*HEADER    TRANSPORT PROTEIN                       29-JUL-10   2L1M              
*TITLE     SOLUTION STRUCTURE OF THE EAG DOMAIN OF THE HERG (KV11.1) K CHANNEL   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: POTASSIUM VOLTAGE-GATED CHANNEL SUBFAMILY H MEMBER 2;      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 1-135;                                        
*COMPND   5 SYNONYM: VOLTAGE-GATED POTASSIUM CHANNEL SUBUNIT KV11.1, ETHER-A-GO- 
*COMPND   6 GO-RELATED GENE POTASSIUM CHANNEL 1, ETHER-A-GO-GO-RELATED PROTEIN 1,
*COMPND   7 EAG-RELATED PROTEIN 1, ERG-1, HERG-1, HERG1, H-ERG, EAG HOMOLOG;     
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: KCNH2, ERG, ERG1, HERG;                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VARIANT: CODONPLUS RIPL;                           
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET-21A                                    
*KEYWDS    EAG DOMAIN, HERG, KV11.1, PAS DOMAIN, TRANSPORT PROTEIN               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    F.W.MUSKETT, J.S.MITCHESON                                            
*REVDAT   1   19-JAN-11 2L1M    0                                                


#
#   3 VAL  HN      3 VAL  HB      4.19             (#peak   786)
 &rst
  ixpk= 786, nxpk= 0, iat=  35,  39, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=1,
 &end
#
#   3 VAL  HN      3 VAL  QQG     3.50             (#peak   789)
 &rst
  ixpk= 789, nxpk= 0, iat=  35,  38, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#   3 VAL  HA      4 ARG  HN      3.09             (#peak   193)
 &rst
  ixpk= 193, nxpk= 0, iat=  37,  51, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#   4 ARG  HN      4 ARG  QB      3.41             (#peak   195)
 &rst
  ixpk= 195, nxpk= 0, iat=  51,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2=  55,  56,
 &end
#
#   4 ARG  HA      4 ARG  HD2     5.35             (#peak    35)
 &rst
  ixpk= 35, nxpk= 0, iat=  53,  61, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   4 ARG  HA      4 ARG  HD3     5.35             (#peak    35)
 &rst
  ixpk= 35, nxpk= 0, iat=  53,  62, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   4 ARG  HA      4 ARG  HG2     4.20             (#peak    34)
 &rst
  ixpk= 34, nxpk= 0, iat=  53,  58, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   4 ARG  HA      4 ARG  HG3     4.20             (#peak    34)
 &rst
  ixpk= 34, nxpk= 0, iat=  53,  59, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   4 ARG  HA      4 ARG  QD      4.61             (#peak    35)
 &rst
  ixpk= 35, nxpk= 0, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr2=  61,  62,
 &end
#
#   4 ARG  HA      4 ARG  QG      3.59             (#peak    34)
 &rst
  ixpk= 34, nxpk= 0, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2=  58,  59,
 &end
#
#   4 ARG  HA      5 ARG  HN      2.98             (#peak    29)
 &rst
  ixpk= 29, nxpk= 0, iat=  53,  75, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
#   4 ARG  HB2     5 ARG  HN      4.67             (#peak   362)
 &rst
  ixpk= 362, nxpk= 0, iat=  55,  75, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   4 ARG  HB3     5 ARG  HN      4.67             (#peak   361)
 &rst
  ixpk= 361, nxpk= 0, iat=  56,  75, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#   4 ARG  HG2     5 ARG  HN      5.50             (#peak   360)
 &rst
  ixpk= 360, nxpk= 0, iat=  58,  75, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   4 ARG  HG3     5 ARG  HN      5.50             (#peak   360)
 &rst
  ixpk= 360, nxpk= 0, iat=  59,  75, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   4 ARG  QB      5 ARG  HN      3.95             (#peak   361)
 &rst
  ixpk= 361, nxpk= 0, iat=  -1,  75, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1=  55,  56,
 &end
#
#   4 ARG  QG      5 ARG  HN      4.82             (#peak   360)
 &rst
  ixpk= 360, nxpk= 0, iat=  -1,  75, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1=  58,  59,
 &end
#
#   5 ARG  HA      6 GLY  HN      3.06             (#peak   402)
 &rst
  ixpk= 402, nxpk= 0, iat=  77,  99, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#   5 ARG  QB      6 GLY  HN      3.96             (#peak   403)
 &rst
  ixpk= 403, nxpk= 0, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  79,  80,
 &end
#
#   7 HIS  HN      7 HIS  QB      3.67             (#peak   399)
 &rst
  ixpk= 399, nxpk= 0, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 110, 111,
 &end
#
#   7 HIS  HN      8 VAL  HN      5.12             (#peak   400)
 &rst
  ixpk= 400, nxpk= 0, iat= 106, 123, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#   7 HIS  HA      8 VAL  HN      3.52             (#peak    42)
 &rst
  ixpk= 42, nxpk= 0, iat= 108, 123, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#   7 HIS  HB2     8 VAL  HN      4.69             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat= 110, 123, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   7 HIS  HB3     8 VAL  HN      4.69             (#peak    50)
 &rst
  ixpk= 50, nxpk= 0, iat= 111, 123, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   7 HIS  HD2     8 VAL  HN      5.00             (#peak  1645)
 &rst
  ixpk= 1645, nxpk= 0, iat= 119, 123, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#   7 HIS  HD2     8 VAL  QQG     5.00             (#peak 1191 )
 &rst
  ixpk= 1191, nxpk= 0, iat= 119, 126, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,  &end
#
#   7 HIS  HD2     9 ALA  HN      4.66             (#peak  1777)
 &rst
  ixpk= 1777, nxpk= 0, iat= 119, 139, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   7 HIS  HD2     9 ALA  HA      4.31             (#peak    68)
 &rst
  ixpk= 68, nxpk= 0, iat= 119, 141, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   7 HIS  QB      8 VAL  HN      4.04             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat=  -1, 123, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 110, 111,
 &end
#
#   8 VAL  HN      8 VAL  HB      3.34             (#peak   394)
 &rst
  ixpk= 394, nxpk= 0, iat= 123, 127, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#   8 VAL  HN      8 VAL  QQG     2.92             (#peak   395)
 &rst
  ixpk= 395, nxpk= 0, iat= 123, 126, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#   8 VAL  HN      9 ALA  HN      4.57             (#peak    29)
 &rst
  ixpk= 29, nxpk= 0, iat= 123, 139, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#   8 VAL  HA      8 VAL  HB      3.30             (#peak 2681 )
 &rst
  ixpk= 2681, nxpk= 0, iat= 125, 127, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#   8 VAL  HA      8 VAL  QQG     2.79             (#peak    54)
 &rst
  ixpk= 54, nxpk= 0, iat= 125, 126, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   8 VAL  HA      9 ALA  HN      2.40             (#peak    31)
 &rst
  ixpk= 31, nxpk= 0, iat= 125, 139, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   8 VAL  HA      9 ALA  QB      4.08             (#peak    56)
 &rst
  ixpk= 56, nxpk= 0, iat= 125,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 143, 144, 145,
 &end
#
#   8 VAL  HB      9 ALA  HN      4.31             (#peak    33)
 &rst
  ixpk= 33, nxpk= 0, iat= 127, 139, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   8 VAL  QQG    10 PRO  HA      6.00             (#peak  84  )
 &rst
  ixpk= 84, nxpk= 0, iat= 126, 159, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,  &end
#
#   8 VAL  QQG    11 GLN  HN      5.50             (#peak 1188 )
 &rst
  ixpk= 1188, nxpk= 0, iat= 126, 163, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#   8 VAL  QQG    11 GLN  HN      5.50             (#peak 1188 )
 &rst
  ixpk= 1188, nxpk= 0, iat= 126, 163, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#   8 VAL  QQG    11 GLN  QG      5.00             (#peak 2203 )
 &rst
  ixpk= 2203, nxpk= 0, iat= 126,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2= 170, 171,
 &end
#
#   8 VAL  QQG     9 ALA  HN      3.33             (#peak    36)
 &rst
  ixpk= 36, nxpk= 0, iat= 126, 139, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#   9 ALA  HN      9 ALA  QB      2.60             (#peak    34)
 &rst
  ixpk= 34, nxpk= 0, iat= 139,  -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
 igr2= 143, 144, 145,
 &end
#
#   9 ALA  HA     10 PRO  HD2     2.77             (#peak    67)
 &rst
  ixpk= 67, nxpk= 0, iat= 141, 150, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27,  &end
#
#   9 ALA  HA     10 PRO  HD3     2.77             (#peak    66)
 &rst
  ixpk= 66, nxpk= 0, iat= 141, 151, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27,  &end
#
#   9 ALA  HA     10 PRO  HG2     5.35             (#peak    65)
 &rst
  ixpk= 65, nxpk= 0, iat= 141, 153, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   9 ALA  HA     10 PRO  HG3     5.35             (#peak    65)
 &rst
  ixpk= 65, nxpk= 0, iat= 141, 154, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   9 ALA  HA     10 PRO  QG      4.59             (#peak    65)
 &rst
  ixpk= 65, nxpk= 0, iat= 141,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 153, 154,
 &end
#
#   9 ALA  QB     10 PRO  HD2     3.81             (#peak  2002)
 &rst
  ixpk= 2002, nxpk= 0, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 143, 144, 145,
 &end
#
#   9 ALA  QB     10 PRO  HD3     3.81             (#peak    79)
 &rst
  ixpk= 79, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 143, 144, 145,
 &end
#
#   9 ALA  QB     10 PRO  QD      3.03             (#peak    79)
 &rst
  ixpk= 79, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 143, 144, 145,
 igr2= 150, 151,
 &end
#
#   9 ALA  QB     11 GLN  HN      5.50   (#peak  76  )
 &rst
  ixpk= 76, nxpk= 0, iat=  -1, 163, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 143, 144, 145,
 &end
#
#   9 ALA  QB     11 GLN  HA      5.50   (#peak 1978 )
 &rst
  ixpk= 1978, nxpk= 0, iat=  -1, 165, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 143, 144, 145,
 &end
#
#  10 PRO  HA     11 GLN  HN      2.56             (#peak    88)
 &rst
  ixpk= 88, nxpk= 0, iat= 159, 163, r1= 1.30, r2= 1.80, r3= 2.56, r4= 3.06,  &end
#
#  10 PRO  HB2    11 GLN  HN      4.17             (#peak   710)
 &rst
  ixpk= 710, nxpk= 0, iat= 156, 163, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  10 PRO  HB2    12 ASN  HN      4.70             (#peak    93)
 &rst
  ixpk= 93, nxpk= 0, iat= 156, 180, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  10 PRO  HB3    11 GLN  HN      4.17             (#peak  1649)
 &rst
  ixpk= 1649, nxpk= 0, iat= 157, 163, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  10 PRO  HB3    12 ASN  HN      4.70             (#peak    94)
 &rst
  ixpk= 94, nxpk= 0, iat= 157, 180, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  10 PRO  QB     11 GLN  HN      3.61             (#peak   710)
 &rst
  ixpk= 710, nxpk= 0, iat=  -1, 163, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 156, 157,
 &end
#
#  11 GLN  HN     11 GLN  HG2     4.57             (#peak   707)
 &rst
  ixpk= 707, nxpk= 0, iat= 163, 170, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  11 GLN  HN     11 GLN  HG3     4.57             (#peak   707)
 &rst
  ixpk= 707, nxpk= 0, iat= 163, 171, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  11 GLN  HN     11 GLN  QB      2.76             (#peak   709)
 &rst
  ixpk= 709, nxpk= 0, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
 igr2= 167, 168,
 &end
#
#  11 GLN  HN     11 GLN  QG      3.92             (#peak   707)
 &rst
  ixpk= 707, nxpk= 0, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 170, 171,
 &end
#
#  11 GLN  HN     12 ASN  HN      3.26             (#peak  1770)
 &rst
  ixpk= 1770, nxpk= 0, iat= 163, 180, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  11 GLN  HN     13 THR  QG2     4.92             (#peak   711)
 &rst
  ixpk= 711, nxpk= 0, iat= 163,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2= 200, 201, 202,
 &end
#
#  11 GLN  HA     11 GLN  QB      2.60             (#peak   103)
 &rst
  ixpk= 103, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 167, 168,
 &end
#
#  11 GLN  HA     11 GLN  QG      3.62             (#peak   105)
 &rst
  ixpk= 105, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 170, 171,
 &end
#
#  11 GLN  HA     12 ASN  HN      5.00             (#peak 777  )
 &rst
  ixpk= 777, nxpk= 0, iat= 165, 180, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  11 GLN  HB2    12 ASN  HN      4.42             (#peak   785)
 &rst
  ixpk= 785, nxpk= 0, iat= 167, 180, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  11 GLN  HB3    12 ASN  HN      4.42             (#peak   786)
 &rst
  ixpk= 786, nxpk= 0, iat= 168, 180, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  11 GLN  HE22   12 ASN  HA      6.00             (#peak 1788 )
 &rst
  ixpk= 1788, nxpk= 0, iat= 176, 182, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  11 GLN  HG2    12 ASN  HN      4.73             (#peak   783)
 &rst
  ixpk= 783, nxpk= 0, iat= 170, 180, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  11 GLN  HG3    12 ASN  HN      4.73             (#peak   783)
 &rst
  ixpk= 783, nxpk= 0, iat= 171, 180, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  11 GLN  QB     12 ASN  HN      3.83             (#peak   785)
 &rst
  ixpk= 785, nxpk= 0, iat=  -1, 180, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1= 167, 168,
 &end
#
#  11 GLN  QG     11 GLN  QE2     3.18             (#peak  1456)
 &rst
  ixpk= 1456, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 170, 171,
 igr2= 175, 176,
 &end
#
#  11 GLN  QG     12 ASN  HN      4.10             (#peak   783)
 &rst
  ixpk= 783, nxpk= 0, iat=  -1, 180, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 170, 171,
 &end
#
#  12 ASN  HN     12 ASN  HB2     3.67             (#peak   780)
 &rst
  ixpk= 780, nxpk= 0, iat= 180, 184, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  12 ASN  HN     12 ASN  HB3     3.67             (#peak   782)
 &rst
  ixpk= 782, nxpk= 0, iat= 180, 185, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  12 ASN  HN     13 THR  HN      3.67             (#peak   775)
 &rst
  ixpk= 775, nxpk= 0, iat= 180, 194, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  12 ASN  HN     13 THR  HB      4.91             (#peak   132)
 &rst
  ixpk= 132, nxpk= 0, iat= 180, 198, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  12 ASN  HN     13 THR  QG2     4.52             (#peak  2026)
 &rst
  ixpk= 2026, nxpk= 0, iat= 180,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 200, 201, 202,
 &end
#
#  12 ASN  HA     12 ASN  QD2     4.74             (#peak  1392)
 &rst
  ixpk= 1392, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 189, 190,
 &end
#
#  12 ASN  HA     13 THR  HA      5.11             (#peak   125)
 &rst
  ixpk= 125, nxpk= 0, iat= 182, 196, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#  12 ASN  HA     13 THR  HB      6.00             (#peak 129  )
 &rst
  ixpk= 129, nxpk= 0, iat= 182, 198, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  12 ASN  HA     13 THR  QG2     5.50             (#peak 2028 )
 &rst
  ixpk= 2028, nxpk= 0, iat= 182,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 200, 201, 202,
 &end
#
#  12 ASN  HA     15 LEU  HN      5.00             (#)
 &rst
  ixpk= 2028, nxpk= 0, iat= 182, 228, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  12 ASN  HB2    12 ASN  HD21    4.08             (#peak   118)
 &rst
  ixpk= 118, nxpk= 0, iat= 184, 189, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  12 ASN  HB2    12 ASN  HD22    4.08             (#peak   121)
 &rst
  ixpk= 121, nxpk= 0, iat= 184, 190, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  12 ASN  HB2    13 THR  HN      4.34             (#peak  1325)
 &rst
  ixpk= 1325, nxpk= 0, iat= 184, 194, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  12 ASN  HB3    12 ASN  HD21    4.08             (#peak  1385)
 &rst
  ixpk= 1385, nxpk= 0, iat= 185, 189, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  12 ASN  HB3    12 ASN  HD22    4.08             (#peak  1381)
 &rst
  ixpk= 1381, nxpk= 0, iat= 185, 190, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  12 ASN  HB3    13 THR  HN      4.34             (#peak  1326)
 &rst
  ixpk= 1326, nxpk= 0, iat= 185, 194, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  12 ASN  QB     12 ASN  QD2     2.97             (#peak  1385)
 &rst
  ixpk= 1385, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
 igr1= 184, 185,
 igr2= 189, 190,
 &end
#
#  12 ASN  QB     13 THR  HN      3.78             (#peak  1326)
 &rst
  ixpk= 1326, nxpk= 0, iat=  -1, 194, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 184, 185,
 &end
#
#  12 ASN  QB     15 LEU  HN      5.00             (#)
 &rst
  ixpk= 1326, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 184, 185,
 &end
#
#  12 ASN  QB     15 LEU  HN      5.00             (#)
 &rst
  ixpk= 1326, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 184, 185,
 &end
#
#  12 ASN  QB     15 LEU  HN      5.34             (#peak  3000)
 &rst
  ixpk= 3000, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 184, 185,
 &end
#
#  12 ASN  QB     16 ASP  HN      5.34             (#peak  1171)
 &rst
  ixpk= 1171, nxpk= 0, iat=  -1, 247, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 184, 185,
 &end
#
#  13 THR  HN     13 THR  HB      3.56             (#peak  1324)
 &rst
  ixpk= 1324, nxpk= 0, iat= 194, 198, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  13 THR  HN     13 THR  QG2     2.93             (#peak  1328)
 &rst
  ixpk= 1328, nxpk= 0, iat= 194,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2= 200, 201, 202,
 &end
#
#  13 THR  HN     15 LEU  HN      4.50             (#peak  1785)
 &rst
  ixpk= 1785, nxpk= 0, iat= 194, 228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  13 THR  HN     15 LEU  HN      5.00             (#)
 &rst
  ixpk= 1785, nxpk= 0, iat= 194, 228, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  13 THR  HN     16 ASP  HN      4.91             (#peak  1322)
 &rst
  ixpk= 1322, nxpk= 0, iat= 194, 247, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  13 THR  HN     16 ASP  HB2     4.98             (#peak   170)
 &rst
  ixpk= 170, nxpk= 0, iat= 194, 251, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  13 THR  HN     16 ASP  HB3 6.00   (#peak 1327 )
 &rst
  ixpk= 1327, nxpk= 0, iat= 194, 252, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  13 THR  HA     13 THR  QG2     3.36             (#peak    98)
 &rst
  ixpk= 98, nxpk= 0, iat= 196,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 200, 201, 202,
 &end
#
#  13 THR  HA     16 ASP  HN      4.49             (#peak   123)
 &rst
  ixpk= 123, nxpk= 0, iat= 196, 247, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  13 THR  HA     16 ASP  HB2     3.96             (#peak   172)
 &rst
  ixpk= 172, nxpk= 0, iat= 196, 251, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  13 THR  HA     16 ASP  HB3     4.15             (#peak   127)
 &rst
  ixpk= 127, nxpk= 0, iat= 196, 252, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  13 THR  HB     14 PHE  HN      4.16             (#peak   130)
 &rst
  ixpk= 130, nxpk= 0, iat= 198, 208, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  13 THR  HB     14 PHE  QB      5.34             (#peak   134)
 &rst
  ixpk= 134, nxpk= 0, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 212, 213,
 &end
#
#  13 THR  HB     15 LEU  HN      6.00             (#peak 131  )
 &rst
  ixpk= 131, nxpk= 0, iat= 198, 228, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  13 THR  QG2    14 PHE  HN      3.80             (#peak   429)
 &rst
  ixpk= 429, nxpk= 0, iat=  -1, 208, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 200, 201, 202,
 &end
#
#  13 THR  QG2    15 LEU  HN      4.30             (#peak   803)
 &rst
  ixpk= 803, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 200, 201, 202,
 &end
#
#  13 THR  QG2    16 ASP  HN      4.93             (#peak  2027)
 &rst
  ixpk= 2027, nxpk= 0, iat=  -1, 247, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1= 200, 201, 202,
 &end
#
#  13 THR  QG2    16 ASP  HB2     5.50             (#peak 2030 )
 &rst
  ixpk= 2030, nxpk= 0, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 200, 201, 202,
 &end
#
#  14 PHE  HN     14 PHE  HB2     3.17             (#peak   424)
 &rst
  ixpk= 424, nxpk= 0, iat= 208, 212, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#  14 PHE  HN     14 PHE  HB3     3.17             (#peak   425)
 &rst
  ixpk= 425, nxpk= 0, iat= 208, 213, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
#  14 PHE  HN     14 PHE  HD      6.02             (#peak   432)
 &rst
  ixpk= 432, nxpk= 0, iat= 208,  -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr2= 216, 224,
 &end
#
#  14 PHE  HN     15 LEU  HN      3.34             (#peak   434)
 &rst
  ixpk= 434, nxpk= 0, iat= 208, 228, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  14 PHE  HN     15 LEU  HB2     5.46             (#peak   430)
 &rst
  ixpk= 430, nxpk= 0, iat= 208, 232, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  14 PHE  HN     15 LEU  HB3     5.00             (#peak   428)
 &rst
  ixpk= 428, nxpk= 0, iat= 208, 233, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  14 PHE  HN     16 ASP  HN      4.37             (#peak  1784)
 &rst
  ixpk= 1784, nxpk= 0, iat= 208, 247, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  14 PHE  HA     14 PHE  HD      5.61             (#peak     4)
 &rst
  ixpk= 4, nxpk= 0, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2= 216, 224,
 &end
#
#  14 PHE  HA     16 ASP  HN      5.00             (#peak  1169)
 &rst
  ixpk= 1169, nxpk= 0, iat= 210, 247, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  14 PHE  HA     17 THR  HN      4.00             (#)
 &rst
  ixpk= 1169, nxpk= 0, iat= 210, 259, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  14 PHE  HA     17 THR  HN      4.14             (#peak     5)
 &rst
  ixpk= 5, nxpk= 0, iat= 210, 259, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  14 PHE  HA     17 THR  HN      5.00             (#peak 135  )
 &rst
  ixpk= 135, nxpk= 0, iat= 210, 259, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  14 PHE  HA     17 THR  HB      4.60             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat= 210, 263, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  14 PHE  HA     17 THR  QG2     5.00             (#peak 2055 )
 &rst
  ixpk= 2055, nxpk= 0, iat= 210,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 265, 266, 267,
 &end
#
#  14 PHE  HB2    15 LEU  HN      3.77             (#peak   798)
 &rst
  ixpk= 798, nxpk= 0, iat= 212, 228, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  14 PHE  HB3    15 LEU  HN      3.77             (#peak   799)
 &rst
  ixpk= 799, nxpk= 0, iat= 213, 228, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  14 PHE  HD     15 LEU  HN      6.56             (#peak   795)
 &rst
  ixpk= 795, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
 igr1= 216, 224,
 &end
#
#  14 PHE  HD     17 THR  QG2     6.88             (#peak  2054)
 &rst
  ixpk= 2054, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.27, r4= 9.77,
 igr1= 216, 224,
 igr2= 265, 266, 267,
 &end
#
#  14 PHE  HD     18 ILE  QD1     7.50             (#peak 2093 )
 &rst
  ixpk= 2093, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1= 216, 224,
 igr2= 286, 287, 288,
 &end
#
#  14 PHE  HD     18 ILE  QG2     7.50             (#peak 2089 )
 &rst
  ixpk= 2089, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1= 216, 224,
 igr2= 279, 280, 281,
 &end
#
#  15 LEU  HN     15 LEU  HB2     3.04             (#peak   801)
 &rst
  ixpk= 801, nxpk= 0, iat= 228, 232, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
#  15 LEU  HN     15 LEU  HB3     3.10             (#peak   800)
 &rst
  ixpk= 800, nxpk= 0, iat= 228, 233, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  15 LEU  HN     15 LEU  HG      4.38             (#peak  2546)
 &rst
  ixpk= 2546, nxpk= 0, iat= 228, 235, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  15 LEU  HN     15 LEU  QD1     4.32             (#peak  2050)
 &rst
  ixpk= 2050, nxpk= 0, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 237, 238, 239,
 &end
#
#  15 LEU  HN     15 LEU  QD2     4.35             (#peak  2031)
 &rst
  ixpk= 2031, nxpk= 0, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 241, 242, 243,
 &end
#
#  15 LEU  HN     16 ASP  HN      3.23             (#peak  1164)
 &rst
  ixpk= 1164, nxpk= 0, iat= 228, 247, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  15 LEU  HN     17 THR  HN      4.51             (#peak  1783)
 &rst
  ixpk= 1783, nxpk= 0, iat= 228, 259, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  15 LEU  HN     17 THR  HN      5.00             (#)
 &rst
  ixpk= 1783, nxpk= 0, iat= 228, 259, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  15 LEU  HA     15 LEU  QD1     3.01             (#peak  2036)
 &rst
  ixpk= 2036, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2= 237, 238, 239,
 &end
#
#  15 LEU  HA     15 LEU  QD2     4.13             (#peak  2034)
 &rst
  ixpk= 2034, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 241, 242, 243,
 &end
#
#  15 LEU  HA     18 ILE  HN      3.80             (#peak   522)
 &rst
  ixpk= 522, nxpk= 0, iat= 230, 273, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  15 LEU  HA     18 ILE  HB      3.71             (#peak   136)
 &rst
  ixpk= 136, nxpk= 0, iat= 230, 277, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  15 LEU  HA     18 ILE  HG12    4.43             (#peak  2075)
 &rst
  ixpk= 2075, nxpk= 0, iat= 230, 283, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  15 LEU  HA     18 ILE  HG13    4.35             (#peak   139)
 &rst
  ixpk= 139, nxpk= 0, iat= 230, 284, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  15 LEU  HA     18 ILE  QD1     4.52             (#peak   141)
 &rst
  ixpk= 141, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 286, 287, 288,
 &end
#
#  15 LEU  HA     18 ILE  QG2     4.64             (#peak  2080)
 &rst
  ixpk= 2080, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 279, 280, 281,
 &end
#
#  15 LEU  HA     19 ILE  HN      4.80             (#peak  2998)
 &rst
  ixpk= 2998, nxpk= 0, iat= 230, 292, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#  15 LEU  HB2    15 LEU  QD1     3.16             (#peak  2039)
 &rst
  ixpk= 2039, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 237, 238, 239,
 &end
#
#  15 LEU  HB2    15 LEU  QD2     3.17             (#peak  1010)
 &rst
  ixpk= 1010, nxpk= 0, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 241, 242, 243,
 &end
#
#  15 LEU  HB2    16 ASP  HN      4.58             (#peak   148)
 &rst
  ixpk= 148, nxpk= 0, iat= 232, 247, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  15 LEU  HB3    15 LEU  QD1     3.29             (#peak  2038)
 &rst
  ixpk= 2038, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 237, 238, 239,
 &end
#
#  15 LEU  HB3    15 LEU  QD2     3.02             (#peak  1009)
 &rst
  ixpk= 1009, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 241, 242, 243,
 &end
#
#  15 LEU  HB3    16 ASP  HN      3.32             (#peak  1174)
 &rst
  ixpk= 1174, nxpk= 0, iat= 233, 247, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  15 LEU  HG     16 ASP  HN      3.93             (#peak  1175)
 &rst
  ixpk= 1175, nxpk= 0, iat= 235, 247, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  15 LEU  HG     16 ASP  HA      4.05             (#peak  2896)
 &rst
  ixpk= 2896, nxpk= 0, iat= 235, 249, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  15 LEU  HG     17 THR  HN      5.38             (#peak  1348)
 &rst
  ixpk= 1348, nxpk= 0, iat= 235, 259, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#  15 LEU  HG     18 ILE  HN      5.00             (#peak   518)
 &rst
  ixpk= 518, nxpk= 0, iat= 235, 273, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  15 LEU  HG     19 ILE  QD1     3.27             (#peak  2670)
 &rst
  ixpk= 2670, nxpk= 0, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 305, 306, 307,
 &end
#
#  15 LEU  QD1    16 ASP  HN      4.47             (#peak  2048)
 &rst
  ixpk= 2048, nxpk= 0, iat=  -1, 247, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    17 THR  HN      5.07             (#peak  2049)
 &rst
  ixpk= 2049, nxpk= 0, iat=  -1, 259, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    18 ILE  HN      4.66             (#peak  2047)
 &rst
  ixpk= 2047, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    18 ILE  HB      3.29             (#peak  2037)
 &rst
  ixpk= 2037, nxpk= 0, iat=  -1, 277, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    18 ILE  HG13    3.15             (#peak  2040)
 &rst
  ixpk= 2040, nxpk= 0, iat=  -1, 284, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    19 ILE  HA      4.26             (#peak  2043)
 &rst
  ixpk= 2043, nxpk= 0, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 237, 238, 239,
 &end
#
#  15 LEU  QD1    19 ILE  QD1     3.10             (#peak  2041)
 &rst
  ixpk= 2041, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 237, 238, 239,
 igr2= 305, 306, 307,
 &end
#
#  15 LEU  QD1    22 PHE  HD      6.10             (#peak  2045)
 &rst
  ixpk= 2045, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.22, r4= 8.72,
 igr1= 237, 238, 239,
 igr2= 365, 373,
 &end
#
#  15 LEU  QD2    16 ASP  HN      4.67             (#peak  2032)
 &rst
  ixpk= 2032, nxpk= 0, iat=  -1, 247, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 241, 242, 243,
 &end
#
#  15 LEU  QD2    19 ILE  QD1     3.17             (#peak  1011)
 &rst
  ixpk= 1011, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 241, 242, 243,
 igr2= 305, 306, 307,
 &end
#
#  15 LEU  QD2    22 PHE  HD      7.00             (#peak  2033)
 &rst
  ixpk= 2033, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 241, 242, 243,
 igr2= 365, 373,
 &end
#
#  16 ASP  HN     16 ASP  HB2     2.96             (#peak  1172)
 &rst
  ixpk= 1172, nxpk= 0, iat= 247, 251, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#  16 ASP  HN     16 ASP  HB3     3.20             (#peak  1173)
 &rst
  ixpk= 1173, nxpk= 0, iat= 247, 252, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  16 ASP  HN     17 THR  HN      3.14             (#peak  1338)
 &rst
  ixpk= 1338, nxpk= 0, iat= 247, 259, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  16 ASP  HN     18 ILE  HN      4.33             (#peak   525)
 &rst
  ixpk= 525, nxpk= 0, iat= 247, 273, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  16 ASP  HN     19 ILE  HG13    5.18             (#peak  1179)
 &rst
  ixpk= 1179, nxpk= 0, iat= 247, 303, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  16 ASP  HN     19 ILE  QD1     4.92             (#peak  2677)
 &rst
  ixpk= 2677, nxpk= 0, iat= 247,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2= 305, 306, 307,
 &end
#
#  16 ASP  HA     18 ILE  HB      5.50             (#peak   205)
 &rst
  ixpk= 205, nxpk= 0, iat= 249, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  16 ASP  HA     19 ILE  HN      3.70             (#peak  1644)
 &rst
  ixpk= 1644, nxpk= 0, iat= 249, 292, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  16 ASP  HA     19 ILE  HB      3.76             (#peak   157)
 &rst
  ixpk= 157, nxpk= 0, iat= 249, 296, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  16 ASP  HA     19 ILE  HG12    4.42             (#peak   159)
 &rst
  ixpk= 159, nxpk= 0, iat= 249, 302, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  16 ASP  HA     19 ILE  HG13    4.26             (#peak   162)
 &rst
  ixpk= 162, nxpk= 0, iat= 249, 303, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  16 ASP  HA     19 ILE  QD1     5.00             (#peak   161)
 &rst
  ixpk= 161, nxpk= 0, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 305, 306, 307,
 &end
#
#  16 ASP  HA     19 ILE  QG2     4.28             (#peak  2652)
 &rst
  ixpk= 2652, nxpk= 0, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 298, 299, 300,
 &end
#
#  16 ASP  HA     20 ARG  HN      5.50             (#peak  1261)
 &rst
  ixpk= 1261, nxpk= 0, iat= 249, 311, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  16 ASP  HB2    17 THR  HN      3.79             (#peak  1342)
 &rst
  ixpk= 1342, nxpk= 0, iat= 251, 259, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  16 ASP  HB2    19 ILE  HN      6.00             (#peak 1748 )
 &rst
  ixpk= 1748, nxpk= 0, iat= 251, 292, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  16 ASP  HB3    17 THR  HN      3.71             (#peak  1343)
 &rst
  ixpk= 1343, nxpk= 0, iat= 252, 259, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  17 THR  HN     17 THR  HB      2.93             (#peak  1340)
 &rst
  ixpk= 1340, nxpk= 0, iat= 259, 263, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
#  17 THR  HN     17 THR  QG2     3.85             (#peak  1345)
 &rst
  ixpk= 1345, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2= 265, 266, 267,
 &end
#
#  17 THR  HN     18 ILE  HN      3.09             (#peak  1337)
 &rst
  ixpk= 1337, nxpk= 0, iat= 259, 273, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#  17 THR  HN     18 ILE  HB      4.95             (#peak   208)
 &rst
  ixpk= 208, nxpk= 0, iat= 259, 277, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  17 THR  HN     18 ILE  HG12    4.60             (#peak  1346)
 &rst
  ixpk= 1346, nxpk= 0, iat= 259, 283, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  17 THR  HN     18 ILE  QG2     6.00             (#peak 1352 )
 &rst
  ixpk= 1352, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 279, 280, 281,
 &end
#
#  17 THR  HN     19 ILE  HN      4.03             (#peak  1336)
 &rst
  ixpk= 1336, nxpk= 0, iat= 259, 292, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  17 THR  HN     19 ILE  HB      5.47             (#peak  1349)
 &rst
  ixpk= 1349, nxpk= 0, iat= 259, 296, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  17 THR  HA     17 THR  QG2     2.85             (#peak  2058)
 &rst
  ixpk= 2058, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 265, 266, 267,
 &end
#
#  17 THR  HA     19 ILE  HB      5.00             (#peak  2641)
 &rst
  ixpk= 2641, nxpk= 0, iat= 261, 296, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  17 THR  HA     20 ARG  HN      4.00             (#)
 &rst
  ixpk= 2641, nxpk= 0, iat= 261, 311, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  17 THR  HA     20 ARG  HD2     5.50             (#peak 177  )
 &rst
  ixpk= 177, nxpk= 0, iat= 261, 321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 THR  HA     20 ARG  QB      5.50             (#peak 178  )
 &rst
  ixpk= 178, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 315, 316,
 &end
#
#  17 THR  HA     20 ARG  QG      5.34             (#peak   179)
 &rst
  ixpk= 179, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 318, 319,
 &end
#
#  17 THR  HA     21 LYS  HN      5.50             (#peak 183  )
 &rst
  ixpk= 183, nxpk= 0, iat= 261, 335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 THR  HB     18 ILE  HN      3.49             (#peak   523)
 &rst
  ixpk= 523, nxpk= 0, iat= 263, 273, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  17 THR  HB     18 ILE  HA      4.77             (#peak   199)
 &rst
  ixpk= 199, nxpk= 0, iat= 263, 275, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#  17 THR  HB     18 ILE  HB      5.50             (#peak   205)
 &rst
  ixpk= 205, nxpk= 0, iat= 263, 277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  17 THR  HB     18 ILE  QD1     4.47             (#peak  2095)
 &rst
  ixpk= 2095, nxpk= 0, iat= 263,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 286, 287, 288,
 &end
#
#  17 THR  HB     20 ARG  HN      6.00             (#)
 &rst
  ixpk= 2095, nxpk= 0, iat= 263, 311, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  17 THR  QG2    18 ILE  HN      3.94             (#peak  2053)
 &rst
  ixpk= 2053, nxpk= 0, iat=  -1, 273, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 265, 266, 267,
 &end
#
#  17 THR  QG2    18 ILE  HA      3.71             (#peak  2059)
 &rst
  ixpk= 2059, nxpk= 0, iat=  -1, 275, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 265, 266, 267,
 &end
#
#  18 ILE  HN     18 ILE  HB      2.99             (#peak   520)
 &rst
  ixpk= 520, nxpk= 0, iat= 273, 277, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  18 ILE  HN     18 ILE  HG12    3.30             (#peak   515)
 &rst
  ixpk= 515, nxpk= 0, iat= 273, 283, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  18 ILE  HN     18 ILE  HG13    4.30             (#peak  2073)
 &rst
  ixpk= 2073, nxpk= 0, iat= 273, 284, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#  18 ILE  HN     18 ILE  QD1     3.75             (#peak   513)
 &rst
  ixpk= 513, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 286, 287, 288,
 &end
#
#  18 ILE  HN     18 ILE  QG2     3.89             (#peak   514)
 &rst
  ixpk= 514, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 279, 280, 281,
 &end
#
#  18 ILE  HN     19 ILE  HN      3.29             (#peak   526)
 &rst
  ixpk= 526, nxpk= 0, iat= 273, 292, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  18 ILE  HN     19 ILE  HB      4.79             (#peak   519)
 &rst
  ixpk= 519, nxpk= 0, iat= 273, 296, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  18 ILE  HN     19 ILE  HG12    4.42             (#peak   517)
 &rst
  ixpk= 517, nxpk= 0, iat= 273, 302, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  18 ILE  HN     19 ILE  QD1     5.00             (#peak  2675)
 &rst
  ixpk= 2675, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 305, 306, 307,
 &end
#
#  18 ILE  HA     18 ILE  HG12    4.14             (#peak   195)
 &rst
  ixpk= 195, nxpk= 0, iat= 275, 283, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  18 ILE  HA     18 ILE  QD1     3.26             (#peak  2097)
 &rst
  ixpk= 2097, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 286, 287, 288,
 &end
#
#  18 ILE  HA     18 ILE  QG2     3.24             (#peak  2078)
 &rst
  ixpk= 2078, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 279, 280, 281,
 &end
#
#  18 ILE  HA     20 ARG  HN      4.50             (#peak   202)
 &rst
  ixpk= 202, nxpk= 0, iat= 275, 311, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  18 ILE  HA     21 LYS  HN      3.85             (#peak  1026)
 &rst
  ixpk= 1026, nxpk= 0, iat= 275, 335, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  18 ILE  HA     21 LYS  HA      5.34             (#peak   198)
 &rst
  ixpk= 198, nxpk= 0, iat= 275, 337, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  18 ILE  HA     21 LYS  HB2     4.22             (#peak   262)
 &rst
  ixpk= 262, nxpk= 0, iat= 275, 339, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  18 ILE  HA     21 LYS  HB3     4.44             (#peak   192)
 &rst
  ixpk= 192, nxpk= 0, iat= 275, 340, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  18 ILE  HA     21 LYS  QD      4.26             (#peak   193)
 &rst
  ixpk= 193, nxpk= 0, iat= 275,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 345, 346,
 &end
#
#  18 ILE  HB     18 ILE  QD1     3.41             (#peak  2098)
 &rst
  ixpk= 2098, nxpk= 0, iat= 277,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 286, 287, 288,
 &end
#
#  18 ILE  HB     19 ILE  HN      3.47             (#peak   727)
 &rst
  ixpk= 727, nxpk= 0, iat= 277, 292, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  18 ILE  HB     19 ILE  HG12    4.54             (#peak   215)
 &rst
  ixpk= 215, nxpk= 0, iat= 277, 302, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  18 ILE  HG12   19 ILE  HN      4.35             (#peak   761)
 &rst
  ixpk= 761, nxpk= 0, iat= 283, 292, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  18 ILE  HG12   19 ILE  HN      5.50             (#peak 732  )
 &rst
  ixpk= 732, nxpk= 0, iat= 283, 292, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  18 ILE  QD1    19 ILE  HN      4.77             (#peak  1749)
 &rst
  ixpk= 1749, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 286, 287, 288,
 &end
#
#  18 ILE  QD1    21 LYS  HB2     4.01             (#peak  2099)
 &rst
  ixpk= 2099, nxpk= 0, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 286, 287, 288,
 &end
#
#  18 ILE  QD1    21 LYS  QD      4.00             (#peak  2100)
 &rst
  ixpk= 2100, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 286, 287, 288,
 igr2= 345, 346,
 &end
#
#  18 ILE  QG2    18 ILE  HG12    3.49             (#peak  2083)
 &rst
  ixpk= 2083, nxpk= 0, iat=  -1, 283, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    18 ILE  HG13    3.38             (#peak  2082)
 &rst
  ixpk= 2082, nxpk= 0, iat=  -1, 284, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    19 ILE  HN      4.19             (#peak  2085)
 &rst
  ixpk= 2085, nxpk= 0, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    19 ILE  HA      4.40             (#peak  2079)
 &rst
  ixpk= 2079, nxpk= 0, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    20 ARG  HN      5.47             (#peak  2086)
 &rst
  ixpk= 2086, nxpk= 0, iat=  -1, 311, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    21 LYS  HB3     4.15             (#peak  2081)
 &rst
  ixpk= 2081, nxpk= 0, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    22 PHE  HN      4.33             (#peak  1190)
 &rst
  ixpk= 1190, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 279, 280, 281,
 &end
#
#  18 ILE  QG2    22 PHE  HD      5.70             (#peak  2091)
 &rst
  ixpk= 2091, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
 igr1= 279, 280, 281,
 igr2= 365, 373,
 &end
#
#  19 ILE  HN     19 ILE  HB      3.14             (#peak   728)
 &rst
  ixpk= 728, nxpk= 0, iat= 292, 296, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  19 ILE  HN     19 ILE  HG12    3.39             (#peak   730)
 &rst
  ixpk= 730, nxpk= 0, iat= 292, 302, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  19 ILE  HN     19 ILE  HG13    3.85             (#peak   734)
 &rst
  ixpk= 734, nxpk= 0, iat= 292, 303, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  19 ILE  HN     19 ILE  QD1     3.51             (#peak   733)
 &rst
  ixpk= 733, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 305, 306, 307,
 &end
#
#  19 ILE  HN     19 ILE  QG2     3.77             (#peak   731)
 &rst
  ixpk= 731, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 298, 299, 300,
 &end
#
#  19 ILE  HN     20 ARG  HN      3.34             (#peak  1258)
 &rst
  ixpk= 1258, nxpk= 0, iat= 292, 311, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  19 ILE  HN     20 ARG  HE      5.50             (#peak  1779)
 &rst
  ixpk= 1779, nxpk= 0, iat= 292, 324, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  19 ILE  HN     20 ARG  QB      5.34             (#peak   729)
 &rst
  ixpk= 729, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 315, 316,
 &end
#
#  19 ILE  HN     21 LYS  HN      4.44             (#peak  1021)
 &rst
  ixpk= 1021, nxpk= 0, iat= 292, 335, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  19 ILE  HN     22 PHE  HD      6.55             (#peak   718)
 &rst
  ixpk= 718, nxpk= 0, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr2= 365, 373,
 &end
#
#  19 ILE  HA     19 ILE  HG13    4.06             (#peak   226)
 &rst
  ixpk= 226, nxpk= 0, iat= 294, 303, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  19 ILE  HA     19 ILE  QD1     3.67             (#peak  2666)
 &rst
  ixpk= 2666, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 305, 306, 307,
 &end
#
#  19 ILE  HA     19 ILE  QG2     3.20             (#peak  2133)
 &rst
  ixpk= 2133, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 298, 299, 300,
 &end
#
#  19 ILE  HA     20 ARG  HA      5.47             (#peak   237)
 &rst
  ixpk= 237, nxpk= 0, iat= 294, 313, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  19 ILE  HA     21 LYS  HN      4.15             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat= 294, 335, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  19 ILE  HA     21 LYS  HN      5.00             (#)
 &rst
  ixpk= 218, nxpk= 0, iat= 294, 335, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  19 ILE  HA     23 GLU  HN      5.00             (#)
 &rst
  ixpk= 218, nxpk= 0, iat= 294, 377, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  19 ILE  HA     23 GLU  HB2     4.68             (#peak   220)
 &rst
  ixpk= 220, nxpk= 0, iat= 294, 381, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  19 ILE  HB     19 ILE  QD1     3.30             (#peak  2669)
 &rst
  ixpk= 2669, nxpk= 0, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 305, 306, 307,
 &end
#
#  19 ILE  HB     20 ARG  HN      3.28             (#peak  1269)
 &rst
  ixpk= 1269, nxpk= 0, iat= 296, 311, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
#  19 ILE  HB     23 GLU  HB2     4.64             (#peak  2638)
 &rst
  ixpk= 2638, nxpk= 0, iat= 296, 381, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  19 ILE  HG12   20 ARG  HN      4.58             (#peak  1270)
 &rst
  ixpk= 1270, nxpk= 0, iat= 302, 311, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  19 ILE  HG13   20 ARG  HN      5.08             (#peak  1275)
 &rst
  ixpk= 1275, nxpk= 0, iat= 303, 311, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#  19 ILE  QD1    20 ARG  HN      4.71             (#peak  2676)
 &rst
  ixpk= 2676, nxpk= 0, iat=  -1, 311, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 305, 306, 307,
 &end
#
#  19 ILE  QD1    22 PHE  HD      5.92             (#peak  2674)
 &rst
  ixpk= 2674, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
 igr1= 305, 306, 307,
 igr2= 365, 373,
 &end
#
#  19 ILE  QD1    23 GLU  HA      5.25             (#peak  2668)
 &rst
  ixpk= 2668, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 305, 306, 307,
 &end
#
#  19 ILE  QG2    19 ILE  HG12    3.60             (#peak  2656)
 &rst
  ixpk= 2656, nxpk= 0, iat=  -1, 302, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    19 ILE  HG13    3.30             (#peak  2658)
 &rst
  ixpk= 2658, nxpk= 0, iat=  -1, 303, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    19 ILE  QD1     2.81             (#peak  2672)
 &rst
  ixpk= 2672, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 298, 299, 300,
 igr2= 305, 306, 307,
 &end
#
#  19 ILE  QG2    20 ARG  HN      3.41             (#peak  1272)
 &rst
  ixpk= 1272, nxpk= 0, iat=  -1, 311, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    20 ARG  HA      3.87             (#peak   246)
 &rst
  ixpk= 246, nxpk= 0, iat=  -1, 313, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    22 PHE  HD      6.23             (#peak  2661)
 &rst
  ixpk= 2661, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
 igr1= 298, 299, 300,
 igr2= 365, 373,
 &end
#
#  19 ILE  QG2    23 GLU  HA      4.57             (#peak  2659)
 &rst
  ixpk= 2659, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    23 GLU  HB2     4.54             (#peak   302)
 &rst
  ixpk= 302, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    23 GLU  HB3     4.32             (#peak   301)
 &rst
  ixpk= 301, nxpk= 0, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    23 GLU  HG2     4.80             (#peak  2802)
 &rst
  ixpk= 2802, nxpk= 0, iat=  -1, 384, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 298, 299, 300,
 &end
#
#  19 ILE  QG2    23 GLU  HG3     4.80             (#peak  2654)
 &rst
  ixpk= 2654, nxpk= 0, iat=  -1, 385, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 298, 299, 300,
 &end
#
#  20 ARG  HN     20 ARG  QB      2.70             (#peak  1268)
 &rst
  ixpk= 1268, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
 igr2= 315, 316,
 &end
#
#  20 ARG  HN     20 ARG  QG      3.39             (#peak  1269)
 &rst
  ixpk= 1269, nxpk= 0, iat= 311,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 318, 319,
 &end
#
#  20 ARG  HN     21 LYS  HN      3.03             (#peak  1020)
 &rst
  ixpk= 1020, nxpk= 0, iat= 311, 335, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  20 ARG  HN     22 PHE  HN      5.00             (#)
 &rst
  ixpk= 1020, nxpk= 0, iat= 311, 357, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  20 ARG  HN     23 GLU  HA      6.00             (#peak 587  )
 &rst
  ixpk= 587, nxpk= 0, iat= 311, 379, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  20 ARG  HA     20 ARG  HD2     5.50             (#peak  2768)
 &rst
  ixpk= 2768, nxpk= 0, iat= 313, 321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  20 ARG  HA     20 ARG  HD3     5.50             (#peak  2768)
 &rst
  ixpk= 2768, nxpk= 0, iat= 313, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  20 ARG  HA     20 ARG  HG2     3.98             (#peak  2135)
 &rst
  ixpk= 2135, nxpk= 0, iat= 313, 318, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  20 ARG  HA     20 ARG  HG3     3.98             (#peak   244)
 &rst
  ixpk= 244, nxpk= 0, iat= 313, 319, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  20 ARG  HA     20 ARG  QG      3.13             (#peak   244)
 &rst
  ixpk= 244, nxpk= 0, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2= 318, 319,
 &end
#
#  20 ARG  HA     23 GLU  HN      3.94             (#peak   233)
 &rst
  ixpk= 233, nxpk= 0, iat= 313, 377, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  20 ARG  HA     23 GLU  HA      4.96             (#peak   589)
 &rst
  ixpk= 589, nxpk= 0, iat= 313, 379, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#  20 ARG  HA     23 GLU  HB2     4.15             (#peak   294)
 &rst
  ixpk= 294, nxpk= 0, iat= 313, 381, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  20 ARG  HA     23 GLU  HB3     3.12             (#peak   241)
 &rst
  ixpk= 241, nxpk= 0, iat= 313, 382, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  20 ARG  HA     23 GLU  HG2     4.98             (#peak  2189)
 &rst
  ixpk= 2189, nxpk= 0, iat= 313, 384, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  20 ARG  HA     23 GLU  HG3     4.98             (#peak  2187)
 &rst
  ixpk= 2187, nxpk= 0, iat= 313, 385, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  20 ARG  HA     23 GLU  QG      4.28             (#peak  2187)
 &rst
  ixpk= 2187, nxpk= 0, iat= 313,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 384, 385,
 &end
#
#  20 ARG  HE     21 LYS  HN      5.33             (#peak  1022)
 &rst
  ixpk= 1022, nxpk= 0, iat= 324, 335, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#  20 ARG  QB     20 ARG  HE      4.28             (#peak  1679)
 &rst
  ixpk= 1679, nxpk= 0, iat=  -1, 324, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 315, 316,
 &end
#
#  20 ARG  QB     21 LYS  HN      3.23             (#peak  1028)
 &rst
  ixpk= 1028, nxpk= 0, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr1= 315, 316,
 &end
#
#  20 ARG  QB     23 GLU  HN      5.00             (#)
 &rst
  ixpk= 1028, nxpk= 0, iat=  -1, 377, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 315, 316,
 &end
#
#  20 ARG  QB     23 GLU  HN      5.34             (#peak   729)
 &rst
  ixpk= 729, nxpk= 0, iat=  -1, 377, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 315, 316,
 &end
#
#  20 ARG  QD     23 GLU  HB2     5.50             (#peak 2612 )
 &rst
  ixpk= 2612, nxpk= 0, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 321, 322,
 &end
#
#  21 LYS  HN     21 LYS  HB2     2.85             (#peak  1029)
 &rst
  ixpk= 1029, nxpk= 0, iat= 335, 339, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
#  21 LYS  HN     21 LYS  HB3     3.22             (#peak  1030)
 &rst
  ixpk= 1030, nxpk= 0, iat= 335, 340, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#  21 LYS  HN     21 LYS  HD2     4.69             (#peak  1031)
 &rst
  ixpk= 1031, nxpk= 0, iat= 335, 345, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  21 LYS  HN     21 LYS  HD3     4.69             (#peak  2160)
 &rst
  ixpk= 2160, nxpk= 0, iat= 335, 346, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  21 LYS  HN     21 LYS  HG2     4.98             (#peak  2151)
 &rst
  ixpk= 2151, nxpk= 0, iat= 335, 342, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  21 LYS  HN     21 LYS  HG3     4.98             (#peak  1032)
 &rst
  ixpk= 1032, nxpk= 0, iat= 335, 343, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  21 LYS  HN     21 LYS  QD      4.06             (#peak  2160)
 &rst
  ixpk= 2160, nxpk= 0, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 345, 346,
 &end
#
#  21 LYS  HN     21 LYS  QE      6.00             (#peak 2185 )
 &rst
  ixpk= 2185, nxpk= 0, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 348, 349,
 &end
#
#  21 LYS  HN     21 LYS  QG      4.15             (#peak  1032)
 &rst
  ixpk= 1032, nxpk= 0, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2= 342, 343,
 &end
#
#  21 LYS  HN     22 PHE  HN      3.07             (#peak  1181)
 &rst
  ixpk= 1181, nxpk= 0, iat= 335, 357, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
#  21 LYS  HN     22 PHE  HD      6.70             (#peak  1023)
 &rst
  ixpk= 1023, nxpk= 0, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
 igr2= 365, 373,
 &end
#
#  21 LYS  HN     23 GLU  HN      4.68             (#peak  1021)
 &rst
  ixpk= 1021, nxpk= 0, iat= 335, 377, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  21 LYS  HN     23 GLU  HB2     4.72             (#peak  1027)
 &rst
  ixpk= 1027, nxpk= 0, iat= 335, 381, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  21 LYS  HA     21 LYS  HB2     3.02             (#peak   258)
 &rst
  ixpk= 258, nxpk= 0, iat= 337, 339, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  21 LYS  HA     21 LYS  HB3     3.02             (#peak   259)
 &rst
  ixpk= 259, nxpk= 0, iat= 337, 340, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  21 LYS  HA     21 LYS  HD2     4.35             (#peak   257)
 &rst
  ixpk= 257, nxpk= 0, iat= 337, 345, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  21 LYS  HA     21 LYS  HD3     4.35             (#peak  2163)
 &rst
  ixpk= 2163, nxpk= 0, iat= 337, 346, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  21 LYS  HA     21 LYS  QD      3.79             (#peak   257)
 &rst
  ixpk= 257, nxpk= 0, iat= 337,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 345, 346,
 &end
#
#  21 LYS  HA     21 LYS  QG      3.34             (#peak   256)
 &rst
  ixpk= 256, nxpk= 0, iat= 337,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr2= 342, 343,
 &end
#
#  21 LYS  HA     23 GLU  HN      4.68             (#peak  2997)
 &rst
  ixpk= 2997, nxpk= 0, iat= 337, 377, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  21 LYS  HA     23 GLU  HN      5.00             (#)
 &rst
  ixpk= 2997, nxpk= 0, iat= 337, 377, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  21 LYS  HB2    21 LYS  QD      3.56             (#peak   266)
 &rst
  ixpk= 266, nxpk= 0, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2= 345, 346,
 &end
#
#  21 LYS  HB2    22 PHE  HN      3.74             (#peak  1188)
 &rst
  ixpk= 1188, nxpk= 0, iat= 339, 357, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  21 LYS  HB3    21 LYS  HB3     5.00             (#peak 2179 )
#This appears to be self-referential: ignoring
#
#  21 LYS  HB3    21 LYS  QD      3.55             (#peak   267)
 &rst
  ixpk= 267, nxpk= 0, iat= 340,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 345, 346,
 &end
#
#  21 LYS  HB3    22 PHE  HN      3.38             (#peak  1187)
 &rst
  ixpk= 1187, nxpk= 0, iat= 340, 357, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  21 LYS  HB3    22 PHE  HA      4.32             (#peak   280)
 &rst
  ixpk= 280, nxpk= 0, iat= 340, 359, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  21 LYS  HG2    22 PHE  HN      5.43             (#peak  2152)
 &rst
  ixpk= 2152, nxpk= 0, iat= 342, 357, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#  21 LYS  HG3    22 PHE  HN      5.43             (#peak  2152)
 &rst
  ixpk= 2152, nxpk= 0, iat= 343, 357, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#  21 LYS  QE     22 PHE  HD      8.00             (#peak 2182 )
 &rst
  ixpk= 2182, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 348, 349,
 igr2= 365, 373,
 &end
#
#  21 LYS  QG     21 LYS  QE      3.30             (#peak  2177)
 &rst
  ixpk= 2177, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 342, 343,
 igr2= 348, 349,
 &end
#
#  21 LYS  QG     22 PHE  HN      4.67             (#peak  2152)
 &rst
  ixpk= 2152, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 342, 343,
 &end
#
#  22 PHE  HN     22 PHE  HB3     3.15             (#peak  1186)
 &rst
  ixpk= 1186, nxpk= 0, iat= 357, 362, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  22 PHE  HN     22 PHE  HD      5.62             (#peak  1182)
 &rst
  ixpk= 1182, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr2= 365, 373,
 &end
#
#  22 PHE  HN     23 GLU  HN      3.23             (#peak  1180)
 &rst
  ixpk= 1180, nxpk= 0, iat= 357, 377, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  22 PHE  HN     23 GLU  HB3     5.10             (#peak  1185)
 &rst
  ixpk= 1185, nxpk= 0, iat= 357, 382, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#  22 PHE  HA     22 PHE  HD      5.93             (#peak   274)
 &rst
  ixpk= 274, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr2= 365, 373,
 &end
#
#  22 PHE  HD     23 GLU  HN      6.93             (#peak   718)
 &rst
  ixpk= 718, nxpk= 0, iat=  -1, 377, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 365, 373,
 &end
#
#  22 PHE  HD     23 GLU  HA      6.65             (#peak   286)
 &rst
  ixpk= 286, nxpk= 0, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
 igr1= 365, 373,
 &end
#
#  23 GLU  HN     23 GLU  HB2     3.13             (#peak   726)
 &rst
  ixpk= 726, nxpk= 0, iat= 377, 381, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#  23 GLU  HN     23 GLU  HB3     3.25             (#peak   725)
 &rst
  ixpk= 725, nxpk= 0, iat= 377, 382, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,  &end
#
#  23 GLU  HN     23 GLU  HG2     4.81             (#peak  2191)
 &rst
  ixpk= 2191, nxpk= 0, iat= 377, 384, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  23 GLU  HN     23 GLU  HG3     4.81             (#peak   724)
 &rst
  ixpk= 724, nxpk= 0, iat= 377, 385, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  23 GLU  HN     23 GLU  QG      4.18             (#peak  2191)
 &rst
  ixpk= 2191, nxpk= 0, iat= 377,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 384, 385,
 &end
#
#  23 GLU  HN     24 GLY  HN      3.94             (#peak   715)
 &rst
  ixpk= 715, nxpk= 0, iat= 377, 392, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  23 GLU  HA     24 GLY  HN      3.52             (#peak   285)
 &rst
  ixpk= 285, nxpk= 0, iat= 379, 392, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  23 GLU  HA     24 GLY  QA      5.23             (#peak   589)
 &rst
  ixpk= 589, nxpk= 0, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 394, 395,
 &end
#
#  23 GLU  HB2    24 GLY  HN      4.33             (#peak  1530)
 &rst
  ixpk= 1530, nxpk= 0, iat= 381, 392, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  23 GLU  HB3    24 GLY  HN      3.80             (#peak  1529)
 &rst
  ixpk= 1529, nxpk= 0, iat= 382, 392, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  23 GLU  HG2    24 GLY  HN      5.04             (#peak  2192)
 &rst
  ixpk= 2192, nxpk= 0, iat= 384, 392, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  23 GLU  HG3    24 GLY  HN      5.04             (#peak  1528)
 &rst
  ixpk= 1528, nxpk= 0, iat= 385, 392, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  23 GLU  QG     24 GLY  HN      4.23             (#peak  2192)
 &rst
  ixpk= 2192, nxpk= 0, iat=  -1, 392, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 384, 385,
 &end
#
#  23 GLU  QG     24 GLY  QA      4.71             (#peak  2187)
 &rst
  ixpk= 2187, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 384, 385,
 igr2= 394, 395,
 &end
#
#  24 GLY  HN     25 GLN  HN      3.96             (#peak  1089)
 &rst
  ixpk= 1089, nxpk= 0, iat= 392, 399, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  25 GLN  HN     25 GLN  HB2     3.70             (#peak  1082)
 &rst
  ixpk= 1082, nxpk= 0, iat= 399, 403, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  25 GLN  HN     25 GLN  HB3     3.70             (#peak  1083)
 &rst
  ixpk= 1083, nxpk= 0, iat= 399, 404, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  25 GLN  HN     25 GLN  HG2     4.62             (#peak  1081)
 &rst
  ixpk= 1081, nxpk= 0, iat= 399, 406, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  25 GLN  HN     25 GLN  HG3     4.62             (#peak  1774)
 &rst
  ixpk= 1774, nxpk= 0, iat= 399, 407, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  25 GLN  HN     25 GLN  QB      3.18             (#peak  1083)
 &rst
  ixpk= 1083, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 403, 404,
 &end
#
#  25 GLN  HN     25 GLN  QG      4.06             (#peak  1774)
 &rst
  ixpk= 1774, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 406, 407,
 &end
#
#  25 GLN  HN     26 SER  HN      3.64             (#peak  1372)
 &rst
  ixpk= 1372, nxpk= 0, iat= 399, 416, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#  25 GLN  HN     27 ARG  HN      4.47             (#peak  1088)
 &rst
  ixpk= 1088, nxpk= 0, iat= 399, 427, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  25 GLN  HN     27 ARG  QG      5.25             (#peak  1084)
 &rst
  ixpk= 1084, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr2= 434, 435,
 &end
#
#  25 GLN  HA     25 GLN  QG      3.48             (#peak  2201)
 &rst
  ixpk= 2201, nxpk= 0, iat= 401,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 406, 407,
 &end
#
#  25 GLN  HA     26 SER  HN      3.56             (#peak    30)
 &rst
  ixpk= 30, nxpk= 0, iat= 401, 416, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  25 GLN  HB2    26 SER  HN      4.38             (#peak  1377)
 &rst
  ixpk= 1377, nxpk= 0, iat= 403, 416, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  25 GLN  HB2    27 ARG  HN      5.50             (#peak   926)
 &rst
  ixpk= 926, nxpk= 0, iat= 403, 427, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 GLN  HB3    26 SER  HN      4.38             (#peak  1378)
 &rst
  ixpk= 1378, nxpk= 0, iat= 404, 416, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  25 GLN  HB3    27 ARG  HN      5.50             (#peak   928)
 &rst
  ixpk= 928, nxpk= 0, iat= 404, 427, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 GLN  HG2    26 SER  HN      5.50             (#peak  1376)
 &rst
  ixpk= 1376, nxpk= 0, iat= 406, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 GLN  HG3    26 SER  HN      5.50             (#peak  1376)
 &rst
  ixpk= 1376, nxpk= 0, iat= 407, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  25 GLN  QB     26 SER  HN      3.79             (#peak  1377)
 &rst
  ixpk= 1377, nxpk= 0, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 403, 404,
 &end
#
#  25 GLN  QB     27 ARG  HN      4.76             (#peak   926)
 &rst
  ixpk= 926, nxpk= 0, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 403, 404,
 &end
#
#  25 GLN  QG     25 GLN  QE2     3.23             (#peak  2625)
 &rst
  ixpk= 2625, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr1= 406, 407,
 igr2= 411, 412,
 &end
#
#  25 GLN  QG     26 SER  HN      4.66             (#peak  1376)
 &rst
  ixpk= 1376, nxpk= 0, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr1= 406, 407,
 &end
#
#  26 SER  HN     26 SER  QB      3.67             (#peak  1375)
 &rst
  ixpk= 1375, nxpk= 0, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 420, 421,
 &end
#
#  26 SER  HN     27 ARG  HN      3.63             (#peak  1373)
 &rst
  ixpk= 1373, nxpk= 0, iat= 416, 427, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  26 SER  HA     27 ARG  HN      3.56             (#peak   323)
 &rst
  ixpk= 323, nxpk= 0, iat= 418, 427, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  26 SER  HB2    27 ARG  HN      5.40             (#peak   924)
 &rst
  ixpk= 924, nxpk= 0, iat= 420, 427, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#  26 SER  HB3    27 ARG  HN      5.40             (#peak   924)
 &rst
  ixpk= 924, nxpk= 0, iat= 421, 427, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#  27 ARG  HN     27 ARG  HD2     5.50             (#peak   925)
 &rst
  ixpk= 925, nxpk= 0, iat= 427, 437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  27 ARG  HN     27 ARG  HD3     5.50             (#peak   925)
 &rst
  ixpk= 925, nxpk= 0, iat= 427, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  27 ARG  HN     27 ARG  HG2     4.08             (#peak   929)
 &rst
  ixpk= 929, nxpk= 0, iat= 427, 434, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  27 ARG  HN     27 ARG  HG3     4.08             (#peak   930)
 &rst
  ixpk= 930, nxpk= 0, iat= 427, 435, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  27 ARG  HN     27 ARG  QB      3.47             (#peak   927)
 &rst
  ixpk= 927, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2= 431, 432,
 &end
#
#  27 ARG  HN     27 ARG  QG      3.38             (#peak   930)
 &rst
  ixpk= 930, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 434, 435,
 &end
#
#  27 ARG  HN     28 LYS  HN      4.73             (#peak  1656)
 &rst
  ixpk= 1656, nxpk= 0, iat= 427, 451, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#  27 ARG  HA     27 ARG  HD2     4.13             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat= 429, 437, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  27 ARG  HA     27 ARG  HD3     4.13             (#peak  2207)
 &rst
  ixpk= 2207, nxpk= 0, iat= 429, 438, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  27 ARG  HA     27 ARG  QD      3.55             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat= 429,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 437, 438,
 &end
#
#  27 ARG  HA     27 ARG  QG      3.71             (#peak  2138)
 &rst
  ixpk= 2138, nxpk= 0, iat= 429,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 434, 435,
 &end
#
#  27 ARG  HA     28 LYS  HN      3.40             (#peak   264)
 &rst
  ixpk= 264, nxpk= 0, iat= 429, 451, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  27 ARG  HB2    28 LYS  HN      4.05             (#peak   268)
 &rst
  ixpk= 268, nxpk= 0, iat= 431, 451, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  27 ARG  HB3    28 LYS  HN      4.05             (#peak   269)
 &rst
  ixpk= 269, nxpk= 0, iat= 432, 451, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  27 ARG  HD2    28 LYS  HN      4.56             (#peak   265)
 &rst
  ixpk= 265, nxpk= 0, iat= 437, 451, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#  27 ARG  HD2    29 PHE  HD      7.50             (#peak 2212 )
 &rst
  ixpk= 2212, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2= 481, 489,
 &end
#
#  27 ARG  HD3    28 LYS  HN      4.56             (#peak  2214)
 &rst
  ixpk= 2214, nxpk= 0, iat= 438, 451, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
#  27 ARG  HD3    29 PHE  HD      7.50             (#)
 &rst
  ixpk= 2214, nxpk= 0, iat= 438,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2= 481, 489,
 &end
#
#  27 ARG  HE    132 VAL  QQG     5.50             (#peak 1968 )
 &rst
  ixpk= 1968, nxpk= 0, iat= 440,2074, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  27 ARG  HG2   132 VAL  QQG     5.50             (#peak 1964 )
 &rst
  ixpk= 1964, nxpk= 0, iat= 434,2074, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  27 ARG  HG2    27 ARG  HE      4.07             (#peak  1690)
 &rst
  ixpk= 1690, nxpk= 0, iat= 434, 440, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  27 ARG  HG3    27 ARG  HE      4.07             (#peak  1691)
 &rst
  ixpk= 1691, nxpk= 0, iat= 435, 440, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  27 ARG  QB     27 ARG  QD      3.21             (#peak  2216)
 &rst
  ixpk= 2216, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 431, 432,
 igr2= 437, 438,
 &end
#
#  27 ARG  QB     28 LYS  HN      3.39             (#peak   268)
 &rst
  ixpk= 268, nxpk= 0, iat=  -1, 451, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1= 431, 432,
 &end
#
#  27 ARG  QG     28 LYS  HN      4.73             (#peak   272)
 &rst
  ixpk= 272, nxpk= 0, iat=  -1, 451, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 434, 435,
 &end
#
#  28 LYS  HN    130 GLU  HB3     4.41             (#peak   269)
 &rst
  ixpk= 269, nxpk= 0, iat= 451,2045, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  28 LYS  HN     28 LYS  HD2     4.20             (#peak   270)
 &rst
  ixpk= 270, nxpk= 0, iat= 451, 461, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  28 LYS  HN     28 LYS  HD3     4.20             (#peak   271)
 &rst
  ixpk= 271, nxpk= 0, iat= 451, 462, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  28 LYS  HN     28 LYS  HG2     4.45             (#peak   273)
 &rst
  ixpk= 273, nxpk= 0, iat= 451, 458, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  28 LYS  HN     28 LYS  HG3     4.45             (#peak   273)
 &rst
  ixpk= 273, nxpk= 0, iat= 451, 459, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  28 LYS  HN     28 LYS  QD      3.64             (#peak   270)
 &rst
  ixpk= 270, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr2= 461, 462,
 &end
#
#  28 LYS  HN     28 LYS  QG      3.82             (#peak   273)
 &rst
  ixpk= 273, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 458, 459,
 &end
#
#  28 LYS  HN     29 PHE  HN      4.69             (#peak   833)
 &rst
  ixpk= 833, nxpk= 0, iat= 451, 473, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  28 LYS  HN     29 PHE  HD      6.71             (#peak   262)
 &rst
  ixpk= 262, nxpk= 0, iat= 451,  -1, r1= 1.30, r2= 1.80, r3= 7.53, r4= 8.03,
 igr2= 481, 489,
 &end
#
#  28 LYS  HA     29 PHE  HN      3.22             (#peak   817)
 &rst
  ixpk= 817, nxpk= 0, iat= 453, 473, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#  28 LYS  HA     47 GLY  HA3     4.40             (#peak   346)
 &rst
  ixpk= 346, nxpk= 0, iat= 453, 751, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  28 LYS  HA     48 PHE  HN      4.20             (#peak   342)
 &rst
  ixpk= 342, nxpk= 0, iat= 453, 755, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  28 LYS  HA     48 PHE  HA      4.64             (#peak   517)
 &rst
  ixpk= 517, nxpk= 0, iat= 453, 757, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  28 LYS  HB2    29 PHE  HN      4.25             (#peak  1988)
 &rst
  ixpk= 1988, nxpk= 0, iat= 455, 473, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  28 LYS  HB2    48 PHE  HN      4.83             (#peak   313)
 &rst
  ixpk= 313, nxpk= 0, iat= 455, 755, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  28 LYS  HB3    29 PHE  HN      4.25             (#peak   834)
 &rst
  ixpk= 834, nxpk= 0, iat= 456, 473, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  28 LYS  HB3    48 PHE  HN      4.83             (#peak   336)
 &rst
  ixpk= 336, nxpk= 0, iat= 456, 755, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  28 LYS  HE2    51 LEU  HB2     4.31             (#peak  2222)
 &rst
  ixpk= 2222, nxpk= 0, iat= 464, 805, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  28 LYS  HE3    51 LEU  HB2     4.31             (#peak  2222)
 &rst
  ixpk= 2222, nxpk= 0, iat= 465, 805, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  28 LYS  HG2    29 PHE  HN      5.50             (#peak   835)
 &rst
  ixpk= 835, nxpk= 0, iat= 458, 473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  28 LYS  HG2    48 PHE  HA      4.98             (#peak  2235)
 &rst
  ixpk= 2235, nxpk= 0, iat= 458, 757, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  28 LYS  HG2    51 LEU  HB2     4.79             (#peak  2242)
 &rst
  ixpk= 2242, nxpk= 0, iat= 458, 805, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  28 LYS  HG3    29 PHE  HN      5.50             (#peak   835)
 &rst
  ixpk= 835, nxpk= 0, iat= 459, 473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  28 LYS  HG3    48 PHE  HA      4.98             (#peak  2235)
 &rst
  ixpk= 2235, nxpk= 0, iat= 459, 757, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  28 LYS  HG3    51 LEU  HB2     4.79             (#peak  2242)
 &rst
  ixpk= 2242, nxpk= 0, iat= 459, 805, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  28 LYS  QB     29 PHE  HN      3.71             (#peak   834)
 &rst
  ixpk= 834, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 455, 456,
 &end
#
#  28 LYS  QB     48 PHE  HN      3.96             (#peak   336)
 &rst
  ixpk= 336, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 455, 456,
 &end
#
#  28 LYS  QB     48 PHE  HA      4.34             (#peak   521)
 &rst
  ixpk= 521, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 455, 456,
 &end
#
#  28 LYS  QB     51 LEU  HA      5.01             (#peak   572)
 &rst
  ixpk= 572, nxpk= 0, iat=  -1, 803, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 455, 456,
 &end
#
#  28 LYS  QB     51 LEU  QQD     4.13             (#peak  2490)
 &rst
  ixpk= 2490, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr1= 455, 456,
 &end
#
#  28 LYS  QD    131 VAL  HN      4.74             (#peak   204)
 &rst
  ixpk= 204, nxpk= 0, iat=  -1,2055, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 461, 462,
 &end
#
#  28 LYS  QD    131 VAL  QQG     4.04             (#peak  1942)
 &rst
  ixpk= 1942, nxpk= 0, iat=  -1,2058, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1= 461, 462,
 &end
#
#  28 LYS  QD     51 LEU  HB2     3.60             (#peak  1220)
 &rst
  ixpk= 1220, nxpk= 0, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 461, 462,
 &end
#
#  28 LYS  QD     51 LEU  QQD     3.20             (#peak  2506)
 &rst
  ixpk= 2506, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr1= 461, 462,
 &end
#
#  28 LYS  QE     51 LEU  HB2     3.68             (#peak  2222)
 &rst
  ixpk= 2222, nxpk= 0, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1= 464, 465,
 &end
#
#  28 LYS  QE     51 LEU  QQD     4.42             (#peak  2261)
 &rst
  ixpk= 2261, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr1= 464, 465,
 &end
#
#  28 LYS  QG     29 PHE  HN      4.77             (#peak   835)
 &rst
  ixpk= 835, nxpk= 0, iat=  -1, 473, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 458, 459,
 &end
#
#  28 LYS  QG     47 GLY  HA2     5.50             (#peak 2236 )
 &rst
  ixpk= 2236, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 458, 459,
 &end
#
#  28 LYS  QG     51 LEU  HB2     4.07             (#peak  2242)
 &rst
  ixpk= 2242, nxpk= 0, iat=  -1, 805, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 458, 459,
 &end
#
#  29 PHE  HN    126 ILE  QG2     6.00             (#peak 837  )
 &rst
  ixpk= 837, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  HN     29 PHE  HD      5.65             (#peak   825)
 &rst
  ixpk= 825, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2= 481, 489,
 &end
#
#  29 PHE  HN     30 ILE  HN      4.48             (#peak  1640)
 &rst
  ixpk= 1640, nxpk= 0, iat= 473, 493, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
#  29 PHE  HN     45 ASN  QB      4.55             (#peak   838)
 &rst
  ixpk= 838, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr2= 726, 727,
 &end
#
#  29 PHE  HN     47 GLY  HN      4.97             (#peak   830)
 &rst
  ixpk= 830, nxpk= 0, iat= 473, 748, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  29 PHE  HN     47 GLY  HA3     4.29             (#peak   818)
 &rst
  ixpk= 818, nxpk= 0, iat= 473, 751, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#  29 PHE  HN     48 PHE  HN      3.95             (#peak   346)
 &rst
  ixpk= 346, nxpk= 0, iat= 473, 755, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  29 PHE  HN     48 PHE  QB      3.72             (#peak   820)
 &rst
  ixpk= 820, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2= 759, 760,
 &end
#
#  29 PHE  HN     48 PHE  HD      6.34             (#peak   824)
 &rst
  ixpk= 824, nxpk= 0, iat= 473,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2= 763, 771,
 &end
#
#  29 PHE  HN     49 CYS  HN      5.28             (#peak   864)
 &rst
  ixpk= 864, nxpk= 0, iat= 473, 775, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  29 PHE  HN     51 LEU  HB2     6.00             (#peak   836)
 &rst
  ixpk= 836, nxpk= 0, iat= 473, 805, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  29 PHE  HA    126 ILE  QG2     4.95             (#peak  3005)
 &rst
  ixpk= 3005, nxpk= 0, iat= 475,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  HA    128 ASN  HN      5.38             (#peak   677)
 &rst
  ixpk= 677, nxpk= 0, iat= 475,2006, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#  29 PHE  HA    128 ASN  HA      4.11             (#peak  2691)
 &rst
  ixpk= 2691, nxpk= 0, iat= 475,2008, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  29 PHE  HA    129 PHE  HN      4.06             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat= 475,2020, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  29 PHE  HA    129 PHE  HD      6.73             (#peak   350)
 &rst
  ixpk= 350, nxpk= 0, iat= 475,  -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
 igr2=2028,2036,
 &end
#
#  29 PHE  HA     29 PHE  HD      6.86             (#peak   351)
 &rst
  ixpk= 351, nxpk= 0, iat= 475,  -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr2= 481, 489,
 &end
#
#  29 PHE  HA     30 ILE  HN      3.34             (#peak  1464)
 &rst
  ixpk= 1464, nxpk= 0, iat= 475, 493, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  29 PHE  HB2   126 ILE  QG2     4.27             (#peak  1815)
 &rst
  ixpk= 1815, nxpk= 0, iat= 477,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  HB2   128 ASN  HA      4.43             (#peak  2692)
 &rst
  ixpk= 2692, nxpk= 0, iat= 477,2008, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  29 PHE  HB2    30 ILE  HN      4.07             (#peak  1466)
 &rst
  ixpk= 1466, nxpk= 0, iat= 477, 493, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  29 PHE  HB3   126 ILE  QG2     4.27             (#peak  1806)
 &rst
  ixpk= 1806, nxpk= 0, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  HB3   128 ASN  HA      4.43             (#peak  2695)
 &rst
  ixpk= 2695, nxpk= 0, iat= 478,2008, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  29 PHE  HB3    30 ILE  HN      4.07             (#peak  1467)
 &rst
  ixpk= 1467, nxpk= 0, iat= 478, 493, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  29 PHE  QB    126 ILE  QG2     3.67             (#peak  1806)
 &rst
  ixpk= 1806, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 477, 478,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  QB    128 ASN  HA      3.85             (#peak  2695)
 &rst
  ixpk= 2695, nxpk= 0, iat=  -1,2008, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 477, 478,
 &end
#
#  29 PHE  QB    129 PHE  HN      4.34             (#peak   540)
 &rst
  ixpk= 540, nxpk= 0, iat=  -1,2020, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 477, 478,
 &end
#
#  29 PHE  QB     30 ILE  HN      3.49             (#peak  1467)
 &rst
  ixpk= 1467, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr1= 477, 478,
 &end
#
#  29 PHE  HD    126 ILE  QG2     5.54             (#peak  1822)
 &rst
  ixpk= 1822, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 481, 489,
 igr2=1974,1975,1976,
 &end
#
#  29 PHE  HD     30 ILE  HN      6.10             (#peak  1463)
 &rst
  ixpk= 1463, nxpk= 0, iat=  -1, 493, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1= 481, 489,
 &end
#
#  29 PHE  HD     31 ILE  HN      7.48             (#peak   881)
 &rst
  ixpk= 881, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
 igr1= 481, 489,
 &end
#
#  29 PHE  HD     31 ILE  HG13    7.00             (#peak  2305)
 &rst
  ixpk= 2305, nxpk= 0, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 481, 489,
 &end
#
#  29 PHE  HD     31 ILE  QD1     5.55             (#peak  2318)
 &rst
  ixpk= 2318, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
 igr1= 481, 489,
 igr2= 525, 526, 527,
 &end
#
#  29 PHE  HD     31 ILE  QG2     6.96             (#peak  2287)
 &rst
  ixpk= 2287, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.38, r4= 9.88,
 igr1= 481, 489,
 igr2= 518, 519, 520,
 &end
#
#  30 ILE  HN    126 ILE  QG2     4.30             (#peak  1824)
 &rst
  ixpk= 1824, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=1974,1975,1976,
 &end
#
#  30 ILE  HN    127 LEU  HN      4.51             (#peak   128)
 &rst
  ixpk= 128, nxpk= 0, iat= 493,1987, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  30 ILE  HN    127 LEU  QD2 6.00   (#peak 1470 )
 &rst
  ixpk= 1470, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2000,2001,2002,
 &end
#
#  30 ILE  HN    128 ASN  HA      4.52             (#peak  2698)
 &rst
  ixpk= 2698, nxpk= 0, iat= 493,2008, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  30 ILE  HN    129 PHE  HN      4.83             (#peak  1460)
 &rst
  ixpk= 1460, nxpk= 0, iat= 493,2020, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  30 ILE  HN    129 PHE  HD      6.39             (#peak  1461)
 &rst
  ixpk= 1461, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr2=2028,2036,
 &end
#
#  30 ILE  HN     30 ILE  QD1     3.84             (#peak  1733)
 &rst
  ixpk= 1733, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 506, 507, 508,
 &end
#
#  30 ILE  HN     30 ILE  QG2     4.25             (#peak  1474)
 &rst
  ixpk= 1474, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 499, 500, 501,
 &end
#
#  30 ILE  HN     31 ILE  HN      4.72             (#peak   879)
 &rst
  ixpk= 879, nxpk= 0, iat= 493, 512, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  30 ILE  HN     31 ILE  QD1     4.68             (#peak  1739)
 &rst
  ixpk= 1739, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2= 525, 526, 527,
 &end
#
#  30 ILE  HA     30 ILE  QD1     4.84             (#peak  2286)
 &rst
  ixpk= 2286, nxpk= 0, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 506, 507, 508,
 &end
#
#  30 ILE  HA     30 ILE  QG2     3.55             (#peak  2270)
 &rst
  ixpk= 2270, nxpk= 0, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2= 499, 500, 501,
 &end
#
#  30 ILE  HA     31 ILE  QG2     5.50             (#peak  2293)
 &rst
  ixpk= 2293, nxpk= 0, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 518, 519, 520,
 &end
#
#  30 ILE  HB     30 ILE  QD1     4.23             (#peak  2266)
 &rst
  ixpk= 2266, nxpk= 0, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 506, 507, 508,
 &end
#
#  30 ILE  HB     31 ILE  HN      3.41             (#peak   885)
 &rst
  ixpk= 885, nxpk= 0, iat= 497, 512, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  30 ILE  HB     31 ILE  HG12    4.71             (#peak  2268)
 &rst
  ixpk= 2268, nxpk= 0, iat= 497, 522, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  30 ILE  HB     32 ALA  HN      5.35             (#peak     4)
 &rst
  ixpk= 4, nxpk= 0, iat= 497, 531, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#  30 ILE  HB     41 VAL  QG1     4.30             (#peak  2393)
 &rst
  ixpk= 2393, nxpk= 0, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 661, 662, 663,
 &end
#
#  30 ILE  HB     59 VAL  QQG     5.50             (#peak 2267 )
 &rst
  ixpk= 2267, nxpk= 0, iat= 497, 922, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  30 ILE  QD1   114 PRO  HA      5.50             (#peak 1542 )
 &rst
  ixpk= 1542, nxpk= 0, iat=  -1,1796, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   126 ILE  HB      5.07             (#peak  1803)
 &rst
  ixpk= 1803, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   126 ILE  QG2     3.42             (#peak  1814)
 &rst
  ixpk= 1814, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 506, 507, 508,
 igr2=1974,1975,1976,
 &end
#
#  30 ILE  QD1   127 LEU  HN      4.10             (#peak   118)
 &rst
  ixpk= 118, nxpk= 0, iat=  -1,1987, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   127 LEU  HA      4.57             (#peak  1736)
 &rst
  ixpk= 1736, nxpk= 0, iat=  -1,1989, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   127 LEU  HG      4.41             (#peak  1741)
 &rst
  ixpk= 1741, nxpk= 0, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   128 ASN  HN      4.91             (#peak   685)
 &rst
  ixpk= 685, nxpk= 0, iat=  -1,2006, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1   129 PHE  HD      6.32             (#peak  1730)
 &rst
  ixpk= 1730, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.52, r4= 9.02,
 igr1= 506, 507, 508,
 igr2=2028,2036,
 &end
#
#  30 ILE  QD1    31 ILE  HN      4.33             (#peak   891)
 &rst
  ixpk= 891, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1    32 ALA  HN      4.53             (#peak    11)
 &rst
  ixpk= 11, nxpk= 0, iat=  -1, 531, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1    32 ALA  QB      3.58             (#peak   388)
 &rst
  ixpk= 388, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1= 506, 507, 508,
 igr2= 535, 536, 537,
 &end
#
#  30 ILE  QD1    41 VAL  QG1     4.17             (#peak  2395)
 &rst
  ixpk= 2395, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1= 506, 507, 508,
 igr2= 661, 662, 663,
 &end
#
#  30 ILE  QD1    41 VAL  QG2     4.40             (#peak  2395)
 &rst
  ixpk= 2395, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 506, 507, 508,
 igr2= 665, 666, 667,
 &end
#
#  30 ILE  QD1    64 CYS  HA      4.24             (#peak  1724)
 &rst
  ixpk= 1724, nxpk= 0, iat=  -1,1009, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1    64 CYS  HB2     4.81             (#peak  1737)
 &rst
  ixpk= 1737, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QD1    64 CYS  HB3     4.81             (#peak  1738)
 &rst
  ixpk= 1738, nxpk= 0, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 506, 507, 508,
 &end
#
#  30 ILE  QG2    30 ILE  QD1     3.28             (#peak  2285)
 &rst
  ixpk= 2285, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 499, 500, 501,
 igr2= 506, 507, 508,
 &end
#
#  30 ILE  QG2    31 ILE  HN      3.77             (#peak   892)
 &rst
  ixpk= 892, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    31 ILE  HG12    4.62             (#peak  2282)
 &rst
  ixpk= 2282, nxpk= 0, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    32 ALA  QB      5.50             (#peak 2283 )
 &rst
  ixpk= 2283, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 499, 500, 501,
 igr2= 535, 536, 537,
 &end
#
#  30 ILE  QG2    41 VAL  QG1     4.42             (#peak  2396)
 &rst
  ixpk= 2396, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
 igr1= 499, 500, 501,
 igr2= 661, 662, 663,
 &end
#
#  30 ILE  QG2    41 VAL  QG2     5.06             (#peak  2396)
 &rst
  ixpk= 2396, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 499, 500, 501,
 igr2= 665, 666, 667,
 &end
#
#  30 ILE  QG2    43 TYR  HD      7.50             (#peak  2273)
 &rst
  ixpk= 2273, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1= 499, 500, 501,
 igr2= 698, 707,
 &end
#
#  30 ILE  QG2    44 CYS  HN      6.00             (#peak 1605 )
 &rst
  ixpk= 1605, nxpk= 0, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    44 CYS  HA      3.70             (#peak  2271)
 &rst
  ixpk= 2271, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    44 CYS  HB2     4.21             (#peak  2460)
 &rst
  ixpk= 2460, nxpk= 0, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    44 CYS  HB3     4.21             (#peak  2459)
 &rst
  ixpk= 2459, nxpk= 0, iat=  -1, 716, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    45 ASN  HN      3.83             (#peak   500)
 &rst
  ixpk= 500, nxpk= 0, iat=  -1, 722, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 499, 500, 501,
 &end
#
#  30 ILE  QG2    48 PHE  QB      4.15             (#peak  2278)
 &rst
  ixpk= 2278, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1= 499, 500, 501,
 igr2= 759, 760,
 &end
#
#  30 ILE  QG2    48 PHE  HD      6.05             (#peak  2272)
 &rst
  ixpk= 2272, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
 igr1= 499, 500, 501,
 igr2= 763, 771,
 &end
#
#  30 ILE  QG2    59 VAL  QQG     3.27             (#peak  2284)
 &rst
  ixpk= 2284, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr1= 499, 500, 501,
 &end
#
#  31 ILE  HN     31 ILE  HB      3.90             (#peak   886)
 &rst
  ixpk= 886, nxpk= 0, iat= 512, 516, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  31 ILE  HN     31 ILE  HG12    3.86             (#peak   888)
 &rst
  ixpk= 888, nxpk= 0, iat= 512, 522, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  31 ILE  HN     31 ILE  HG13    4.78             (#peak  2306)
 &rst
  ixpk= 2306, nxpk= 0, iat= 512, 523, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  31 ILE  HN     31 ILE  QD1     3.81             (#peak   890)
 &rst
  ixpk= 890, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 525, 526, 527,
 &end
#
#  31 ILE  HN     31 ILE  QG2     4.01             (#peak   889)
 &rst
  ixpk= 889, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 518, 519, 520,
 &end
#
#  31 ILE  HN     32 ALA  HN      4.72             (#peak   877)
 &rst
  ixpk= 877, nxpk= 0, iat= 512, 531, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  31 ILE  HN     42 ILE  HN      5.49             (#peak   878)
 &rst
  ixpk= 878, nxpk= 0, iat= 512, 671, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  31 ILE  HN     43 TYR  HN      3.81             (#peak   880)
 &rst
  ixpk= 880, nxpk= 0, iat= 512, 690, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#  31 ILE  HN     43 TYR  HB3     4.71             (#peak   884)
 &rst
  ixpk= 884, nxpk= 0, iat= 512, 695, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  31 ILE  HN     43 TYR  HD      7.50             (#peak   881)
 &rst
  ixpk= 881, nxpk= 0, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2= 698, 707,
 &end
#
#  31 ILE  HA    126 ILE  HA      4.33             (#peak   358)
 &rst
  ixpk= 358, nxpk= 0, iat= 514,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  31 ILE  HA    126 ILE  HB      5.48             (#peak  1798)
 &rst
  ixpk= 1798, nxpk= 0, iat= 514,1972, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#  31 ILE  HA    126 ILE  QD1     4.53             (#peak  1833)
 &rst
  ixpk= 1833, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2=1981,1982,1983,
 &end
#
#  31 ILE  HA    126 ILE  QG2     4.07             (#peak  1817)
 &rst
  ixpk= 1817, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr2=1974,1975,1976,
 &end
#
#  31 ILE  HA    127 LEU  HN      5.20             (#peak   125)
 &rst
  ixpk= 125, nxpk= 0, iat= 514,1987, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#  31 ILE  HA     31 ILE  QD1     4.04             (#peak   357)
 &rst
  ixpk= 357, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 525, 526, 527,
 &end
#
#  31 ILE  HA     31 ILE  QG2     3.29             (#peak  2291)
 &rst
  ixpk= 2291, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 518, 519, 520,
 &end
#
#  31 ILE  HA     32 ALA  HN      3.38             (#peak    12)
 &rst
  ixpk= 12, nxpk= 0, iat= 514, 531, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  31 ILE  HA     32 ALA  QB      4.02             (#peak   376)
 &rst
  ixpk= 376, nxpk= 0, iat= 514,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 535, 536, 537,
 &end
#
#  31 ILE  HB     31 ILE  QD1     3.54             (#peak  2312)
 &rst
  ixpk= 2312, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2= 525, 526, 527,
 &end
#
#  31 ILE  HB     32 ALA  HN      4.39             (#peak     5)
 &rst
  ixpk= 5, nxpk= 0, iat= 516, 531, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  31 ILE  HB     42 ILE  QD1     4.56             (#peak  2442)
 &rst
  ixpk= 2442, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 684, 685, 686,
 &end
#
#  31 ILE  HB     43 TYR  HN      4.40             (#peak   627)
 &rst
  ixpk= 627, nxpk= 0, iat= 516, 690, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  31 ILE  HB     43 TYR  HB2     4.46             (#peak   365)
 &rst
  ixpk= 365, nxpk= 0, iat= 516, 694, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  31 ILE  HB     43 TYR  HD      6.41             (#peak   363)
 &rst
  ixpk= 363, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2= 698, 707,
 &end
#
#  31 ILE  HG12  126 ILE  QD1     5.05             (#peak  1839)
 &rst
  ixpk= 1839, nxpk= 0, iat= 522,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2=1981,1982,1983,
 &end
#
#  31 ILE  HG12  126 ILE  QG2     4.24             (#peak  1811)
 &rst
  ixpk= 1811, nxpk= 0, iat= 522,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2=1974,1975,1976,
 &end
#
#  31 ILE  HG13   43 TYR  HD      7.26             (#peak  2305)
 &rst
  ixpk= 2305, nxpk= 0, iat= 523,  -1, r1= 1.30, r2= 1.80, r3= 8.15, r4= 8.65,
 igr2= 698, 707,
 &end
#
#  31 ILE  QD1   126 ILE  HB      4.27             (#peak  1805)
 &rst
  ixpk= 1805, nxpk= 0, iat=  -1,1972, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 525, 526, 527,
 &end
#
#  31 ILE  QD1    32 ALA  HN      3.97             (#peak    10)
 &rst
  ixpk= 10, nxpk= 0, iat=  -1, 531, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1= 525, 526, 527,
 &end
#
#  31 ILE  QD1    32 ALA  HA      6.00             (#peak 2330 )
 &rst
  ixpk= 2330, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 525, 526, 527,
 &end
#
#  31 ILE  QD1    43 TYR  HB2     5.19             (#peak  2315)
 &rst
  ixpk= 2315, nxpk= 0, iat=  -1, 694, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 525, 526, 527,
 &end
#
#  31 ILE  QD1    43 TYR  HB3     4.27             (#peak  2316)
 &rst
  ixpk= 2316, nxpk= 0, iat=  -1, 695, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 525, 526, 527,
 &end
#
#  31 ILE  QG2   124 MET  HA      5.50             (#peak  1751)
 &rst
  ixpk= 1751, nxpk= 0, iat=  -1,1933, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2   124 MET  QB      4.32             (#peak  1756)
 &rst
  ixpk= 1756, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1= 518, 519, 520,
 igr2=1935,1936,
 &end
#
#  31 ILE  QG2   125 PHE  HN      4.87             (#peak  2288)
 &rst
  ixpk= 2288, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2   126 ILE  HN      6.00             (#peak 1733 )
 &rst
  ixpk= 1733, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2   126 ILE  HA      4.28             (#peak  2294)
 &rst
  ixpk= 2294, nxpk= 0, iat=  -1,1970, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2   126 ILE  QD1     3.93             (#peak  2301)
 &rst
  ixpk= 2301, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 518, 519, 520,
 igr2=1981,1982,1983,
 &end
#
#  31 ILE  QG2   127 LEU  HN      6.00             (#peak 119  )
 &rst
  ixpk= 119, nxpk= 0, iat=  -1,1987, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    31 ILE  HG12    3.75             (#peak  2300)
 &rst
  ixpk= 2300, nxpk= 0, iat=  -1, 522, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    31 ILE  HG13    3.70             (#peak  2298)
 &rst
  ixpk= 2298, nxpk= 0, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    32 ALA  HN      3.22             (#peak     9)
 &rst
  ixpk= 9, nxpk= 0, iat=  -1, 531, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    32 ALA  HA      4.16             (#peak  2292)
 &rst
  ixpk= 2292, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    42 ILE  HB      4.87             (#peak  2297)
 &rst
  ixpk= 2297, nxpk= 0, iat=  -1, 675, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    42 ILE  HG12    3.94             (#peak  2300)
 &rst
  ixpk= 2300, nxpk= 0, iat=  -1, 681, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    43 TYR  HA      5.35             (#peak  2295)
 &rst
  ixpk= 2295, nxpk= 0, iat=  -1, 692, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    43 TYR  HB2     4.03             (#peak  2296)
 &rst
  ixpk= 2296, nxpk= 0, iat=  -1, 694, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 518, 519, 520,
 &end
#
#  31 ILE  QG2    43 TYR  HD      7.22             (#peak  2287)
 &rst
  ixpk= 2287, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.73, r4=10.23,
 igr1= 518, 519, 520,
 igr2= 698, 707,
 &end
#
#  32 ALA  HN    124 MET  QB      5.04             (#peak     3)
 &rst
  ixpk= 3, nxpk= 0, iat= 531,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1935,1936,
 &end
#
#  32 ALA  HN    125 PHE  HN      3.84             (#peak    13)
 &rst
  ixpk= 13, nxpk= 0, iat= 531,1948, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  32 ALA  HN    125 PHE  HB2     5.00             (#peak     2)
 &rst
  ixpk= 2, nxpk= 0, iat= 531,1952, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  32 ALA  HN    125 PHE  HB3     4.97             (#peak    14)
 &rst
  ixpk= 14, nxpk= 0, iat= 531,1953, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  32 ALA  HN    126 ILE  QD1     4.57             (#peak    15)
 &rst
  ixpk= 15, nxpk= 0, iat= 531,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2=1981,1982,1983,
 &end
#
#  32 ALA  HN    127 LEU  HN      5.34             (#peak   131)
 &rst
  ixpk= 131, nxpk= 0, iat= 531,1987, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  32 ALA  HN     32 ALA  QB      3.37             (#peak     6)
 &rst
  ixpk= 6, nxpk= 0, iat= 531,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 535, 536, 537,
 &end
#
#  32 ALA  HN     33 ASN  HN      4.75             (#peak  1010)
 &rst
  ixpk= 1010, nxpk= 0, iat= 531, 541, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#  32 ALA  HN     42 ILE  HG12    4.23             (#peak     7)
 &rst
  ixpk= 7, nxpk= 0, iat= 531, 681, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  32 ALA  HN     42 ILE  QG2     5.42             (#peak     8)
 &rst
  ixpk= 8, nxpk= 0, iat= 531,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr2= 677, 678, 679,
 &end
#
#  32 ALA  HA     33 ASN  HN      3.27             (#peak  1007)
 &rst
  ixpk= 1007, nxpk= 0, iat= 533, 541, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  32 ALA  HA     41 VAL  HA      3.88             (#peak  2325)
 &rst
  ixpk= 2325, nxpk= 0, iat= 533, 657, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  32 ALA  HA     41 VAL  QG1     4.71             (#peak  2403)
 &rst
  ixpk= 2403, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2= 661, 662, 663,
 &end
#
#  32 ALA  HA     41 VAL  QG2     5.17             (#peak  2403)
 &rst
  ixpk= 2403, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 665, 666, 667,
 &end
#
#  32 ALA  HA     42 ILE  HN      3.96             (#peak  2333)
 &rst
  ixpk= 2333, nxpk= 0, iat= 533, 671, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  32 ALA  HA     42 ILE  HG12    4.65             (#peak  2327)
 &rst
  ixpk= 2327, nxpk= 0, iat= 533, 681, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  32 ALA  HA     42 ILE  HG13    4.16             (#peak  2328)
 &rst
  ixpk= 2328, nxpk= 0, iat= 533, 682, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  32 ALA  HA     42 ILE  QD1     4.30             (#peak  2328)
 &rst
  ixpk= 2328, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 684, 685, 686,
 &end
#
#  32 ALA  HA     42 ILE  QG2     3.89             (#peak  2329)
 &rst
  ixpk= 2329, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 677, 678, 679,
 &end
#
#  32 ALA  HA     43 TYR  HN      4.55             (#peak  2331)
 &rst
  ixpk= 2331, nxpk= 0, iat= 533, 690, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  32 ALA  QB    125 PHE  HN      3.94             (#peak  1295)
 &rst
  ixpk= 1295, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB    125 PHE  HB2     3.93             (#peak   385)
 &rst
  ixpk= 385, nxpk= 0, iat=  -1,1952, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB    125 PHE  HB3     3.95             (#peak   384)
 &rst
  ixpk= 384, nxpk= 0, iat=  -1,1953, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB    125 PHE  HD      5.89             (#peak   374)
 &rst
  ixpk= 374, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
 igr1= 535, 536, 537,
 igr2=1956,1964,
 &end
#
#  32 ALA  QB    126 ILE  HA      5.00             (#peak   377)
 &rst
  ixpk= 377, nxpk= 0, iat=  -1,1970, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB    127 LEU  QD1     5.00             (#peak 387  )
 &rst
  ixpk= 387, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 535, 536, 537,
 igr2=1996,1997,1998,
 &end
#
#  32 ALA  QB     33 ASN  HN      3.33             (#peak   371)
 &rst
  ixpk= 371, nxpk= 0, iat=  -1, 541, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     33 ASN  HA      4.68             (#peak   377)
 &rst
  ixpk= 377, nxpk= 0, iat=  -1, 543, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     35 ARG  HN      6.00             (#peak 372  )
 &rst
  ixpk= 372, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     39 CYS  HA      4.46             (#peak   378)
 &rst
  ixpk= 378, nxpk= 0, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     39 CYS  QB      3.73             (#peak   382)
 &rst
  ixpk= 382, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 535, 536, 537,
 igr2= 638, 639,
 &end
#
#  32 ALA  QB     40 ALA  HA      4.55             (#peak   380)
 &rst
  ixpk= 380, nxpk= 0, iat=  -1, 647, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     41 VAL  HN      4.38             (#peak   790)
 &rst
  ixpk= 790, nxpk= 0, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     41 VAL  HA      3.73             (#peak   381)
 &rst
  ixpk= 381, nxpk= 0, iat=  -1, 657, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     41 VAL  QG2     3.25             (#peak   386)
 &rst
  ixpk= 386, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 535, 536, 537,
 igr2= 665, 666, 667,
 &end
#
#  32 ALA  QB     42 ILE  HN      4.06             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=  -1, 671, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     43 TYR  HN      5.00             (#peak   628)
 &rst
  ixpk= 628, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     64 CYS  HA      5.11             (#peak   379)
 &rst
  ixpk= 379, nxpk= 0, iat=  -1,1009, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 535, 536, 537,
 &end
#
#  32 ALA  QB     64 CYS  QB      4.05             (#peak   383)
 &rst
  ixpk= 383, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 535, 536, 537,
 igr2=1011,1012,
 &end
#
#  32 ALA  QB     86 LEU  QD1     5.50             (#peak  2335)
 &rst
  ixpk= 2335, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 535, 536, 537,
 igr2=1347,1348,1349,
 &end
#
#  32 ALA  QB     86 LEU  QD1     5.50             (#peak 984  )
 &rst
  ixpk= 984, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 535, 536, 537,
 igr2=1347,1348,1349,
 &end
#
#  33 ASN  HN     33 ASN  HB2     3.69             (#peak  1004)
 &rst
  ixpk= 1004, nxpk= 0, iat= 541, 545, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  33 ASN  HN     33 ASN  HB3     3.69             (#peak  1003)
 &rst
  ixpk= 1003, nxpk= 0, iat= 541, 546, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  33 ASN  HN     33 ASN  QB      3.24             (#peak  1003)
 &rst
  ixpk= 1003, nxpk= 0, iat= 541,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 545, 546,
 &end
#
#  33 ASN  HN     33 ASN  QD2     4.33             (#peak  1008)
 &rst
  ixpk= 1008, nxpk= 0, iat= 541,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 550, 551,
 &end
#
#  33 ASN  HN     36 VAL  HB      6.00             (#peak  1005)
 &rst
  ixpk= 1005, nxpk= 0, iat= 541, 593, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  33 ASN  HN     36 VAL  QQG     4.74             (#peak  2374)
 &rst
  ixpk= 2374, nxpk= 0, iat= 541, 592, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,  &end
#
#  33 ASN  HN     41 VAL  HA      4.75             (#peak  1006)
 &rst
  ixpk= 1006, nxpk= 0, iat= 541, 657, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#  33 ASN  HN     42 ILE  HN      4.32             (#peak   646)
 &rst
  ixpk= 646, nxpk= 0, iat= 541, 671, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  33 ASN  HN     42 ILE  HB      5.50             (#peak  1005)
 &rst
  ixpk= 1005, nxpk= 0, iat= 541, 675, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  33 ASN  HN     42 ILE  HG12    4.00             (#peak   999)
 &rst
  ixpk= 999, nxpk= 0, iat= 541, 681, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  33 ASN  HN     42 ILE  QD1     3.58             (#peak  1001)
 &rst
  ixpk= 1001, nxpk= 0, iat= 541,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 684, 685, 686,
 &end
#
#  33 ASN  HN     42 ILE  QG2     3.41             (#peak  1000)
 &rst
  ixpk= 1000, nxpk= 0, iat= 541,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  HA    124 MET  QE      4.09             (#peak  2968)
 &rst
  ixpk= 2968, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1942,1943,1944,
 &end
#
#  33 ASN  HA    124 MET  QG      5.21             (#peak  1771)
 &rst
  ixpk= 1771, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2=1938,1939,
 &end
#
#  33 ASN  HA     36 VAL  QQG     4.22             (#peak  2379)
 &rst
  ixpk= 2379, nxpk= 0, iat= 543, 592, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,  &end
#
#  33 ASN  HA     42 ILE  QD1     4.20             (#peak  2443)
 &rst
  ixpk= 2443, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 684, 685, 686,
 &end
#
#  33 ASN  HA     42 ILE  QG2     4.24             (#peak  2429)
 &rst
  ixpk= 2429, nxpk= 0, iat= 543,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  HB2    34 ALA  HN      4.45             (#peak   479)
 &rst
  ixpk= 479, nxpk= 0, iat= 545, 555, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  33 ASN  HB2    36 VAL  QG1     5.34             (#peak  2362)
 &rst
  ixpk= 2362, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 595, 596, 597,
 &end
#
#  33 ASN  HB2    36 VAL  QG2     5.34             (#peak  2383)
 &rst
  ixpk= 2383, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 599, 600, 601,
 &end
#
#  33 ASN  HB2    40 ALA  QB      6.00             (#peak 448  )
 &rst
  ixpk= 448, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 649, 650, 651,
 &end
#
#  33 ASN  HB2    42 ILE  QD1     4.46             (#peak  2441)
 &rst
  ixpk= 2441, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 684, 685, 686,
 &end
#
#  33 ASN  HB2    42 ILE  QG2     4.19             (#peak  2426)
 &rst
  ixpk= 2426, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  HB3    34 ALA  HN      4.45             (#peak   480)
 &rst
  ixpk= 480, nxpk= 0, iat= 546, 555, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  33 ASN  HB3    36 VAL  QG1     5.34             (#peak  2345)
 &rst
  ixpk= 2345, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 595, 596, 597,
 &end
#
#  33 ASN  HB3    36 VAL  QG2     5.34             (#peak  2342)
 &rst
  ixpk= 2342, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2= 599, 600, 601,
 &end
#
#  33 ASN  HB3    42 ILE  QD1     4.46             (#peak  2440)
 &rst
  ixpk= 2440, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2= 684, 685, 686,
 &end
#
#  33 ASN  HB3    42 ILE  QG2     4.19             (#peak  2425)
 &rst
  ixpk= 2425, nxpk= 0, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  HD21   36 VAL  QG1     4.10             (#peak  2367)
 &rst
  ixpk= 2367, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 595, 596, 597,
 &end
#
#  33 ASN  HD21   36 VAL  QG2     4.10             (#peak  1407)
 &rst
  ixpk= 1407, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 599, 600, 601,
 &end
#
#  33 ASN  HD21   42 ILE  QG2     4.17             (#peak  1407)
 &rst
  ixpk= 1407, nxpk= 0, iat= 550,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  HD22   36 VAL  QG1     4.10             (#peak  1416)
 &rst
  ixpk= 1416, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 595, 596, 597,
 &end
#
#  33 ASN  HD22   36 VAL  QG2     4.10             (#peak  1413)
 &rst
  ixpk= 1413, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2= 599, 600, 601,
 &end
#
#  33 ASN  HD22   42 ILE  QG2     4.17             (#peak  1413)
 &rst
  ixpk= 1413, nxpk= 0, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  QB     33 ASN  QD2     3.19             (#peak  1414)
 &rst
  ixpk= 1414, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 545, 546,
 igr2= 550, 551,
 &end
#
#  33 ASN  QB     36 VAL  QQG     3.41             (#peak  2383)
 &rst
  ixpk= 2383, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 545, 546,
 &end
#
#  33 ASN  QB     42 ILE  QG2     3.34             (#peak  2425)
 &rst
  ixpk= 2425, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 545, 546,
 igr2= 677, 678, 679,
 &end
#
#  33 ASN  QD2    36 VAL  QQG     3.12             (#peak  1416)
 &rst
  ixpk= 1416, nxpk= 0, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 550, 551,
 &end
#
#  33 ASN  QD2    40 ALA  QB      4.87             (#peak   454)
 &rst
  ixpk= 454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 550, 551,
 igr2= 649, 650, 651,
 &end
#
#  33 ASN  QD2    42 ILE  HG12    5.34             (#peak  1581)
 &rst
  ixpk= 1581, nxpk= 0, iat=  -1, 681, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 550, 551,
 &end
#
#  33 ASN  QD2    42 ILE  QG2     3.49             (#peak  1407)
 &rst
  ixpk= 1407, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 550, 551,
 igr2= 677, 678, 679,
 &end
#
#  34 ALA  HN    124 MET  HN      4.89             (#peak  1657)
 &rst
  ixpk= 1657, nxpk= 0, iat= 555,1931, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  34 ALA  HN    124 MET  HA      3.62             (#peak   477)
 &rst
  ixpk= 477, nxpk= 0, iat= 555,1933, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  34 ALA  HN    124 MET  HG2     5.50             (#peak   481)
 &rst
  ixpk= 481, nxpk= 0, iat= 555,1938, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  34 ALA  HN    124 MET  HG3     5.50             (#peak   482)
 &rst
  ixpk= 482, nxpk= 0, iat= 555,1939, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  34 ALA  HN    124 MET  QB      5.14             (#peak   483)
 &rst
  ixpk= 483, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2=1935,1936,
 &end
#
#  34 ALA  HN    124 MET  QG      4.73             (#peak   482)
 &rst
  ixpk= 482, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2=1938,1939,
 &end
#
#  34 ALA  HN    125 PHE  HN      4.04             (#peak   475)
 &rst
  ixpk= 475, nxpk= 0, iat= 555,1948, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  34 ALA  HN    125 PHE  HB2     5.42             (#peak   482)
 &rst
  ixpk= 482, nxpk= 0, iat= 555,1952, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  34 ALA  HN    125 PHE  HB3     5.50             (#peak   481)
 &rst
  ixpk= 481, nxpk= 0, iat= 555,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  34 ALA  HN    125 PHE  HD      6.55             (#peak  1658)
 &rst
  ixpk= 1658, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr2=1956,1964,
 &end
#
#  34 ALA  HN     34 ALA  QB      3.15             (#peak   484)
 &rst
  ixpk= 484, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 559, 560, 561,
 &end
#
#  34 ALA  HN     35 ARG  HN      3.70             (#peak   474)
 &rst
  ixpk= 474, nxpk= 0, iat= 555, 565, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  34 ALA  HN     36 VAL  HN      4.88             (#peak   476)
 &rst
  ixpk= 476, nxpk= 0, iat= 555, 589, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#  34 ALA  HN     36 VAL  QG1     5.50             (#peak 485  )
 &rst
  ixpk= 485, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 595, 596, 597,
 &end
#
#  34 ALA  HN     36 VAL  QQG     5.44             (#peak   486)
 &rst
  ixpk= 486, nxpk= 0, iat= 555, 592, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  34 ALA  HN     42 ILE  QD1     5.50             (#peak   486)
 &rst
  ixpk= 486, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 684, 685, 686,
 &end
#
#  34 ALA  HA    122 VAL  QQG     4.49             (#peak  1679)
 &rst
  ixpk= 1679, nxpk= 0, iat= 557,1899, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,  &end
#
#  34 ALA  QB    115 VAL  HN      5.35             (#peak   281)
 &rst
  ixpk= 281, nxpk= 0, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    122 VAL  HN      5.04             (#peak   569)
 &rst
  ixpk= 569, nxpk= 0, iat=  -1,1896, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    122 VAL  HA      4.78             (#peak  1670)
 &rst
  ixpk= 1670, nxpk= 0, iat=  -1,1898, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    122 VAL  HB      4.51             (#peak  2355)
 &rst
  ixpk= 2355, nxpk= 0, iat=  -1,1900, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    122 VAL  QQG     3.21             (#peak  1696)
 &rst
  ixpk= 1696, nxpk= 0, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    123 ILE  HA      3.63             (#peak  2354)
 &rst
  ixpk= 2354, nxpk= 0, iat=  -1,1914, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    124 MET  HN      4.14             (#peak   752)
 &rst
  ixpk= 752, nxpk= 0, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    124 MET  HA      3.79             (#peak  2352)
 &rst
  ixpk= 2352, nxpk= 0, iat=  -1,1933, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    124 MET  QB      5.25             (#peak  2357)
 &rst
  ixpk= 2357, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
 igr1= 559, 560, 561,
 igr2=1935,1936,
 &end
#
#  34 ALA  QB    125 PHE  HN      4.22             (#peak  1296)
 &rst
  ixpk= 1296, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB    125 PHE  HD      5.75             (#peak  2347)
 &rst
  ixpk= 2347, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
 igr1= 559, 560, 561,
 igr2=1956,1964,
 &end
#
#  34 ALA  QB    126 ILE  HN      5.01             (#peak   548)
 &rst
  ixpk= 548, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB     35 ARG  HN      3.71             (#peak  1243)
 &rst
  ixpk= 1243, nxpk= 0, iat=  -1, 565, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 559, 560, 561,
 &end
#
#  34 ALA  QB     35 ARG  QG      4.57             (#peak  2357)
 &rst
  ixpk= 2357, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1= 559, 560, 561,
 igr2= 572, 573,
 &end
#
#  35 ARG  HN     35 ARG  HB2     3.76             (#peak  1239)
 &rst
  ixpk= 1239, nxpk= 0, iat= 565, 569, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  35 ARG  HN     35 ARG  HB3     3.76             (#peak  1240)
 &rst
  ixpk= 1240, nxpk= 0, iat= 565, 570, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  35 ARG  HN     35 ARG  HD2     5.50             (#peak  2752)
 &rst
  ixpk= 2752, nxpk= 0, iat= 565, 575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  35 ARG  HN     35 ARG  HD3     5.50             (#peak  2752)
 &rst
  ixpk= 2752, nxpk= 0, iat= 565, 576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  35 ARG  HN     35 ARG  HG2     3.93             (#peak  1241)
 &rst
  ixpk= 1241, nxpk= 0, iat= 565, 572, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  35 ARG  HN     35 ARG  HG3     3.93             (#peak  1242)
 &rst
  ixpk= 1242, nxpk= 0, iat= 565, 573, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  35 ARG  HN     35 ARG  QB      3.17             (#peak  1240)
 &rst
  ixpk= 1240, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 569, 570,
 &end
#
#  35 ARG  HN     35 ARG  QD      4.70             (#peak  2752)
 &rst
  ixpk= 2752, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr2= 575, 576,
 &end
#
#  35 ARG  HN     35 ARG  QG      3.43             (#peak  1241)
 &rst
  ixpk= 1241, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 572, 573,
 &end
#
#  35 ARG  HN     36 VAL  HN      3.69             (#peak  1237)
 &rst
  ixpk= 1237, nxpk= 0, iat= 565, 589, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,  &end
#
#  35 ARG  HN     36 VAL  QG1     5.50             (#peak  1244)
 &rst
  ixpk= 1244, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 595, 596, 597,
 &end
#
#  35 ARG  HN     36 VAL  QG2     5.50             (#peak  1244)
 &rst
  ixpk= 1244, nxpk= 0, iat= 565,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 599, 600, 601,
 &end
#
#  35 ARG  HN     36 VAL  QQG     4.29             (#peak  1244)
 &rst
  ixpk= 1244, nxpk= 0, iat= 565, 592, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,  &end
#
#  35 ARG  HA     35 ARG  HG2     3.97             (#peak   395)
 &rst
  ixpk= 395, nxpk= 0, iat= 567, 572, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  35 ARG  HA     35 ARG  HG3     3.97             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat= 567, 573, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  35 ARG  HA     35 ARG  QD      3.57             (#peak  2747)
 &rst
  ixpk= 2747, nxpk= 0, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 575, 576,
 &end
#
#  35 ARG  HA     35 ARG  QG      3.42             (#peak   393)
 &rst
  ixpk= 393, nxpk= 0, iat= 567,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 572, 573,
 &end
#
#  35 ARG  QB     35 ARG  HE      4.10             (#peak  1685)
 &rst
  ixpk= 1685, nxpk= 0, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 569, 570,
 &end
#
#  35 ARG  QB     35 ARG  QD      3.14             (#peak  2742)
 &rst
  ixpk= 2742, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 569, 570,
 igr2= 575, 576,
 &end
#
#  35 ARG  QD    123 ILE  HA      3.82             (#peak  2746)
 &rst
  ixpk= 2746, nxpk= 0, iat=  -1,1914, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr1= 575, 576,
 &end
#
#  35 ARG  QD    123 ILE  QG2     3.87             (#peak  2741)
 &rst
  ixpk= 2741, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 575, 576,
 igr2=1918,1919,1920,
 &end
#
#  35 ARG  QG    123 ILE  HB      4.72             (#peak  1706)
 &rst
  ixpk= 1706, nxpk= 0, iat=  -1,1916, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 572, 573,
 &end
#
#  35 ARG  QG     35 ARG  HE      3.66             (#peak  1686)
 &rst
  ixpk= 1686, nxpk= 0, iat=  -1, 578, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 572, 573,
 &end
#
#  36 VAL  HN     36 VAL  QG1     3.89             (#peak  2366)
 &rst
  ixpk= 2366, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 595, 596, 597,
 &end
#
#  36 VAL  HN     36 VAL  QG2     3.89             (#peak  1334)
 &rst
  ixpk= 1334, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 599, 600, 601,
 &end
#
#  36 VAL  HN     36 VAL  QQG     3.39             (#peak  2366)
 &rst
  ixpk= 2366, nxpk= 0, iat= 589, 592, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
#  36 VAL  HN     37 GLU  HN      4.74             (#peak   529)
 &rst
  ixpk= 529, nxpk= 0, iat= 589, 605, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#  36 VAL  HA     37 GLU  HA      4.58             (#peak   400)
 &rst
  ixpk= 400, nxpk= 0, iat= 591, 607, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  36 VAL  HB     37 GLU  HN      5.00             (#peak   533)
 &rst
  ixpk= 533, nxpk= 0, iat= 593, 605, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  36 VAL  QG1    37 GLU  HN      3.95             (#peak  2369)
 &rst
  ixpk= 2369, nxpk= 0, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 595, 596, 597,
 &end
#
#  36 VAL  QG1    39 CYS  HN      4.76             (#peak  2370)
 &rst
  ixpk= 2370, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 595, 596, 597,
 &end
#
#  36 VAL  QG2    37 GLU  HN      3.95             (#peak   535)
 &rst
  ixpk= 535, nxpk= 0, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 599, 600, 601,
 &end
#
#  36 VAL  QG2    39 CYS  HN      4.76             (#peak  1140)
 &rst
  ixpk= 1140, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 599, 600, 601,
 &end
#
#  36 VAL  QG2    39 CYS  HA      5.50             (#peak 1949 )
 &rst
  ixpk= 1949, nxpk= 0, iat=  -1, 636, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 599, 600, 601,
 &end
#
#  36 VAL  QQG    37 GLU  HA      4.35             (#peak  2382)
 &rst
  ixpk= 2382, nxpk= 0, iat= 592, 607, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,  &end
#
#  36 VAL  QQG    38 ASN  HN      3.68             (#peak  1307)
 &rst
  ixpk= 1307, nxpk= 0, iat= 592, 620, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,  &end
#
#  36 VAL  QQG    38 ASN  QB      5.12             (#peak  2384)
 &rst
  ixpk= 2384, nxpk= 0, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
 igr2= 624, 625,
 &end
#
#  36 VAL  QQG    39 CYS  HN      3.22             (#peak  1140)
 &rst
  ixpk= 1140, nxpk= 0, iat= 592, 634, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  36 VAL  QQG    39 CYS  HA      3.54             (#peak  2380)
 &rst
  ixpk= 2380, nxpk= 0, iat= 592, 636, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#  37 GLU  HN     37 GLU  HB2     4.05             (#peak   534)
 &rst
  ixpk= 534, nxpk= 0, iat= 605, 609, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  37 GLU  HN     37 GLU  HB3     4.05             (#peak   534)
 &rst
  ixpk= 534, nxpk= 0, iat= 605, 610, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  37 GLU  HN     37 GLU  QB      3.39             (#peak   534)
 &rst
  ixpk= 534, nxpk= 0, iat= 605,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2= 609, 610,
 &end
#
#  37 GLU  HN     37 GLU  QG      4.51             (#peak   532)
 &rst
  ixpk= 532, nxpk= 0, iat= 605,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 612, 613,
 &end
#
#  37 GLU  HN     38 ASN  HN      3.62             (#peak  1300)
 &rst
  ixpk= 1300, nxpk= 0, iat= 605, 620, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  37 GLU  HA     37 GLU  QG      3.38             (#peak   401)
 &rst
  ixpk= 401, nxpk= 0, iat= 607,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 612, 613,
 &end
#
#  37 GLU  HA     38 ASN  HN      3.56             (#peak   397)
 &rst
  ixpk= 397, nxpk= 0, iat= 607, 620, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  37 GLU  HA     38 ASN  HA      5.01             (#peak   398)
 &rst
  ixpk= 398, nxpk= 0, iat= 607, 622, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#  37 GLU  HA     39 CYS  HN      4.36             (#peak  1136)
 &rst
  ixpk= 1136, nxpk= 0, iat= 607, 634, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  37 GLU  QB     38 ASN  HN      3.61             (#peak  1306)
 &rst
  ixpk= 1306, nxpk= 0, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 609, 610,
 &end
#
#  37 GLU  QB     38 ASN  QB      4.76             (#peak   423)
 &rst
  ixpk= 423, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 609, 610,
 igr2= 624, 625,
 &end
#
#  37 GLU  QB     39 CYS  HN      5.11             (#peak  1138)
 &rst
  ixpk= 1138, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 609, 610,
 &end
#
#  37 GLU  QG     38 ASN  HN      4.36             (#peak  1305)
 &rst
  ixpk= 1305, nxpk= 0, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 612, 613,
 &end
#
#  37 GLU  QG     38 ASN  HA      4.45             (#peak   410)
 &rst
  ixpk= 410, nxpk= 0, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 612, 613,
 &end
#
#  38 ASN  HN     38 ASN  QB      3.62             (#peak  1304)
 &rst
  ixpk= 1304, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 624, 625,
 &end
#
#  38 ASN  HN     39 CYS  HN      3.35             (#peak  1133)
 &rst
  ixpk= 1133, nxpk= 0, iat= 620, 634, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  38 ASN  QB     38 ASN  QD2     3.09             (#peak  1424)
 &rst
  ixpk= 1424, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 624, 625,
 igr2= 629, 630,
 &end
#
#  39 CYS  HN     39 CYS  HB2     4.03             (#peak  1715)
 &rst
  ixpk= 1715, nxpk= 0, iat= 634, 638, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  39 CYS  HN     39 CYS  HB3     4.03             (#peak  1716)
 &rst
  ixpk= 1716, nxpk= 0, iat= 634, 639, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  39 CYS  HN     39 CYS  QB      3.48             (#peak  1716)
 &rst
  ixpk= 1716, nxpk= 0, iat= 634,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 638, 639,
 &end
#
#  39 CYS  HN     40 ALA  QB      5.00   (#peak 1139 )
 &rst
  ixpk= 1139, nxpk= 0, iat= 634,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 649, 650, 651,
 &end
#
#  39 CYS  HB2    86 LEU  HG      6.00             (#peak 434  )
 &rst
  ixpk= 434, nxpk= 0, iat= 638,1345, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  39 CYS  HB3    86 LEU  HG      6.00             (#peak 433  )
 &rst
  ixpk= 433, nxpk= 0, iat= 639,1345, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  40 ALA  HA     41 VAL  HN      3.18             (#peak   779)
 &rst
  ixpk= 779, nxpk= 0, iat= 647, 655, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#  40 ALA  HA     41 VAL  HB      5.27             (#peak   440)
 &rst
  ixpk= 440, nxpk= 0, iat= 647, 659, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  40 ALA  HA     41 VAL  QG2     4.04             (#peak  2400)
 &rst
  ixpk= 2400, nxpk= 0, iat= 647,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 665, 666, 667,
 &end
#
#  40 ALA  HA     61 GLN  HA      5.08             (#peak   439)
 &rst
  ixpk= 439, nxpk= 0, iat= 647, 954, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#  40 ALA  QB     41 VAL  HN      3.13             (#peak   455)
 &rst
  ixpk= 455, nxpk= 0, iat=  -1, 655, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     41 VAL  HB      4.42             (#peak   447)
 &rst
  ixpk= 447, nxpk= 0, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     61 GLN  HN      4.72             (#peak  1400)
 &rst
  ixpk= 1400, nxpk= 0, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     61 GLN  HA      3.05             (#peak   445)
 &rst
  ixpk= 445, nxpk= 0, iat=  -1, 954, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     61 GLN  QB      3.45             (#peak   446)
 &rst
  ixpk= 446, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 649, 650, 651,
 igr2= 956, 957,
 &end
#
#  40 ALA  QB     62 ARG  HN      4.41             (#peak   772)
 &rst
  ixpk= 772, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     62 ARG  HA      3.98             (#peak   450)
 &rst
  ixpk= 450, nxpk= 0, iat=  -1, 971, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 649, 650, 651,
 &end
#
#  40 ALA  QB     62 ARG  HE      6.00             (#peak 452  )
 &rst
  ixpk= 452, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 649, 650, 651,
 &end
#
#  41 VAL  HN     41 VAL  HB      3.20             (#peak   784)
 &rst
  ixpk= 784, nxpk= 0, iat= 655, 659, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  41 VAL  HN     41 VAL  QG2     3.00             (#peak   788)
 &rst
  ixpk= 788, nxpk= 0, iat= 655,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 665, 666, 667,
 &end
#
#  41 VAL  HN     42 ILE  HN      4.88             (#peak   646)
 &rst
  ixpk= 646, nxpk= 0, iat= 655, 671, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#  41 VAL  HN     43 TYR  HN      5.50             (#peak 616  )
 &rst
  ixpk= 616, nxpk= 0, iat= 655, 690, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  41 VAL  HN     61 GLN  HA      4.06             (#peak  1717)
 &rst
  ixpk= 1717, nxpk= 0, iat= 655, 954, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  41 VAL  HN     62 ARG  HN      4.03             (#peak   776)
 &rst
  ixpk= 776, nxpk= 0, iat= 655, 969, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  41 VAL  HN     64 CYS  HA      5.50             (#peak   778)
 &rst
  ixpk= 778, nxpk= 0, iat= 655,1009, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  41 VAL  HA     41 VAL  QG1     3.66             (#peak  2401)
 &rst
  ixpk= 2401, nxpk= 0, iat= 657,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 661, 662, 663,
 &end
#
#  41 VAL  HA     41 VAL  QG2     3.96             (#peak  2401)
 &rst
  ixpk= 2401, nxpk= 0, iat= 657,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 665, 666, 667,
 &end
#
#  41 VAL  HA     42 ILE  HN      3.46             (#peak   649)
 &rst
  ixpk= 649, nxpk= 0, iat= 657, 671, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#  41 VAL  HA     42 ILE  QG2     4.57             (#peak  2427)
 &rst
  ixpk= 2427, nxpk= 0, iat= 657,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 677, 678, 679,
 &end
#
#  41 VAL  HA     43 TYR  HN      3.70             (#peak   623)
 &rst
  ixpk= 623, nxpk= 0, iat= 657, 690, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  41 VAL  HB     59 VAL  QQG     3.95             (#peak   465)
 &rst
  ixpk= 465, nxpk= 0, iat= 659, 922, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  41 VAL  HB     60 MET  HA      5.16             (#peak   668)
 &rst
  ixpk= 668, nxpk= 0, iat= 659, 937, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  41 VAL  HB     61 GLN  HN      3.99             (#peak  1397)
 &rst
  ixpk= 1397, nxpk= 0, iat= 659, 952, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  41 VAL  HB     61 GLN  HA      4.28             (#peak   463)
 &rst
  ixpk= 463, nxpk= 0, iat= 659, 954, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  41 VAL  HB     62 ARG  HN      3.43             (#peak   769)
 &rst
  ixpk= 769, nxpk= 0, iat= 659, 969, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#  41 VAL  QG1    42 ILE  HN      4.05             (#peak  2408)
 &rst
  ixpk= 2408, nxpk= 0, iat=  -1, 671, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 661, 662, 663,
 &end
#
#  41 VAL  QG1    43 TYR  HN      4.51             (#peak  2405)
 &rst
  ixpk= 2405, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr1= 661, 662, 663,
 &end
#
#  41 VAL  QG1    61 GLN  HN      4.73             (#peak  1401)
 &rst
  ixpk= 1401, nxpk= 0, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 661, 662, 663,
 &end
#
#  41 VAL  QG2    61 GLN  HN      5.25             (#peak  1401)
 &rst
  ixpk= 1401, nxpk= 0, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 665, 666, 667,
 &end
#
#  41 VAL  QG2    62 ARG  HN      3.82             (#peak   773)
 &rst
  ixpk= 773, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1= 665, 666, 667,
 &end
#
#  41 VAL  QG2    64 CYS  HA      3.34             (#peak  2399)
 &rst
  ixpk= 2399, nxpk= 0, iat=  -1,1009, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1= 665, 666, 667,
 &end
#
#  41 VAL  QG2    64 CYS  HB2     5.25             (#peak   702)
 &rst
  ixpk= 702, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 665, 666, 667,
 &end
#
#  41 VAL  QG2    64 CYS  HB3     5.25             (#peak  2397)
 &rst
  ixpk= 2397, nxpk= 0, iat=  -1,1012, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 665, 666, 667,
 &end
#
#  41 VAL  QG2    64 CYS  QB      4.43             (#peak  2397)
 &rst
  ixpk= 2397, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 665, 666, 667,
 igr2=1011,1012,
 &end
#
#  42 ILE  HN     42 ILE  HG12    3.86             (#peak   654)
 &rst
  ixpk= 654, nxpk= 0, iat= 671, 681, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  42 ILE  HN     42 ILE  HG13    3.24             (#peak   656)
 &rst
  ixpk= 656, nxpk= 0, iat= 671, 682, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  42 ILE  HN     42 ILE  QD1     4.05             (#peak  2448)
 &rst
  ixpk= 2448, nxpk= 0, iat= 671,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 684, 685, 686,
 &end
#
#  42 ILE  HN     42 ILE  QG2     3.66             (#peak   657)
 &rst
  ixpk= 657, nxpk= 0, iat= 671,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 677, 678, 679,
 &end
#
#  42 ILE  HN     43 TYR  HN      3.23             (#peak   618)
 &rst
  ixpk= 618, nxpk= 0, iat= 671, 690, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  42 ILE  HA     42 ILE  QD1     4.35             (#peak  2444)
 &rst
  ixpk= 2444, nxpk= 0, iat= 673,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 684, 685, 686,
 &end
#
#  42 ILE  HA     42 ILE  QG2     3.11             (#peak  2428)
 &rst
  ixpk= 2428, nxpk= 0, iat= 673,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 677, 678, 679,
 &end
#
#  42 ILE  HA     43 TYR  HB2     6.00             (#peak 473  )
 &rst
  ixpk= 473, nxpk= 0, iat= 673, 694, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  42 ILE  HA     60 MET  QE      5.50             (#peak 2412 )
 &rst
  ixpk= 2412, nxpk= 0, iat= 673,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 946, 947, 948,
 &end
#
#  42 ILE  HB     42 ILE  QD1     3.41             (#peak  2439)
 &rst
  ixpk= 2439, nxpk= 0, iat= 675,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 684, 685, 686,
 &end
#
#  42 ILE  HB     43 TYR  HN      4.52             (#peak   626)
 &rst
  ixpk= 626, nxpk= 0, iat= 675, 690, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  42 ILE  HG12   43 TYR  HN      3.74             (#peak   629)
 &rst
  ixpk= 629, nxpk= 0, iat= 681, 690, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  42 ILE  HG13   43 TYR  HN      2.91             (#peak   630)
 &rst
  ixpk= 630, nxpk= 0, iat= 682, 690, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
#  42 ILE  QD1   124 MET  HA      5.50             (#peak  1751)
 &rst
  ixpk= 1751, nxpk= 0, iat=  -1,1933, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 684, 685, 686,
 &end
#
#  42 ILE  QD1   124 MET  QE      4.12             (#peak  2438)
 &rst
  ixpk= 2438, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 684, 685, 686,
 igr2=1942,1943,1944,
 &end
#
#  42 ILE  QD1   125 PHE  HN      5.50             (#peak  1297)
 &rst
  ixpk= 1297, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 684, 685, 686,
 &end
#
#  42 ILE  QD1    43 TYR  HN      4.10             (#peak  2446)
 &rst
  ixpk= 2446, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 684, 685, 686,
 &end
#
#  42 ILE  QG2    43 TYR  HN      4.23             (#peak   631)
 &rst
  ixpk= 631, nxpk= 0, iat=  -1, 690, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 677, 678, 679,
 &end
#
#  43 TYR  HN     43 TYR  HB2     5.00             (#peak 624  )
 &rst
  ixpk= 624, nxpk= 0, iat= 690, 694, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  43 TYR  HN     43 TYR  HD      6.43             (#peak   619)
 &rst
  ixpk= 619, nxpk= 0, iat= 690,  -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
 igr2= 698, 707,
 &end
#
#  43 TYR  HN     59 VAL  QQG     5.50             (#peak 1937 )
 &rst
  ixpk= 1937, nxpk= 0, iat= 690, 922, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  43 TYR  HA     44 CYS  HN      3.12             (#peak  1597)
 &rst
  ixpk= 1597, nxpk= 0, iat= 692, 711, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  43 TYR  HA     44 CYS  HA      4.42             (#peak   426)
 &rst
  ixpk= 426, nxpk= 0, iat= 692, 713, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  43 TYR  HA     60 MET  QE      4.36             (#peak   468)
 &rst
  ixpk= 468, nxpk= 0, iat= 692,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 946, 947, 948,
 &end
#
#  43 TYR  HB2    44 CYS  HN      4.50             (#peak  1601)
 &rst
  ixpk= 1601, nxpk= 0, iat= 694, 711, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  43 TYR  HB3    44 CYS  HN      3.96             (#peak  1598)
 &rst
  ixpk= 1598, nxpk= 0, iat= 695, 711, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  43 TYR  HD     44 CYS  HN      5.62             (#peak  1595)
 &rst
  ixpk= 1595, nxpk= 0, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1= 698, 707,
 &end
#
#  43 TYR  HD     45 ASN  HN      6.23             (#peak   490)
 &rst
  ixpk= 490, nxpk= 0, iat=  -1, 722, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 698, 707,
 &end
#
#  43 TYR  HD     45 ASN  HA      6.02             (#peak   477)
 &rst
  ixpk= 477, nxpk= 0, iat=  -1, 724, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr1= 698, 707,
 &end
#
#  43 TYR  HD     46 ASP  HN      7.50             (#peak 667  )
 &rst
  ixpk= 667, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr1= 698, 707,
 &end
#
#  43 TYR  HD     60 MET  QE      7.27             (#peak  2981)
 &rst
  ixpk= 2981, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1= 698, 707,
 igr2= 946, 947, 948,
 &end
#
#  44 CYS  HN     44 CYS  HB2     4.11             (#peak  1599)
 &rst
  ixpk= 1599, nxpk= 0, iat= 711, 715, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  44 CYS  HN     44 CYS  HB3     4.11             (#peak  1600)
 &rst
  ixpk= 1600, nxpk= 0, iat= 711, 716, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  44 CYS  HN     44 CYS  QB      3.61             (#peak  1600)
 &rst
  ixpk= 1600, nxpk= 0, iat= 711,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 715, 716,
 &end
#
#  44 CYS  HN     45 ASN  HN      4.44             (#peak   489)
 &rst
  ixpk= 489, nxpk= 0, iat= 711, 722, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  44 CYS  HN     48 PHE  HD      6.73             (#peak  1596)
 &rst
  ixpk= 1596, nxpk= 0, iat= 711,  -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
 igr2= 763, 771,
 &end
#
#  44 CYS  HN     59 VAL  QQG     5.50   (#peak 1604 )
 &rst
  ixpk= 1604, nxpk= 0, iat= 711, 922, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  44 CYS  HN     60 MET  QE      4.11             (#peak  2985)
 &rst
  ixpk= 2985, nxpk= 0, iat= 711,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2= 946, 947, 948,
 &end
#
#  44 CYS  HB2    45 ASN  HN      4.43             (#peak   495)
 &rst
  ixpk= 495, nxpk= 0, iat= 715, 722, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  44 CYS  HB2    48 PHE  HD      6.68             (#peak  2454)
 &rst
  ixpk= 2454, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
 igr2= 763, 771,
 &end
#
#  44 CYS  HB3    45 ASN  HN      4.43             (#peak   496)
 &rst
  ixpk= 496, nxpk= 0, iat= 716, 722, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  44 CYS  HB3    48 PHE  HD      6.68             (#peak  2453)
 &rst
  ixpk= 2453, nxpk= 0, iat= 716,  -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
 igr2= 763, 771,
 &end
#
#  44 CYS  QB     45 ASN  HN      3.71             (#peak   495)
 &rst
  ixpk= 495, nxpk= 0, iat=  -1, 722, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1= 715, 716,
 &end
#
#  44 CYS  QB     48 PHE  HD      6.09             (#peak  2454)
 &rst
  ixpk= 2454, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
 igr1= 715, 716,
 igr2= 763, 771,
 &end
#
#  44 CYS  QB     59 VAL  QQG     3.08             (#peak  2537)
 &rst
  ixpk= 2537, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 715, 716,
 &end
#
#  44 CYS  QB     60 MET  QE      3.78             (#peak  2978)
 &rst
  ixpk= 2978, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 715, 716,
 igr2= 946, 947, 948,
 &end
#
#  45 ASN  HN     45 ASN  HB2     4.11             (#peak   493)
 &rst
  ixpk= 493, nxpk= 0, iat= 722, 726, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  45 ASN  HN     45 ASN  HB3     4.11             (#peak   497)
 &rst
  ixpk= 497, nxpk= 0, iat= 722, 727, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  45 ASN  HN     45 ASN  QB      3.43             (#peak   497)
 &rst
  ixpk= 497, nxpk= 0, iat= 722,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2= 726, 727,
 &end
#
#  45 ASN  HN     46 ASP  HN      4.63             (#peak   488)
 &rst
  ixpk= 488, nxpk= 0, iat= 722, 736, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  45 ASN  HN     48 PHE  HB3     5.50             (#peak 494  )
 &rst
  ixpk= 494, nxpk= 0, iat= 722, 760, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  45 ASN  HN     48 PHE  HD      7.00             (#peak   491)
 &rst
  ixpk= 491, nxpk= 0, iat= 722,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 763, 771,
 &end
#
#  45 ASN  HN     59 VAL  QQG     5.44             (#peak   498)
 &rst
  ixpk= 498, nxpk= 0, iat= 722, 922, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  45 ASN  HA     46 ASP  HN      3.54             (#peak   665)
 &rst
  ixpk= 665, nxpk= 0, iat= 724, 736, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  45 ASN  HA     48 PHE  HD      7.00             (#peak   476)
 &rst
  ixpk= 476, nxpk= 0, iat= 724,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 763, 771,
 &end
#
#  45 ASN  HB2    46 ASP  HN      3.93             (#peak   663)
 &rst
  ixpk= 663, nxpk= 0, iat= 726, 736, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  45 ASN  HB2    48 PHE  HD      6.58             (#peak   480)
 &rst
  ixpk= 480, nxpk= 0, iat= 726,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 763, 771,
 &end
#
#  45 ASN  HB3    46 ASP  HN      3.93             (#peak   662)
 &rst
  ixpk= 662, nxpk= 0, iat= 727, 736, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  45 ASN  HB3    48 PHE  HD      6.58             (#peak   487)
 &rst
  ixpk= 487, nxpk= 0, iat= 727,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 763, 771,
 &end
#
#  45 ASN  HB3    49 CYS  HN      5.50             (#peak 875  )
 &rst
  ixpk= 875, nxpk= 0, iat= 727, 775, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  45 ASN  QB     46 ASP  HN      3.43             (#peak   662)
 &rst
  ixpk= 662, nxpk= 0, iat=  -1, 736, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr1= 726, 727,
 &end
#
#  45 ASN  QB     47 GLY  HN      3.79             (#peak  1591)
 &rst
  ixpk= 1591, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1= 726, 727,
 &end
#
#  45 ASN  QB     47 GLY  HA2     5.24             (#peak  2723)
 &rst
  ixpk= 2723, nxpk= 0, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 726, 727,
 &end
#
#  45 ASN  QB     47 GLY  HA3     4.48             (#peak  2722)
 &rst
  ixpk= 2722, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 726, 727,
 &end
#
#  45 ASN  QB     48 PHE  HN      4.24             (#peak   337)
 &rst
  ixpk= 337, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 726, 727,
 &end
#
#  45 ASN  QB     48 PHE  HD      6.02             (#peak   487)
 &rst
  ixpk= 487, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
 igr1= 726, 727,
 igr2= 763, 771,
 &end
#
#  46 ASP  HN     46 ASP  QB      3.55             (#peak   661)
 &rst
  ixpk= 661, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 740, 741,
 &end
#
#  46 ASP  HN     47 GLY  HN      3.60             (#peak   668)
 &rst
  ixpk= 668, nxpk= 0, iat= 736, 748, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  46 ASP  HN     47 GLY  HA3     4.88             (#peak  1637)
 &rst
  ixpk= 1637, nxpk= 0, iat= 736, 751, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#  46 ASP  HN     48 PHE  HD      6.86             (#peak   666)
 &rst
  ixpk= 666, nxpk= 0, iat= 736,  -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr2= 763, 771,
 &end
#
#  46 ASP  HA     48 PHE  HN      5.50             (#peak   494)
 &rst
  ixpk= 494, nxpk= 0, iat= 738, 755, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  46 ASP  HA     49 CYS  HN      4.04             (#peak   496)
 &rst
  ixpk= 496, nxpk= 0, iat= 738, 775, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  46 ASP  HA     49 CYS  HA      5.07             (#peak   501)
 &rst
  ixpk= 501, nxpk= 0, iat= 738, 777, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#  46 ASP  HA     49 CYS  HB2     4.10             (#peak   498)
 &rst
  ixpk= 498, nxpk= 0, iat= 738, 779, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  46 ASP  HA     49 CYS  HB3     4.10             (#peak   499)
 &rst
  ixpk= 499, nxpk= 0, iat= 738, 780, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  46 ASP  HA     49 CYS  QB      3.51             (#peak   499)
 &rst
  ixpk= 499, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 779, 780,
 &end
#
#  46 ASP  HA     50 GLU  HN      5.50             (#peak   494)
 &rst
  ixpk= 494, nxpk= 0, iat= 738, 786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  46 ASP  HA     50 GLU  QG      4.82             (#peak   502)
 &rst
  ixpk= 502, nxpk= 0, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2= 793, 794,
 &end
#
#  46 ASP  HB2    47 GLY  HN      4.90             (#peak   507)
 &rst
  ixpk= 507, nxpk= 0, iat= 740, 748, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  46 ASP  HB3    47 GLY  HN      4.90             (#peak   507)
 &rst
  ixpk= 507, nxpk= 0, iat= 741, 748, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  46 ASP  QB     47 GLY  HN      4.11             (#peak   507)
 &rst
  ixpk= 507, nxpk= 0, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 740, 741,
 &end
#
#  46 ASP  QB     49 CYS  HN      5.50             (#peak 873  )
 &rst
  ixpk= 873, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 740, 741,
 &end
#
#  47 GLY  HN     48 PHE  HN      3.61             (#peak   345)
 &rst
  ixpk= 345, nxpk= 0, iat= 748, 755, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  47 GLY  HN     49 CYS  HN      4.76             (#peak   863)
 &rst
  ixpk= 863, nxpk= 0, iat= 748, 775, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  47 GLY  HA2    50 GLU  HB2     4.62             (#peak   562)
 &rst
  ixpk= 562, nxpk= 0, iat= 750, 790, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  47 GLY  HA3    48 PHE  HN      3.41             (#peak   340)
 &rst
  ixpk= 340, nxpk= 0, iat= 751, 755, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#  48 PHE  HN     48 PHE  HB2     3.70             (#peak   339)
 &rst
  ixpk= 339, nxpk= 0, iat= 755, 759, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  48 PHE  HN     48 PHE  HB3     3.70             (#peak   338)
 &rst
  ixpk= 338, nxpk= 0, iat= 755, 760, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  48 PHE  HN     48 PHE  QB      3.11             (#peak   339)
 &rst
  ixpk= 339, nxpk= 0, iat= 755,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 759, 760,
 &end
#
#  48 PHE  HN     48 PHE  HD      5.77             (#peak   343)
 &rst
  ixpk= 343, nxpk= 0, iat= 755,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr2= 763, 771,
 &end
#
#  48 PHE  HN     49 CYS  HN      3.49             (#peak   344)
 &rst
  ixpk= 344, nxpk= 0, iat= 755, 775, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  48 PHE  HN     51 LEU  QQD     5.44             (#peak   334)
 &rst
  ixpk= 334, nxpk= 0, iat= 755, 807, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  48 PHE  HA    129 PHE  HB3     6.00             (#peak 523  )
 &rst
  ixpk= 523, nxpk= 0, iat= 757,2025, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  48 PHE  HA     48 PHE  HD      6.07             (#peak   515)
 &rst
  ixpk= 515, nxpk= 0, iat= 757,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 763, 771,
 &end
#
#  48 PHE  HA     51 LEU  HN      3.29             (#peak   849)
 &rst
  ixpk= 849, nxpk= 0, iat= 757, 801, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#  48 PHE  HA     51 LEU  HB2     4.26             (#peak   522)
 &rst
  ixpk= 522, nxpk= 0, iat= 757, 805, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  48 PHE  HA     51 LEU  HB3     4.44             (#peak   578)
 &rst
  ixpk= 578, nxpk= 0, iat= 757, 806, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#  48 PHE  HA     51 LEU  QQD     3.52             (#peak  2485)
 &rst
  ixpk= 2485, nxpk= 0, iat= 757, 807, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#  48 PHE  HB2    49 CYS  HN      4.33             (#peak  1633)
 &rst
  ixpk= 1633, nxpk= 0, iat= 759, 775, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  48 PHE  HB3    49 CYS  HN      4.33             (#peak  1634)
 &rst
  ixpk= 1634, nxpk= 0, iat= 760, 775, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  48 PHE  QB     49 CYS  HN      3.74             (#peak  1633)
 &rst
  ixpk= 1633, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 759, 760,
 &end
#
#  48 PHE  QB     51 LEU  QQD     3.98             (#peak  2488)
 &rst
  ixpk= 2488, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 759, 760,
 &end
#
#  48 PHE  HD     49 CYS  HN      5.73             (#peak   867)
 &rst
  ixpk= 867, nxpk= 0, iat=  -1, 775, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1= 763, 771,
 &end
#
#  48 PHE  HD     49 CYS  HA      6.39             (#peak   531)
 &rst
  ixpk= 531, nxpk= 0, iat=  -1, 777, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr1= 763, 771,
 &end
#
#  48 PHE  HD     51 LEU  HN      6.10             (#peak  1790)
 &rst
  ixpk= 1790, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1= 763, 771,
 &end
#
#  48 PHE  HD     51 LEU  QQD     6.44             (#peak  2483)
 &rst
  ixpk= 2483, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 9.43, r4= 9.93,
 igr1= 763, 771,
 &end
#
#  48 PHE  HD     59 VAL  QG1     6.28             (#peak  2528)
 &rst
  ixpk= 2528, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.47, r4= 8.97,
 igr1= 763, 771,
 igr2= 925, 926, 927,
 &end
#
#  48 PHE  HD     59 VAL  QG2     6.28             (#peak  2528)
 &rst
  ixpk= 2528, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.47, r4= 8.97,
 igr1= 763, 771,
 igr2= 929, 930, 931,
 &end
#
#  48 PHE  HD     59 VAL  QQG     5.67             (#peak  2528)
 &rst
  ixpk= 2528, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
 igr1= 763, 771,
 &end
#
#  48 PHE  HD     60 MET  QE      7.24             (#peak  2983)
 &rst
  ixpk= 2983, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.76, r4=10.26,
 igr1= 763, 771,
 igr2= 946, 947, 948,
 &end
#
#  48 PHE HD      62 ARG  QD      8.00             (#peak 2737 )
 &rst
  ixpk= 2737, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
 igr1= 763, 771,
 igr2= 979, 980,
 &end
#
#  49 CYS  HN     49 CYS  HB2     3.45             (#peak   871)
 &rst
  ixpk= 871, nxpk= 0, iat= 775, 779, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  49 CYS  HN     49 CYS  HB3     3.45             (#peak   872)
 &rst
  ixpk= 872, nxpk= 0, iat= 775, 780, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#  49 CYS  HN     50 GLU  HN      3.12             (#peak   862)
 &rst
  ixpk= 862, nxpk= 0, iat= 775, 786, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  49 CYS  HN     50 GLU  HA      5.43             (#peak   553)
 &rst
  ixpk= 553, nxpk= 0, iat= 775, 788, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#  49 CYS  HN     50 GLU  QG      4.23             (#peak   874)
 &rst
  ixpk= 874, nxpk= 0, iat= 775,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 793, 794,
 &end
#
#  49 CYS  HN     51 LEU  HN      4.12             (#peak   848)
 &rst
  ixpk= 848, nxpk= 0, iat= 775, 801, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  49 CYS  HA     50 GLU  HG3     5.50             (#peak 536  )
 &rst
  ixpk= 536, nxpk= 0, iat= 777, 794, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  49 CYS  HA     52 CYS  HN      4.89             (#peak  1571)
 &rst
  ixpk= 1571, nxpk= 0, iat= 777, 820, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  49 CYS  HA     53 GLY  HN      4.52             (#peak  1495)
 &rst
  ixpk= 1495, nxpk= 0, iat= 777, 831, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  49 CYS  HA     54 TYR  HN      5.00             (#peak   991)
 &rst
  ixpk= 991, nxpk= 0, iat= 777, 838, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  49 CYS  HA     59 VAL  QG1     5.50             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 925, 926, 927,
 &end
#
#  49 CYS  HA     59 VAL  QG2     5.50             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat= 777,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 929, 930, 931,
 &end
#
#  49 CYS  QB     50 GLU  HN      3.44             (#peak   908)
 &rst
  ixpk= 908, nxpk= 0, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr1= 779, 780,
 &end
#
#  49 CYS  QB     50 GLU  QG      4.03             (#peak   548)
 &rst
  ixpk= 548, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 779, 780,
 igr2= 793, 794,
 &end
#
#  50 GLU  HN     50 GLU  HB2     2.71             (#peak   912)
 &rst
  ixpk= 912, nxpk= 0, iat= 786, 790, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#  50 GLU  HN     50 GLU  HG2     3.84             (#peak  2387)
 &rst
  ixpk= 2387, nxpk= 0, iat= 786, 793, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  50 GLU  HN     50 GLU  HG3     3.84             (#peak   910)
 &rst
  ixpk= 910, nxpk= 0, iat= 786, 794, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  50 GLU  HN     50 GLU  QG      3.27             (#peak   910)
 &rst
  ixpk= 910, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr2= 793, 794,
 &end
#
#  50 GLU  HN     51 LEU  HN      3.26             (#peak   898)
 &rst
  ixpk= 898, nxpk= 0, iat= 786, 801, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  50 GLU  HN     51 LEU  HB2     4.60             (#peak   917)
 &rst
  ixpk= 917, nxpk= 0, iat= 786, 805, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  50 GLU  HN     51 LEU  QD2     6.00             (#peak 919  )
 &rst
  ixpk= 919, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 814, 815, 816,
 &end
#
#  50 GLU  HN     52 CYS  HN      4.69             (#peak  1566)
 &rst
  ixpk= 1566, nxpk= 0, iat= 786, 820, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  50 GLU  HN     53 GLY  QA      5.34             (#peak   906)
 &rst
  ixpk= 906, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 833, 834,
 &end
#
#  50 GLU  HA     50 GLU  HB3     2.86             (#peak   556)
 &rst
  ixpk= 556, nxpk= 0, iat= 788, 791, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#  50 GLU  HA     50 GLU  HG2     4.00             (#peak   558)
 &rst
  ixpk= 558, nxpk= 0, iat= 788, 793, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  50 GLU  HA     50 GLU  HG3     4.00             (#peak   557)
 &rst
  ixpk= 557, nxpk= 0, iat= 788, 794, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  50 GLU  HA     50 GLU  QG      3.24             (#peak   557)
 &rst
  ixpk= 557, nxpk= 0, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 793, 794,
 &end
#
#  50 GLU  HA     53 GLY  HN      4.32             (#peak   550)
 &rst
  ixpk= 550, nxpk= 0, iat= 788, 831, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  50 GLU  HA     53 GLY  QA      4.34             (#peak   555)
 &rst
  ixpk= 555, nxpk= 0, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2= 833, 834,
 &end
#
#  50 GLU  HB2    51 LEU  HN      3.22             (#peak   853)
 &rst
  ixpk= 853, nxpk= 0, iat= 790, 801, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#  50 GLU  HB2    51 LEU  HA      4.40             (#peak   573)
 &rst
  ixpk= 573, nxpk= 0, iat= 790, 803, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  50 GLU  QG     51 LEU  HN      4.23             (#peak   851)
 &rst
  ixpk= 851, nxpk= 0, iat=  -1, 801, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 793, 794,
 &end
#
#  51 LEU  HN     51 LEU  HB2     3.20             (#peak   855)
 &rst
  ixpk= 855, nxpk= 0, iat= 801, 805, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  51 LEU  HN     51 LEU  HB3     3.20             (#peak   854)
 &rst
  ixpk= 854, nxpk= 0, iat= 801, 806, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  51 LEU  HN     51 LEU  HG      4.53             (#peak   856)
 &rst
  ixpk= 856, nxpk= 0, iat= 801, 808, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  51 LEU  HN     51 LEU  QD1     4.35             (#peak   857)
 &rst
  ixpk= 857, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 810, 811, 812,
 &end
#
#  51 LEU  HN     51 LEU  QD2     4.35             (#peak  2501)
 &rst
  ixpk= 2501, nxpk= 0, iat= 801,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 814, 815, 816,
 &end
#
#  51 LEU  HN     51 LEU  QQD     3.76             (#peak  2501)
 &rst
  ixpk= 2501, nxpk= 0, iat= 801, 807, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,  &end
#
#  51 LEU  HN     52 CYS  HN      3.60             (#peak  1564)
 &rst
  ixpk= 1564, nxpk= 0, iat= 801, 820, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  51 LEU  HN     53 GLY  HN      4.60             (#peak  1492)
 &rst
  ixpk= 1492, nxpk= 0, iat= 801, 831, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  51 LEU  HA    131 VAL  QQG     4.53             (#peak  1933)
 &rst
  ixpk= 1933, nxpk= 0, iat= 803,2058, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,  &end
#
#  51 LEU  HA     51 LEU  HG      3.88             (#peak   571)
 &rst
  ixpk= 571, nxpk= 0, iat= 803, 808, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  51 LEU  HA     51 LEU  QD1     4.08             (#peak   568)
 &rst
  ixpk= 568, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 810, 811, 812,
 &end
#
#  51 LEU  HA     51 LEU  QD2     4.08             (#peak  2495)
 &rst
  ixpk= 2495, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 814, 815, 816,
 &end
#
#  51 LEU  HA     51 LEU  QQD     2.94             (#peak  2495)
 &rst
  ixpk= 2495, nxpk= 0, iat= 803, 807, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  51 LEU  HA     52 CYS  HA      4.69             (#peak   565)
 &rst
  ixpk= 565, nxpk= 0, iat= 803, 822, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  51 LEU  HB2    51 LEU  QD1     3.41             (#peak  2489)
 &rst
  ixpk= 2489, nxpk= 0, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 810, 811, 812,
 &end
#
#  51 LEU  HB2    51 LEU  QD2     3.41             (#peak  2508)
 &rst
  ixpk= 2508, nxpk= 0, iat= 805,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 814, 815, 816,
 &end
#
#  51 LEU  HB2    52 CYS  HN      3.84             (#peak  1577)
 &rst
  ixpk= 1577, nxpk= 0, iat= 805, 820, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  51 LEU  HB2    53 GLY  HN      5.50             (#peak  1500)
 &rst
  ixpk= 1500, nxpk= 0, iat= 805, 831, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  51 LEU  HB3    52 CYS  HN      3.56             (#peak  1576)
 &rst
  ixpk= 1576, nxpk= 0, iat= 806, 820, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  51 LEU  HG     52 CYS  HN      3.89             (#peak  1578)
 &rst
  ixpk= 1578, nxpk= 0, iat= 808, 820, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  51 LEU  HG     53 GLY  HN      5.34             (#peak  1501)
 &rst
  ixpk= 1501, nxpk= 0, iat= 808, 831, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  51 LEU  QD1   129 PHE  HB3     4.61             (#peak  2487)
 &rst
  ixpk= 2487, nxpk= 0, iat=  -1,2025, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 810, 811, 812,
 &end
#
#  51 LEU  QD1   131 VAL  HN      5.17             (#peak   197)
 &rst
  ixpk= 197, nxpk= 0, iat=  -1,2055, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1= 810, 811, 812,
 &end
#
#  51 LEU  QD1    52 CYS  HN      4.33             (#peak  1579)
 &rst
  ixpk= 1579, nxpk= 0, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 810, 811, 812,
 &end
#
#  51 LEU  QD1    98 PHE  HD      6.23             (#peak  2480)
 &rst
  ixpk= 2480, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
 igr1= 810, 811, 812,
 igr2=1537,1545,
 &end
#
#  51 LEU  QD2   100 ARG  HE 6.00   (#peak 1711 )
 &rst
  ixpk= 1711, nxpk= 0, iat=  -1,1583, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1= 814, 815, 816,
 &end
#
#  51 LEU  QD2   106 PHE  HD      7.50             (#peak 2499 )
 &rst
  ixpk= 2499, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1= 814, 815, 816,
 igr2=1665,1673,
 &end
#
#  51 LEU  QD2   129 PHE  HB3     4.61             (#peak  2505)
 &rst
  ixpk= 2505, nxpk= 0, iat=  -1,2025, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 814, 815, 816,
 &end
#
#  51 LEU  QD2   131 VAL  HN      5.17             (#peak   196)
 &rst
  ixpk= 196, nxpk= 0, iat=  -1,2055, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1= 814, 815, 816,
 &end
#
#  51 LEU  QD2    52 CYS  HN      4.33             (#peak  2500)
 &rst
  ixpk= 2500, nxpk= 0, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 814, 815, 816,
 &end
#
#  51 LEU  QD2    98 PHE  HD      6.23             (#peak  2498)
 &rst
  ixpk= 2498, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
 igr1= 814, 815, 816,
 igr2=1537,1545,
 &end
#
#  51 LEU  QQD   129 PHE  HN      4.29             (#peak   550)
 &rst
  ixpk= 550, nxpk= 0, iat= 807,2020, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,  &end
#
#  51 LEU  QQD   129 PHE  HB2     3.67             (#peak  2486)
 &rst
  ixpk= 2486, nxpk= 0, iat= 807,2024, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
#  51 LEU  QQD   129 PHE  HB3     3.43             (#peak  2487)
 &rst
  ixpk= 2487, nxpk= 0, iat= 807,2025, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  51 LEU  QQD   129 PHE  HD      5.67             (#peak  2478)
 &rst
  ixpk= 2478, nxpk= 0, iat= 807,  -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
 igr2=2028,2036,
 &end
#
#  51 LEU  QQD   131 VAL  HN      4.18             (#peak   196)
 &rst
  ixpk= 196, nxpk= 0, iat= 807,2055, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,  &end
#
#  51 LEU  QQD   131 VAL  QQG     2.75             (#peak  1944)
 &rst
  ixpk= 1944, nxpk= 0, iat= 807,2058, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,  &end
#
#  51 LEU  QQD    52 CYS  HN      3.79             (#peak  1579)
 &rst
  ixpk= 1579, nxpk= 0, iat= 807, 820, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#  51 LEU  QQD    53 GLY  HN      5.44             (#peak  1502)
 &rst
  ixpk= 1502, nxpk= 0, iat= 807, 831, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,  &end
#
#  52 CYS  HN     52 CYS  QB      3.63             (#peak  1574)
 &rst
  ixpk= 1574, nxpk= 0, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
 igr2= 824, 825,
 &end
#
#  52 CYS  HN     53 GLY  HN      3.34             (#peak  1490)
 &rst
  ixpk= 1490, nxpk= 0, iat= 820, 831, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  52 CYS  HN     54 TYR  HN      4.59             (#peak   987)
 &rst
  ixpk= 987, nxpk= 0, iat= 820, 838, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  52 CYS  HN     54 TYR  HD      7.29             (#peak  1567)
 &rst
  ixpk= 1567, nxpk= 0, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr2= 846, 855,
 &end
#
#  52 CYS  HB2    54 TYR  HD      6.66             (#peak  2512)
 &rst
  ixpk= 2512, nxpk= 0, iat= 824,  -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
 igr2= 846, 855,
 &end
#
#  52 CYS  HB3    54 TYR  HD      6.66             (#peak   593)
 &rst
  ixpk= 593, nxpk= 0, iat= 825,  -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
 igr2= 846, 855,
 &end
#
#  52 CYS  QB     53 GLY  HN      4.10             (#peak  1497)
 &rst
  ixpk= 1497, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 824, 825,
 &end
#
#  53 GLY  HN     54 TYR  HN      3.27             (#peak   985)
 &rst
  ixpk= 985, nxpk= 0, iat= 831, 838, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  53 GLY  HN     54 TYR  QB      5.20             (#peak  1498)
 &rst
  ixpk= 1498, nxpk= 0, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 842, 843,
 &end
#
#  53 GLY  HN     54 TYR  HD      6.92             (#peak  1491)
 &rst
  ixpk= 1491, nxpk= 0, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr2= 846, 855,
 &end
#
#  54 TYR  HN     54 TYR  QB      3.02             (#peak   993)
 &rst
  ixpk= 993, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2= 842, 843,
 &end
#
#  54 TYR  HN     54 TYR  HD      5.47             (#peak   988)
 &rst
  ixpk= 988, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2= 846, 855,
 &end
#
#  54 TYR  HN     55 SER  HN      4.03             (#peak  1224)
 &rst
  ixpk= 1224, nxpk= 0, iat= 838, 859, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  54 TYR  HA     54 TYR  HD      6.11             (#peak   602)
 &rst
  ixpk= 602, nxpk= 0, iat= 840,  -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
 igr2= 846, 855,
 &end
#
#  54 TYR  HB2    55 SER  HN      4.14             (#peak  1229)
 &rst
  ixpk= 1229, nxpk= 0, iat= 842, 859, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  54 TYR  HB3    55 SER  HN      4.14             (#peak  1229)
 &rst
  ixpk= 1229, nxpk= 0, iat= 843, 859, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#  54 TYR  QB     55 SER  HN      3.39             (#peak  1229)
 &rst
  ixpk= 1229, nxpk= 0, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1= 842, 843,
 &end
#
#  54 TYR  QB     58 GLU  QB      4.71             (#peak  2517)
 &rst
  ixpk= 2517, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 842, 843,
 igr2= 908, 909,
 &end
#
#  54 TYR  QB     59 VAL  QQG     4.20             (#peak   608)
 &rst
  ixpk= 608, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
 igr1= 842, 843,
 &end
#
#  54 TYR  HD     55 SER  HN      6.04             (#peak  1225)
 &rst
  ixpk= 1225, nxpk= 0, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
 igr1= 846, 855,
 &end
#
#  54 TYR  HD     59 VAL  QQG     6.38             (#peak  2527)
 &rst
  ixpk= 2527, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 9.36, r4= 9.86,
 igr1= 846, 855,
 &end
#
#  54 TYR  HD     69 LEU  QD1     7.00             (#peak 2920 )
 &rst
  ixpk= 2920, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 846, 855,
 igr2=1084,1085,1086,
 &end
#
#  55 SER  HN     55 SER  HB2     4.21             (#peak  1227)
 &rst
  ixpk= 1227, nxpk= 0, iat= 859, 863, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  55 SER  HN     55 SER  HB3     4.21             (#peak  1228)
 &rst
  ixpk= 1228, nxpk= 0, iat= 859, 864, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  55 SER  HN     55 SER  QB      3.57             (#peak  1228)
 &rst
  ixpk= 1228, nxpk= 0, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2= 863, 864,
 &end
#
#  55 SER  HN     56 ARG  HN      4.83             (#peak  1719)
 &rst
  ixpk= 1719, nxpk= 0, iat= 859, 870, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  55 SER  HN     58 GLU  HN      4.87             (#peak  1276)
 &rst
  ixpk= 1276, nxpk= 0, iat= 859, 904, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  55 SER  HN     58 GLU  HB2     5.50             (#peak 1230 )
 &rst
  ixpk= 1230, nxpk= 0, iat= 859, 908, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  55 SER  HN     58 GLU  HG2     5.50             (#peak  1231)
 &rst
  ixpk= 1231, nxpk= 0, iat= 859, 911, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  55 SER  HN     58 GLU  HG3     5.50             (#peak  1231)
 &rst
  ixpk= 1231, nxpk= 0, iat= 859, 912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  55 SER  HN     58 GLU  QB      4.04             (#peak  1232)
 &rst
  ixpk= 1232, nxpk= 0, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 908, 909,
 &end
#
#  55 SER  HN     58 GLU  QG      4.84             (#peak  1231)
 &rst
  ixpk= 1231, nxpk= 0, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 911, 912,
 &end
#
#  55 SER  HN     59 VAL  QQG     4.26             (#peak  1234)
 &rst
  ixpk= 1234, nxpk= 0, iat= 859, 922, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,  &end
#
#  55 SER  HA     56 ARG  HN      3.15             (#peak   509)
 &rst
  ixpk= 509, nxpk= 0, iat= 861, 870, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  55 SER  HA     56 ARG  QB      6.00             (#peak 612  )
 &rst
  ixpk= 612, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2= 874, 875,
 &end
#
#  55 SER  HA     57 ALA  HN      4.51             (#peak   613)
 &rst
  ixpk= 613, nxpk= 0, iat= 861, 894, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  55 SER  HA     57 ALA  QB      5.50             (#peak   640)
 &rst
  ixpk= 640, nxpk= 0, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 898, 899, 900,
 &end
#
#  55 SER  HB2    56 ARG  HN      4.58             (#peak   508)
 &rst
  ixpk= 508, nxpk= 0, iat= 863, 870, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  55 SER  HB3    56 ARG  HN      4.58             (#peak   615)
 &rst
  ixpk= 615, nxpk= 0, iat= 864, 870, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  55 SER  QB     56 ARG  HN      3.74             (#peak   508)
 &rst
  ixpk= 508, nxpk= 0, iat=  -1, 870, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 863, 864,
 &end
#
#  55 SER  QB     57 ALA  QB      3.97             (#peak   639)
 &rst
  ixpk= 639, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 863, 864,
 igr2= 898, 899, 900,
 &end
#
#  55 SER  QB     58 GLU  QB      4.25             (#peak  2516)
 &rst
  ixpk= 2516, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 863, 864,
 igr2= 908, 909,
 &end
#
#  55 SER  QB     59 VAL  QQG     5.28             (#peak  2534)
 &rst
  ixpk= 2534, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
 igr1= 863, 864,
 &end
#
#  56 ARG  HN     56 ARG  HB2     3.65             (#peak   503)
 &rst
  ixpk= 503, nxpk= 0, iat= 870, 874, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  56 ARG  HN     56 ARG  HB3     3.65             (#peak   503)
 &rst
  ixpk= 503, nxpk= 0, iat= 870, 875, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
#  56 ARG  HN     56 ARG  QB      3.17             (#peak   503)
 &rst
  ixpk= 503, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 874, 875,
 &end
#
#  56 ARG  HN     57 ALA  HN      3.43             (#peak  1034)
 &rst
  ixpk= 1034, nxpk= 0, iat= 870, 894, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#  56 ARG  HN     57 ALA  QB      4.37             (#peak   501)
 &rst
  ixpk= 501, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 898, 899, 900,
 &end
#
#  56 ARG  HN     58 GLU  HG3     6.00             (#peak 504  )
 &rst
  ixpk= 504, nxpk= 0, iat= 870, 912, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  56 ARG  HN     59 VAL  HN      5.31             (#peak   511)
 &rst
  ixpk= 511, nxpk= 0, iat= 870, 919, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  56 ARG  HA     57 ALA  QB      5.50             (#peak 627  )
 &rst
  ixpk= 627, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 898, 899, 900,
 &end
#
#  56 ARG  HA     59 VAL  HN      4.55             (#peak  1012)
 &rst
  ixpk= 1012, nxpk= 0, iat= 872, 919, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  56 ARG  HA     59 VAL  HB      4.83             (#peak   624)
 &rst
  ixpk= 624, nxpk= 0, iat= 872, 923, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  56 ARG  HA     59 VAL  QG1     4.53             (#peak   628)
 &rst
  ixpk= 628, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 925, 926, 927,
 &end
#
#  56 ARG  HA     59 VAL  QG2     4.53             (#peak   628)
 &rst
  ixpk= 628, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 929, 930, 931,
 &end
#
#  56 ARG  HA     59 VAL  QQG     3.93             (#peak   628)
 &rst
  ixpk= 628, nxpk= 0, iat= 872, 922, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
#  56 ARG  HB2    57 ALA  HN      4.87             (#peak  1044)
 &rst
  ixpk= 1044, nxpk= 0, iat= 874, 894, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  56 ARG  HB3    57 ALA  HN      4.87             (#peak  1044)
 &rst
  ixpk= 1044, nxpk= 0, iat= 875, 894, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  56 ARG  QB     57 ALA  HN      4.19             (#peak  1044)
 &rst
  ixpk= 1044, nxpk= 0, iat=  -1, 894, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 874, 875,
 &end
#
#  57 ALA  HN     57 ALA  HA      2.94             (#peak  1039)
 &rst
  ixpk= 1039, nxpk= 0, iat= 894, 896, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
#  57 ALA  HN     57 ALA  QB      2.43             (#peak  1046)
 &rst
  ixpk= 1046, nxpk= 0, iat= 894,  -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
 igr2= 898, 899, 900,
 &end
#
#  57 ALA  HN     58 GLU  HN      3.34             (#peak  1036)
 &rst
  ixpk= 1036, nxpk= 0, iat= 894, 904, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#  57 ALA  HN     59 VAL  HN      4.20             (#peak  1037)
 &rst
  ixpk= 1037, nxpk= 0, iat= 894, 919, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  57 ALA  HA     59 VAL  HN      4.66             (#peak   636)
 &rst
  ixpk= 636, nxpk= 0, iat= 896, 919, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  57 ALA  HA     60 MET  HN      4.33             (#peak   634)
 &rst
  ixpk= 634, nxpk= 0, iat= 896, 935, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#  57 ALA  HA     60 MET  QB      4.26             (#peak   632)
 &rst
  ixpk= 632, nxpk= 0, iat= 896,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 939, 940,
 &end
#
#  57 ALA  QB     58 GLU  HN      3.20             (#peak  1286)
 &rst
  ixpk= 1286, nxpk= 0, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr1= 898, 899, 900,
 &end
#
#  57 ALA  QB     58 GLU  HA      4.56             (#peak   646)
 &rst
  ixpk= 646, nxpk= 0, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 898, 899, 900,
 &end
#
#  57 ALA  QB     58 GLU  QG      4.08             (#peak   641)
 &rst
  ixpk= 641, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 898, 899, 900,
 igr2= 911, 912,
 &end
#
#  57 ALA  QB     59 VAL  HN      4.87             (#peak    74)
 &rst
  ixpk= 74, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 898, 899, 900,
 &end
#
#  58 GLU  HN     58 GLU  HB2     3.60             (#peak  1284)
 &rst
  ixpk= 1284, nxpk= 0, iat= 904, 908, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  58 GLU  HN     58 GLU  HB3     3.60             (#peak  1285)
 &rst
  ixpk= 1285, nxpk= 0, iat= 904, 909, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  58 GLU  HN     58 GLU  HG2     3.93             (#peak  1742)
 &rst
  ixpk= 1742, nxpk= 0, iat= 904, 911, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  58 GLU  HN     58 GLU  HG3     3.93             (#peak  1743)
 &rst
  ixpk= 1743, nxpk= 0, iat= 904, 912, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  58 GLU  HN     58 GLU  QB      3.14             (#peak  1285)
 &rst
  ixpk= 1285, nxpk= 0, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr2= 908, 909,
 &end
#
#  58 GLU  HN     58 GLU  QG      3.23             (#peak  1743)
 &rst
  ixpk= 1743, nxpk= 0, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2= 911, 912,
 &end
#
#  58 GLU  HN     59 VAL  HN      3.32             (#peak  1279)
 &rst
  ixpk= 1279, nxpk= 0, iat= 904, 919, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  58 GLU  HN     59 VAL  QG1     4.78             (#peak  1287)
 &rst
  ixpk= 1287, nxpk= 0, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 925, 926, 927,
 &end
#
#  58 GLU  HN     59 VAL  QG2     4.78             (#peak  1287)
 &rst
  ixpk= 1287, nxpk= 0, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2= 929, 930, 931,
 &end
#
#  58 GLU  HN     59 VAL  QQG     4.18             (#peak  1287)
 &rst
  ixpk= 1287, nxpk= 0, iat= 904, 922, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,  &end
#
#  58 GLU  HN     60 MET  HN      3.97             (#peak  1278)
 &rst
  ixpk= 1278, nxpk= 0, iat= 904, 935, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  58 GLU  HN     60 MET  QG      5.24             (#peak  1282)
 &rst
  ixpk= 1282, nxpk= 0, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2= 942, 943,
 &end
#
#  58 GLU  HA     58 GLU  QG      3.21             (#peak   643)
 &rst
  ixpk= 643, nxpk= 0, iat= 906,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2= 911, 912,
 &end
#
#  58 GLU  HA     59 VAL  QG1     5.50             (#peak   645)
 &rst
  ixpk= 645, nxpk= 0, iat= 906,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 925, 926, 927,
 &end
#
#  58 GLU  HA     59 VAL  QG2     5.50             (#peak   645)
 &rst
  ixpk= 645, nxpk= 0, iat= 906,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 929, 930, 931,
 &end
#
#  58 GLU  QB     59 VAL  HN      4.19             (#peak  1014)
 &rst
  ixpk= 1014, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 908, 909,
 &end
#
#  58 GLU  QG     59 VAL  HN      4.67             (#peak  1015)
 &rst
  ixpk= 1015, nxpk= 0, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1= 911, 912,
 &end
#
#  59 VAL  HN     59 VAL  HB      3.74             (#peak  1016)
 &rst
  ixpk= 1016, nxpk= 0, iat= 919, 923, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  59 VAL  HN     59 VAL  QG1     3.72             (#peak   940)
 &rst
  ixpk= 940, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 925, 926, 927,
 &end
#
#  59 VAL  HN     59 VAL  QG2     3.72             (#peak   940)
 &rst
  ixpk= 940, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 929, 930, 931,
 &end
#
#  59 VAL  HN     59 VAL  QQG     3.26             (#peak   940)
 &rst
  ixpk= 940, nxpk= 0, iat= 919, 922, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  59 VAL  HN     60 MET  HN      3.23             (#peak  1260)
 &rst
  ixpk= 1260, nxpk= 0, iat= 919, 935, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  59 VAL  HN     60 MET  QG      4.77             (#peak  1013)
 &rst
  ixpk= 1013, nxpk= 0, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr2= 942, 943,
 &end
#
#  59 VAL  HA     59 VAL  QG1     3.68             (#peak  2535)
 &rst
  ixpk= 2535, nxpk= 0, iat= 921,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 925, 926, 927,
 &end
#
#  59 VAL  HA     59 VAL  QG2     3.68             (#peak  2535)
 &rst
  ixpk= 2535, nxpk= 0, iat= 921,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 929, 930, 931,
 &end
#
#  59 VAL  HA     62 ARG  HD2     4.76             (#peak  2734)
 &rst
  ixpk= 2734, nxpk= 0, iat= 921, 979, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  59 VAL  HA     62 ARG  HD3     4.76             (#peak  2734)
 &rst
  ixpk= 2734, nxpk= 0, iat= 921, 980, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  59 VAL  HA     62 ARG  HE      4.76             (#peak   651)
 &rst
  ixpk= 651, nxpk= 0, iat= 921, 982, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  59 VAL  HA     62 ARG  QB      4.21             (#peak   654)
 &rst
  ixpk= 654, nxpk= 0, iat= 921,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 973, 974,
 &end
#
#  59 VAL  HA     62 ARG  QD      4.14             (#peak  2734)
 &rst
  ixpk= 2734, nxpk= 0, iat= 921,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 979, 980,
 &end
#
#  59 VAL  HA     62 ARG  QG      4.08             (#peak   655)
 &rst
  ixpk= 655, nxpk= 0, iat= 921,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 976, 977,
 &end
#
#  59 VAL  HB     60 MET  HN      4.62             (#peak   658)
 &rst
  ixpk= 658, nxpk= 0, iat= 923, 935, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  59 VAL  HB     60 MET  HA      5.00             (#peak 667  )
 &rst
  ixpk= 667, nxpk= 0, iat= 923, 937, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  59 VAL  QG1    60 MET  HN      4.80             (#peak  1271)
 &rst
  ixpk= 1271, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 925, 926, 927,
 &end
#
#  59 VAL  QG2    60 MET  HN      4.80             (#peak  1271)
 &rst
  ixpk= 1271, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 929, 930, 931,
 &end
#
#  59 VAL  QQG    49 CYS  HN      6.00             (#peak 876  )
 &rst
  ixpk= 876, nxpk= 0, iat= 922, 775, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,  &end
#
#  59 VAL  QQG    54 TYR  HN      6.00             (#peak 996  )
 &rst
  ixpk= 996, nxpk= 0, iat= 922, 838, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,  &end
#
#  59 VAL  QQG    60 MET  HN      3.95             (#peak  1271)
 &rst
  ixpk= 1271, nxpk= 0, iat= 922, 935, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  59 VAL  QQG    60 MET  HA      4.14             (#peak   665)
 &rst
  ixpk= 665, nxpk= 0, iat= 922, 937, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,  &end
#
#  59 VAL  QQG    60 MET  QE      3.82             (#peak  2979)
 &rst
  ixpk= 2979, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 946, 947, 948,
 &end
#
#  59 VAL  QQG    61 GLN  HN      4.24             (#peak  1402)
 &rst
  ixpk= 1402, nxpk= 0, iat= 922, 952, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,  &end
#
#  59 VAL  QQG    61 GLN  QG      5.50             (#peak 2545 )
 &rst
  ixpk= 2545, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
 igr2= 959, 960,
 &end
#
#  59 VAL  QQG    62 ARG  HN      4.74             (#peak   774)
 &rst
  ixpk= 774, nxpk= 0, iat= 922, 969, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,  &end
#
#  59 VAL  QQG    62 ARG  HA      5.50             (#peak 1934 )
 &rst
  ixpk= 1934, nxpk= 0, iat= 922, 971, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,  &end
#
#  59 VAL  QQG    62 ARG  QD      4.61             (#peak  2735)
 &rst
  ixpk= 2735, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
 igr2= 979, 980,
 &end
#
#  59 VAL  QQG    62 ARG  QG      4.72             (#peak  2552)
 &rst
  ixpk= 2552, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
 igr2= 976, 977,
 &end
#
#  60 MET  HN     60 MET  HG2     4.18             (#peak  1265)
 &rst
  ixpk= 1265, nxpk= 0, iat= 935, 942, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  60 MET  HN     60 MET  HG3     4.18             (#peak  1266)
 &rst
  ixpk= 1266, nxpk= 0, iat= 935, 943, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  60 MET  HN     60 MET  QB      2.99             (#peak  1267)
 &rst
  ixpk= 1267, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 939, 940,
 &end
#
#  60 MET  HN     60 MET  QE      3.77             (#peak  2984)
 &rst
  ixpk= 2984, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 946, 947, 948,
 &end
#
#  60 MET  HN     60 MET  QG      3.41             (#peak  1265)
 &rst
  ixpk= 1265, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2= 942, 943,
 &end
#
#  60 MET  HN     61 GLN  HN      4.34             (#peak  1720)
 &rst
  ixpk= 1720, nxpk= 0, iat= 935, 952, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  60 MET  HN     61 GLN  HG3     5.50             (#peak  1744)
 &rst
  ixpk= 1744, nxpk= 0, iat= 935, 960, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  60 MET  HN     61 GLN  QG      5.50             (#peak 1625 )
 &rst
  ixpk= 1625, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 959, 960,
 &end
#
#  60 MET  HA     60 MET  QE      3.38             (#peak  2976)
 &rst
  ixpk= 2976, nxpk= 0, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 946, 947, 948,
 &end
#
#  60 MET  HA     61 GLN  HN      3.22             (#peak  1395)
 &rst
  ixpk= 1395, nxpk= 0, iat= 937, 952, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#  60 MET  HA     61 GLN  HG2     5.00             (#peak   669)
 &rst
  ixpk= 669, nxpk= 0, iat= 937, 959, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  60 MET  HA     61 GLN  HG3     4.76             (#peak   669)
 &rst
  ixpk= 669, nxpk= 0, iat= 937, 960, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  60 MET  HA     62 ARG  QB      5.50             (#peak 666  )
 &rst
  ixpk= 666, nxpk= 0, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 973, 974,
 &end
#
#  60 MET  HB2    61 GLN  HN      5.49             (#peak  1399)
 &rst
  ixpk= 1399, nxpk= 0, iat= 939, 952, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  60 MET  HB3    61 GLN  HN      5.49             (#peak  1399)
 &rst
  ixpk= 1399, nxpk= 0, iat= 940, 952, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  60 MET  HG2    61 GLN  HE21 5.50   (#peak 1503 )
 &rst
  ixpk= 1503, nxpk= 0, iat= 942, 964, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  60 MET  HG2    61 GLN  HE22 6.00   (#peak 1506 )
 &rst
  ixpk= 1506, nxpk= 0, iat= 942, 965, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  60 MET  QG     60 MET  QE      3.03             (#peak  2977)
 &rst
  ixpk= 2977, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1= 942, 943,
 igr2= 946, 947, 948,
 &end
#
#  61 GLN  HN     61 GLN  HG2     3.79             (#peak  1396)
 &rst
  ixpk= 1396, nxpk= 0, iat= 952, 959, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  61 GLN  HN     61 GLN  HG3     4.11             (#peak  1396)
 &rst
  ixpk= 1396, nxpk= 0, iat= 952, 960, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  61 GLN  HN     62 ARG  HN      3.32             (#peak   763)
 &rst
  ixpk= 763, nxpk= 0, iat= 952, 969, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  61 GLN  HN     62 ARG  QB      4.63             (#peak  1398)
 &rst
  ixpk= 1398, nxpk= 0, iat= 952,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2= 973, 974,
 &end
#
#  61 GLN  HA     61 GLN  HG2     3.20             (#peak  1612)
 &rst
  ixpk= 1612, nxpk= 0, iat= 954, 959, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  61 GLN  HA     62 ARG  HN      3.18             (#peak   766)
 &rst
  ixpk= 766, nxpk= 0, iat= 954, 969, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#  61 GLN  HG2    61 GLN  QE2     3.54             (#peak  1504)
 &rst
  ixpk= 1504, nxpk= 0, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr2= 964, 965,
 &end
#
#  61 GLN  QB     62 ARG  HN      4.24             (#peak   768)
 &rst
  ixpk= 768, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 956, 957,
 &end
#
#  61 GLN  QB     62 ARG  QD      5.50             (#peak 2736 )
 &rst
  ixpk= 2736, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 956, 957,
 igr2= 979, 980,
 &end
#
#  62 ARG  HN     62 ARG  HE      5.00             (#peak 764  )
 &rst
  ixpk= 764, nxpk= 0, iat= 969, 982, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  62 ARG  HN     62 ARG  QB      2.86             (#peak   770)
 &rst
  ixpk= 770, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
 igr2= 973, 974,
 &end
#
#  62 ARG  HN     62 ARG  QD      5.00             (#peak 764  )
 &rst
  ixpk= 764, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 979, 980,
 &end
#
#  62 ARG  HN     62 ARG  QG      3.59             (#peak  2227)
 &rst
  ixpk= 2227, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 976, 977,
 &end
#
#  62 ARG  HA     62 ARG  HD2     5.39             (#peak   683)
 &rst
  ixpk= 683, nxpk= 0, iat= 971, 979, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  62 ARG  HA     62 ARG  HD3     5.39             (#peak   683)
 &rst
  ixpk= 683, nxpk= 0, iat= 971, 980, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  62 ARG  HA     62 ARG  QD      4.57             (#peak   683)
 &rst
  ixpk= 683, nxpk= 0, iat= 971,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 979, 980,
 &end
#
#  62 ARG  QB     62 ARG  HE      4.47             (#peak  1705)
 &rst
  ixpk= 1705, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 973, 974,
 &end
#
#  64 CYS  HA     66 CYS  HN      5.00             (#peak   688)
 &rst
  ixpk= 688, nxpk= 0, iat=1009,1032, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  64 CYS  HB2    65 THR  HN      4.90             (#peak  1652)
 &rst
  ixpk= 1652, nxpk= 0, iat=1011,1018, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  64 CYS  HB3    65 THR  HN      4.90             (#peak  1653)
 &rst
  ixpk= 1653, nxpk= 0, iat=1012,1018, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  64 CYS  QB    127 LEU  QQD     4.80             (#peak  1851)
 &rst
  ixpk= 1851, nxpk= 0, iat=  -1,1993, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
 igr1=1011,1012,
 &end
#
#  64 CYS  QB     65 THR  HN      4.29             (#peak  1652)
 &rst
  ixpk= 1652, nxpk= 0, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1=1011,1012,
 &end
#
#  64 CYS  QB     86 LEU  HG      5.34             (#peak   961)
 &rst
  ixpk= 961, nxpk= 0, iat=  -1,1345, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1011,1012,
 &end
#
#  64 CYS  QB     86 LEU  QB      4.67             (#peak   701)
 &rst
  ixpk= 701, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1011,1012,
 igr2=1342,1343,
 &end
#
#  65 THR  HN     65 THR  QG2     3.85             (#peak   716)
 &rst
  ixpk= 716, nxpk= 0, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2=1024,1025,1026,
 &end
#
#  65 THR  HN     66 CYS  HN      4.00             (#peak  1480)
 &rst
  ixpk= 1480, nxpk= 0, iat=1018,1032, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  65 THR  HN     66 CYS  HA      5.50             (#peak  1538)
 &rst
  ixpk= 1538, nxpk= 0, iat=1018,1034, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  65 THR  HN     82 ILE  QG2     5.30             (#peak  1545)
 &rst
  ixpk= 1545, nxpk= 0, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr2=1288,1289,1290,
 &end
#
#  65 THR  HN     86 LEU  HG      5.00             (#peak 1546 )
 &rst
  ixpk= 1546, nxpk= 0, iat=1018,1345, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  65 THR  HA     65 THR  QG2     2.94             (#peak   719)
 &rst
  ixpk= 719, nxpk= 0, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1024,1025,1026,
 &end
#
#  65 THR  HA     67 ASP  HN      4.91             (#peak   703)
 &rst
  ixpk= 703, nxpk= 0, iat=1020,1043, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  65 THR  HA     82 ILE  QG2     3.60             (#peak   707)
 &rst
  ixpk= 707, nxpk= 0, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2=1288,1289,1290,
 &end
#
#  65 THR  HA     86 LEU  HG      4.83             (#peak   708)
 &rst
  ixpk= 708, nxpk= 0, iat=1020,1345, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  65 THR  HB     82 ILE  QG2     4.82             (#peak  2128)
 &rst
  ixpk= 2128, nxpk= 0, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2=1288,1289,1290,
 &end
#
#  65 THR  HB     86 LEU  HG      5.50             (#peak   963)
 &rst
  ixpk= 963, nxpk= 0, iat=1022,1345, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  65 THR  QG2    66 CYS  HN      4.38             (#peak  1487)
 &rst
  ixpk= 1487, nxpk= 0, iat=  -1,1032, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=1024,1025,1026,
 &end
#
#  65 THR  QG2    67 ASP  HN      4.04             (#peak   714)
 &rst
  ixpk= 714, nxpk= 0, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1=1024,1025,1026,
 &end
#
#  65 THR  QG2    79 ALA  HA      5.12             (#peak   855)
 &rst
  ixpk= 855, nxpk= 0, iat=  -1,1247, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1024,1025,1026,
 &end
#
#  65 THR  QG2    82 ILE  QD1     4.71             (#peak  2117)
 &rst
  ixpk= 2117, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=1024,1025,1026,
 igr2=1295,1296,1297,
 &end
#
#  65 THR  QG2    82 ILE  QG2     3.10             (#peak   723)
 &rst
  ixpk= 723, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=1024,1025,1026,
 igr2=1288,1289,1290,
 &end
#
#  65 THR  QG2    83 ALA  HN      3.95             (#peak   959)
 &rst
  ixpk= 959, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=1024,1025,1026,
 &end
#
#  65 THR  QG2    83 ALA  HA      3.71             (#peak   910)
 &rst
  ixpk= 910, nxpk= 0, iat=  -1,1303, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1=1024,1025,1026,
 &end
#
#  65 THR  QG2    83 ALA  QB      3.19             (#peak   919)
 &rst
  ixpk= 919, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1024,1025,1026,
 igr2=1305,1306,1307,
 &end
#
#  65 THR  QG2    86 LEU  HG      3.10             (#peak   969)
 &rst
  ixpk= 969, nxpk= 0, iat=  -1,1345, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1=1024,1025,1026,
 &end
#
#  66 CYS  HN     82 ILE  QG2     5.38             (#peak  1488)
 &rst
  ixpk= 1488, nxpk= 0, iat=1032,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1288,1289,1290,
 &end
#
#  66 CYS  HA     67 ASP  HN      3.38             (#peak  1129)
 &rst
  ixpk= 1129, nxpk= 0, iat=1034,1043, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#  66 CYS  HA     68 PHE  HN      3.95             (#peak   710)
 &rst
  ixpk= 710, nxpk= 0, iat=1034,1055, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  66 CYS  HA     68 PHE  HD      7.50             (#peak   711)
 &rst
  ixpk= 711, nxpk= 0, iat=1034,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2=1063,1071,
 &end
#
#  66 CYS  HA     69 LEU  HN      5.03             (#peak   962)
 &rst
  ixpk= 962, nxpk= 0, iat=1034,1075, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#  66 CYS  QB     69 LEU  QD1     5.00             (#peak 2924 )
 &rst
  ixpk= 2924, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1036,1037,
 igr2=1084,1085,1086,
 &end
#
#  67 ASP  HN     67 ASP  QB      3.69             (#peak  1131)
 &rst
  ixpk= 1131, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2=1047,1048,
 &end
#
#  67 ASP  HN     68 PHE  HN      3.27             (#peak  1126)
 &rst
  ixpk= 1126, nxpk= 0, iat=1043,1055, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#  67 ASP  HN     68 PHE  HD      6.30             (#peak  1127)
 &rst
  ixpk= 1127, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr2=1063,1071,
 &end
#
#  67 ASP  HN     69 LEU  HN      4.85             (#peak  1125)
 &rst
  ixpk= 1125, nxpk= 0, iat=1043,1075, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  67 ASP  HA     69 LEU  HN      4.58             (#peak   964)
 &rst
  ixpk= 964, nxpk= 0, iat=1045,1075, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  67 ASP  HA     70 HIS  HN      4.82             (#peak  1151)
 &rst
  ixpk= 1151, nxpk= 0, iat=1045,1094, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  67 ASP  HB2    68 PHE  HN      5.36             (#peak  1371)
 &rst
  ixpk= 1371, nxpk= 0, iat=1047,1055, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  67 ASP  HB3    68 PHE  HN      5.36             (#peak  1371)
 &rst
  ixpk= 1371, nxpk= 0, iat=1048,1055, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  68 PHE  HN     68 PHE  HB2     3.96             (#peak  1368)
 &rst
  ixpk= 1368, nxpk= 0, iat=1055,1059, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  68 PHE  HN     68 PHE  HB3     3.96             (#peak  1369)
 &rst
  ixpk= 1369, nxpk= 0, iat=1055,1060, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  68 PHE  HN     68 PHE  QB      3.36             (#peak  1369)
 &rst
  ixpk= 1369, nxpk= 0, iat=1055,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1059,1060,
 &end
#
#  68 PHE  HN     68 PHE  HD      5.33             (#peak  1365)
 &rst
  ixpk= 1365, nxpk= 0, iat=1055,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1063,1071,
 &end
#
#  68 PHE  HN     69 LEU  HN      3.55             (#peak   968)
 &rst
  ixpk= 968, nxpk= 0, iat=1055,1075, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  68 PHE  HA     68 PHE  HD      6.01             (#peak   725)
 &rst
  ixpk= 725, nxpk= 0, iat=1057,  -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
 igr2=1063,1071,
 &end
#
#  68 PHE  HA     70 HIS  HN      4.36             (#peak  1148)
 &rst
  ixpk= 1148, nxpk= 0, iat=1057,1094, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  68 PHE  QB     69 LEU  QQD     5.28             (#peak  2925)
 &rst
  ixpk= 2925, nxpk= 0, iat=  -1,1081, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
 igr1=1059,1060,
 &end
#
#  68 PHE  HD     69 LEU  HN      6.87             (#peak   967)
 &rst
  ixpk= 967, nxpk= 0, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 7.71, r4= 8.21,
 igr1=1063,1071,
 &end
#
#  69 LEU  HN     69 LEU  QQD     3.68             (#peak   956)
 &rst
  ixpk= 956, nxpk= 0, iat=1075,1081, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,  &end
#
#  69 LEU  HN     70 HIS  HN      3.14             (#peak  1141)
 &rst
  ixpk= 1141, nxpk= 0, iat=1075,1094, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  69 LEU  HA     69 LEU  QQD     4.15             (#peak  2923)
 &rst
  ixpk= 2923, nxpk= 0, iat=1077,1081, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
#  69 LEU  HB2    70 HIS  HA      6.00             (#peak 1567 )
 &rst
  ixpk= 1567, nxpk= 0, iat=1079,1096, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  69 LEU  QD1    74 THR  QG2     6.00             (#peak 2929 )
 &rst
  ixpk= 2929, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=1084,1085,1086,
 igr2=1162,1163,1164,
 &end
#
#  69 LEU  QD1    98 PHE  HB2     5.50             (#peak 2926 )
 &rst
  ixpk= 2926, nxpk= 0, iat=  -1,1533, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1084,1085,1086,
 &end
#
#  69 LEU  QD1    99 TYR  HN      6.00             (#peak 1163 )
 &rst
  ixpk= 1163, nxpk= 0, iat=  -1,1549, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1084,1085,1086,
 &end
#
#  69 LEU  QQD    98 PHE  HB3     5.28             (#peak  1310)
 &rst
  ixpk= 1310, nxpk= 0, iat=1081,1534, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,  &end
#
#  69 LEU  QQD    98 PHE  HD      5.91             (#peak  2921)
 &rst
  ixpk= 2921, nxpk= 0, iat=1081,  -1, r1= 1.30, r2= 1.80, r3= 8.83, r4= 9.33,
 igr2=1537,1545,
 &end
#
#  70 HIS  HN     70 HIS  HB2     3.60             (#peak  1149)
 &rst
  ixpk= 1149, nxpk= 0, iat=1094,1098, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  70 HIS  HN     70 HIS  HB3     3.60             (#peak  1150)
 &rst
  ixpk= 1150, nxpk= 0, iat=1094,1099, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  70 HIS  HN     70 HIS  QB      3.11             (#peak  1149)
 &rst
  ixpk= 1149, nxpk= 0, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2=1098,1099,
 &end
#
#  70 HIS  HN     71 GLY  HN      4.89             (#peak  1520)
 &rst
  ixpk= 1520, nxpk= 0, iat=1094,1111, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  70 HIS  HN     74 THR  QG2     5.03             (#peak  1153)
 &rst
  ixpk= 1153, nxpk= 0, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr2=1162,1163,1164,
 &end
#
#  70 HIS  HN     98 PHE  HD      7.50             (#peak  1143)
 &rst
  ixpk= 1143, nxpk= 0, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2=1537,1545,
 &end
#
#  70 HIS  HN     99 TYR  HD      6.72             (#peak  1142)
 &rst
  ixpk= 1142, nxpk= 0, iat=1094,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr2=1557,1566,
 &end
#
#  70 HIS  HA     71 GLY  HN      3.32             (#peak  1515)
 &rst
  ixpk= 1515, nxpk= 0, iat=1096,1111, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#  70 HIS  HA     74 THR  HB      5.29             (#peak   740)
 &rst
  ixpk= 740, nxpk= 0, iat=1096,1160, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  70 HIS  HA     74 THR  QG2     4.12             (#peak  2574)
 &rst
  ixpk= 2574, nxpk= 0, iat=1096,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2=1162,1163,1164,
 &end
#
#  70 HIS  HA     99 TYR  HD      6.48             (#peak   737)
 &rst
  ixpk= 737, nxpk= 0, iat=1096,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2=1557,1566,
 &end
#
#  70 HIS  HB2    71 GLY  HN      4.21             (#peak  1512)
 &rst
  ixpk= 1512, nxpk= 0, iat=1098,1111, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  70 HIS  HB3    71 GLY  HN      4.21             (#peak  1511)
 &rst
  ixpk= 1511, nxpk= 0, iat=1099,1111, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  70 HIS  QB     71 GLY  HN      3.65             (#peak  1511)
 &rst
  ixpk= 1511, nxpk= 0, iat=  -1,1111, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr1=1098,1099,
 &end
#
#  70 HIS  QB     74 THR  QG2     4.22             (#peak  2579)
 &rst
  ixpk= 2579, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1=1098,1099,
 igr2=1162,1163,1164,
 &end
#
#  71 GLY  HN     74 THR  HN      3.78             (#peak   897)
 &rst
  ixpk= 897, nxpk= 0, iat=1111,1156, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  71 GLY  HN     74 THR  HB      3.67             (#peak  1514)
 &rst
  ixpk= 1514, nxpk= 0, iat=1111,1160, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  71 GLY  HN     74 THR  QG2     4.03             (#peak  2568)
 &rst
  ixpk= 2568, nxpk= 0, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2=1162,1163,1164,
 &end
#
#  71 GLY  HN     99 TYR  HB3     4.78             (#peak  1510)
 &rst
  ixpk= 1510, nxpk= 0, iat=1111,1554, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  71 GLY  HN     99 TYR  HD      6.10             (#peak  1519)
 &rst
  ixpk= 1519, nxpk= 0, iat=1111,  -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr2=1557,1566,
 &end
#
#  71 GLY  QA     72 PRO  HA      4.16             (#peak   762)
 &rst
  ixpk= 762, nxpk= 0, iat=  -1,1128, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=1113,1114,
 &end
#
#  72 PRO  QD     73 ARG  HN      4.56             (#peak  1434)
 &rst
  ixpk= 1434, nxpk= 0, iat=  -1,1132, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=1119,1120,
 &end
#
#  72 PRO  QD     99 TYR  HB3     4.91             (#peak  2714)
 &rst
  ixpk= 2714, nxpk= 0, iat=  -1,1554, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=1119,1120,
 &end
#
#  73 ARG  HN     74 THR  HN      3.56             (#peak   895)
 &rst
  ixpk= 895, nxpk= 0, iat=1132,1156, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  73 ARG  HN     99 TYR  HD      7.37             (#peak  1430)
 &rst
  ixpk= 1430, nxpk= 0, iat=1132,  -1, r1= 1.30, r2= 1.80, r3= 8.27, r4= 8.77,
 igr2=1557,1566,
 &end
#
#  74 THR  HN     74 THR  HB      2.93             (#peak  1722)
 &rst
  ixpk= 1722, nxpk= 0, iat=1156,1160, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,  &end
#
#  74 THR  HN     74 THR  QG2     3.91             (#peak  2569)
 &rst
  ixpk= 2569, nxpk= 0, iat=1156,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2=1162,1163,1164,
 &end
#
#  74 THR  HN     75 GLN  HN      4.69             (#peak   896)
 &rst
  ixpk= 896, nxpk= 0, iat=1156,1170, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  74 THR  HN     99 TYR  HD      7.50             (#peak   901)
 &rst
  ixpk= 901, nxpk= 0, iat=1156,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2=1557,1566,
 &end
#
#  74 THR  HA     74 THR  QG2     3.23             (#peak  2576)
 &rst
  ixpk= 2576, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2=1162,1163,1164,
 &end
#
#  74 THR  HA     75 GLN  HN      3.33             (#peak    18)
 &rst
  ixpk= 18, nxpk= 0, iat=1158,1170, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  74 THR  HA     75 GLN  QG      4.23             (#peak  2808)
 &rst
  ixpk= 2808, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2=1177,1178,
 &end
#
#  74 THR  HA     96 ILE  QG2     5.50             (#peak  2846)
 &rst
  ixpk= 2846, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1506,1507,1508,
 &end
#
#  74 THR  HA     97 ALA  HN      4.40             (#peak    74)
 &rst
  ixpk= 74, nxpk= 0, iat=1158,1519, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  74 THR  HA     97 ALA  QB      3.70             (#peak  1290)
 &rst
  ixpk= 1290, nxpk= 0, iat=1158,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2=1523,1524,1525,
 &end
#
#  74 THR  HB     75 GLN  HN      3.83             (#peak    17)
 &rst
  ixpk= 17, nxpk= 0, iat=1160,1170, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  74 THR  HB     97 ALA  QB      4.68             (#peak  1289)
 &rst
  ixpk= 1289, nxpk= 0, iat=1160,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2=1523,1524,1525,
 &end
#
#  74 THR  QG2   107 LEU  HG      6.00             (#peak 1422 )
 &rst
  ixpk= 1422, nxpk= 0, iat=  -1,1684, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1162,1163,1164,
 &end
#
#  74 THR  QG2    75 GLN  HN      3.47             (#peak    26)
 &rst
  ixpk= 26, nxpk= 0, iat=  -1,1170, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1=1162,1163,1164,
 &end
#
#  74 THR  QG2    76 ARG  HN      5.37             (#peak   177)
 &rst
  ixpk= 177, nxpk= 0, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr1=1162,1163,1164,
 &end
#
#  74 THR  QG2    79 ALA  QB      3.44             (#peak   866)
 &rst
  ixpk= 866, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1=1162,1163,1164,
 igr2=1249,1250,1251,
 &end
#
#  74 THR  QG2    96 ILE  HB      3.89             (#peak  1247)
 &rst
  ixpk= 1247, nxpk= 0, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=1162,1163,1164,
 &end
#
#  74 THR  QG2    96 ILE  QG2     3.02             (#peak  2580)
 &rst
  ixpk= 2580, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1=1162,1163,1164,
 igr2=1506,1507,1508,
 &end
#
#  74 THR  QG2    98 PHE  HD      6.52             (#peak  2572)
 &rst
  ixpk= 2572, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.79, r4= 9.29,
 igr1=1162,1163,1164,
 igr2=1537,1545,
 &end
#
#  74 THR  QG2    99 TYR  HD      7.50             (#peak 2571 )
 &rst
  ixpk= 2571, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1=1162,1163,1164,
 igr2=1557,1566,
 &end
#
#  75 GLN  HN     75 GLN  HB2     3.73             (#peak    23)
 &rst
  ixpk= 23, nxpk= 0, iat=1170,1174, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  75 GLN  HN     75 GLN  HB3     3.73             (#peak  1723)
 &rst
  ixpk= 1723, nxpk= 0, iat=1170,1175, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  75 GLN  HN     75 GLN  QB      3.25             (#peak  1723)
 &rst
  ixpk= 1723, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2=1174,1175,
 &end
#
#  75 GLN  HN     75 GLN  QG      3.21             (#peak    22)
 &rst
  ixpk= 22, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1177,1178,
 &end
#
#  75 GLN  HN     76 ARG  HN      4.71             (#peak   164)
 &rst
  ixpk= 164, nxpk= 0, iat=1170,1187, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  75 GLN  HN     78 ALA  HN      4.82             (#peak    19)
 &rst
  ixpk= 19, nxpk= 0, iat=1170,1235, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  75 GLN  HN     78 ALA  QB      3.95             (#peak    24)
 &rst
  ixpk= 24, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  HN     96 ILE  QG2     4.66             (#peak  2854)
 &rst
  ixpk= 2854, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=1506,1507,1508,
 &end
#
#  75 GLN  HN     97 ALA  HN      4.60             (#peak    79)
 &rst
  ixpk= 79, nxpk= 0, iat=1170,1519, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  75 GLN  HN     97 ALA  QB      4.19             (#peak  1278)
 &rst
  ixpk= 1278, nxpk= 0, iat=1170,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2=1523,1524,1525,
 &end
#
#  75 GLN  HA     75 GLN  QG      3.23             (#peak  2807)
 &rst
  ixpk= 2807, nxpk= 0, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr2=1177,1178,
 &end
#
#  75 GLN  HA     76 ARG  HN      2.87             (#peak   166)
 &rst
  ixpk= 166, nxpk= 0, iat=1172,1187, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
#  75 GLN  HA     76 ARG  HA      4.53             (#peak   794)
 &rst
  ixpk= 794, nxpk= 0, iat=1172,1189, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  75 GLN  HA     76 ARG  QD      4.19             (#peak   777)
 &rst
  ixpk= 777, nxpk= 0, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2=1197,1198,
 &end
#
#  75 GLN  HA     76 ARG  QG      3.74             (#peak   776)
 &rst
  ixpk= 776, nxpk= 0, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1194,1195,
 &end
#
#  75 GLN  HA     77 ARG  HN      4.45             (#peak  1049)
 &rst
  ixpk= 1049, nxpk= 0, iat=1172,1211, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  75 GLN  HA     78 ALA  HN      4.95             (#peak   774)
 &rst
  ixpk= 774, nxpk= 0, iat=1172,1235, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  75 GLN  HB2    76 ARG  HN      4.02             (#peak   171)
 &rst
  ixpk= 171, nxpk= 0, iat=1174,1187, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  75 GLN  HB2    78 ALA  HN      3.52             (#peak   591)
 &rst
  ixpk= 591, nxpk= 0, iat=1174,1235, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  75 GLN  HB2    78 ALA  QB      4.02             (#peak   839)
 &rst
  ixpk= 839, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  HB3    76 ARG  HN      4.02             (#peak   172)
 &rst
  ixpk= 172, nxpk= 0, iat=1175,1187, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  75 GLN  HB3    78 ALA  HN      3.52             (#peak   592)
 &rst
  ixpk= 592, nxpk= 0, iat=1175,1235, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  75 GLN  HB3    78 ALA  QB      4.02             (#peak   840)
 &rst
  ixpk= 840, nxpk= 0, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  HG2    78 ALA  HN      5.50             (#peak   590)
 &rst
  ixpk= 590, nxpk= 0, iat=1177,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  75 GLN  HG2    78 ALA  QB      5.31             (#peak  2809)
 &rst
  ixpk= 2809, nxpk= 0, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  HG3    78 ALA  HN      5.50             (#peak   590)
 &rst
  ixpk= 590, nxpk= 0, iat=1178,1235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  75 GLN  HG3    78 ALA  QB      5.31             (#peak  2809)
 &rst
  ixpk= 2809, nxpk= 0, iat=1178,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  QB     76 ARG  HN      3.46             (#peak   171)
 &rst
  ixpk= 171, nxpk= 0, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1=1174,1175,
 &end
#
#  75 GLN  QB     77 ARG  HN      3.98             (#peak  1055)
 &rst
  ixpk= 1055, nxpk= 0, iat=  -1,1211, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=1174,1175,
 &end
#
#  75 GLN  QB     78 ALA  QB      3.46             (#peak   840)
 &rst
  ixpk= 840, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1=1174,1175,
 igr2=1239,1240,1241,
 &end
#
#  75 GLN  QG     76 ARG  HN      5.50             (#peak 170  )
 &rst
  ixpk= 170, nxpk= 0, iat=  -1,1187, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1177,1178,
 &end
#
#  75 GLN  QG     77 ARG  HN      5.07             (#peak  1054)
 &rst
  ixpk= 1054, nxpk= 0, iat=  -1,1211, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1=1177,1178,
 &end
#
#  75 GLN  QG     77 ARG  QD      4.49             (#peak  2614)
 &rst
  ixpk= 2614, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1177,1178,
 igr2=1221,1222,
 &end
#
#  75 GLN  QG     78 ALA  QB      4.55             (#peak  2809)
 &rst
  ixpk= 2809, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
 igr1=1177,1178,
 igr2=1239,1240,1241,
 &end
#
#  76 ARG  HN     76 ARG  HB2     2.99             (#peak   173)
 &rst
  ixpk= 173, nxpk= 0, iat=1187,1191, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  76 ARG  HN     76 ARG  HG2     4.21             (#peak   174)
 &rst
  ixpk= 174, nxpk= 0, iat=1187,1194, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  76 ARG  HN     76 ARG  HG3     4.21             (#peak  2586)
 &rst
  ixpk= 2586, nxpk= 0, iat=1187,1195, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  76 ARG  HN     76 ARG  QD      4.29             (#peak  2598)
 &rst
  ixpk= 2598, nxpk= 0, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2=1197,1198,
 &end
#
#  76 ARG  HN     76 ARG  QG      3.51             (#peak   174)
 &rst
  ixpk= 174, nxpk= 0, iat=1187,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=1194,1195,
 &end
#
#  76 ARG  HN     77 ARG  HA      5.31             (#peak   168)
 &rst
  ixpk= 168, nxpk= 0, iat=1187,1213, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  76 ARG  HN     77 ARG  HB3     5.00             (#peak 175  )
 &rst
  ixpk= 175, nxpk= 0, iat=1187,1216, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  76 ARG  HN     78 ALA  HN      4.45             (#peak   163)
 &rst
  ixpk= 163, nxpk= 0, iat=1187,1235, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  76 ARG  HN     79 ALA  HN      5.50             (#peak   165)
 &rst
  ixpk= 165, nxpk= 0, iat=1187,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  76 ARG  HA     76 ARG  HD2     4.96             (#peak   795)
 &rst
  ixpk= 795, nxpk= 0, iat=1189,1197, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#  76 ARG  HA     76 ARG  HD3     4.96             (#peak   795)
 &rst
  ixpk= 795, nxpk= 0, iat=1189,1198, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#  76 ARG  HA     76 ARG  HG2     3.90             (#peak  2590)
 &rst
  ixpk= 2590, nxpk= 0, iat=1189,1194, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  76 ARG  HA     76 ARG  HG3     3.90             (#peak   799)
 &rst
  ixpk= 799, nxpk= 0, iat=1189,1195, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  76 ARG  HA     76 ARG  QD      4.34             (#peak   795)
 &rst
  ixpk= 795, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr2=1197,1198,
 &end
#
#  76 ARG  HA     76 ARG  QG      3.26             (#peak   799)
 &rst
  ixpk= 799, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr2=1194,1195,
 &end
#
#  76 ARG  HA     78 ALA  HN      4.66             (#peak   793)
 &rst
  ixpk= 793, nxpk= 0, iat=1189,1235, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  76 ARG  HA     78 ALA  QB      5.26             (#peak   798)
 &rst
  ixpk= 798, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr2=1239,1240,1241,
 &end
#
#  76 ARG  HA     79 ALA  HN      4.04             (#peak   742)
 &rst
  ixpk= 742, nxpk= 0, iat=1189,1245, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  76 ARG  HA     79 ALA  QB      3.45             (#peak   864)
 &rst
  ixpk= 864, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2=1249,1250,1251,
 &end
#
#  76 ARG  HA     80 ALA  HN      4.78             (#peak   640)
 &rst
  ixpk= 640, nxpk= 0, iat=1189,1255, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  76 ARG  HA     80 ALA  QB      5.50             (#peak   798)
 &rst
  ixpk= 798, nxpk= 0, iat=1189,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1259,1260,1261,
 &end
#
#  76 ARG  HB2    77 ARG  HN      2.96             (#peak  1058)
 &rst
  ixpk= 1058, nxpk= 0, iat=1191,1211, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#  76 ARG  HB2    79 ALA  HN      5.50             (#peak   745)
 &rst
  ixpk= 745, nxpk= 0, iat=1191,1245, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  76 ARG  HB2    80 ALA  HN      5.50             (#peak   641)
 &rst
  ixpk= 641, nxpk= 0, iat=1191,1255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  76 ARG  HB2    80 ALA  QB      4.84             (#peak   882)
 &rst
  ixpk= 882, nxpk= 0, iat=1191,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2=1259,1260,1261,
 &end
#
#  76 ARG  QD     78 ALA  HN      5.50             (#peak 2596 )
 &rst
  ixpk= 2596, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1197,1198,
 &end
#
#  76 ARG  QD     79 ALA  QB      5.50             (#peak 2602 )
 &rst
  ixpk= 2602, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1197,1198,
 igr2=1249,1250,1251,
 &end
#
#  76 ARG  QG     77 ARG  HN      4.29             (#peak  1063)
 &rst
  ixpk= 1063, nxpk= 0, iat=  -1,1211, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1=1194,1195,
 &end
#
#  77 ARG  HN     77 ARG  HD2     5.11             (#peak  1053)
 &rst
  ixpk= 1053, nxpk= 0, iat=1211,1221, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#  77 ARG  HN     77 ARG  HD3     5.11             (#peak  1053)
 &rst
  ixpk= 1053, nxpk= 0, iat=1211,1222, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#  77 ARG  HN     77 ARG  HG2     4.25             (#peak  1745)
 &rst
  ixpk= 1745, nxpk= 0, iat=1211,1218, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  77 ARG  HN     77 ARG  HG3     4.25             (#peak  1060)
 &rst
  ixpk= 1060, nxpk= 0, iat=1211,1219, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  77 ARG  HN     77 ARG  QB      3.15             (#peak  1059)
 &rst
  ixpk= 1059, nxpk= 0, iat=1211,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=1215,1216,
 &end
#
#  77 ARG  HN     77 ARG  QG      3.50             (#peak  1745)
 &rst
  ixpk= 1745, nxpk= 0, iat=1211,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1218,1219,
 &end
#
#  77 ARG  HN     78 ALA  HN      3.56             (#peak  1048)
 &rst
  ixpk= 1048, nxpk= 0, iat=1211,1235, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  77 ARG  HN     78 ALA  QB      4.58             (#peak   834)
 &rst
  ixpk= 834, nxpk= 0, iat=1211,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1239,1240,1241,
 &end
#
#  77 ARG  HN     79 ALA  HN      4.59             (#peak  1047)
 &rst
  ixpk= 1047, nxpk= 0, iat=1211,1245, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  77 ARG  HN     79 ALA  QB      5.50             (#peak  1062)
 &rst
  ixpk= 1062, nxpk= 0, iat=1211,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1249,1250,1251,
 &end
#
#  77 ARG  HN     80 ALA  QB      5.26             (#peak  1061)
 &rst
  ixpk= 1061, nxpk= 0, iat=1211,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr2=1259,1260,1261,
 &end
#
#  77 ARG  HA     77 ARG  HD2     5.44             (#peak   806)
 &rst
  ixpk= 806, nxpk= 0, iat=1213,1221, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  77 ARG  HA     77 ARG  HD3     5.44             (#peak  2767)
 &rst
  ixpk= 2767, nxpk= 0, iat=1213,1222, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
#  77 ARG  HA     77 ARG  HG2     3.99             (#peak   811)
 &rst
  ixpk= 811, nxpk= 0, iat=1213,1218, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  77 ARG  HA     77 ARG  HG3     3.99             (#peak  2603)
 &rst
  ixpk= 2603, nxpk= 0, iat=1213,1219, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  77 ARG  HA     77 ARG  QD      4.66             (#peak  2767)
 &rst
  ixpk= 2767, nxpk= 0, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
 igr2=1221,1222,
 &end
#
#  77 ARG  HA     77 ARG  QG      3.43             (#peak   811)
 &rst
  ixpk= 811, nxpk= 0, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2=1218,1219,
 &end
#
#  77 ARG  HA     78 ALA  QB      5.14             (#peak   837)
 &rst
  ixpk= 837, nxpk= 0, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1239,1240,1241,
 &end
#
#  77 ARG  HA     80 ALA  HN      3.66             (#peak   638)
 &rst
  ixpk= 638, nxpk= 0, iat=1213,1255, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  77 ARG  HA     80 ALA  QB      2.96             (#peak   880)
 &rst
  ixpk= 880, nxpk= 0, iat=1213,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2=1259,1260,1261,
 &end
#
#  77 ARG  HA     81 GLN  HN      4.62             (#peak   805)
 &rst
  ixpk= 805, nxpk= 0, iat=1213,1265, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  77 ARG  HB2    78 ALA  HN      4.01             (#peak   593)
 &rst
  ixpk= 593, nxpk= 0, iat=1215,1235, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  77 ARG  HB2    80 ALA  HN      5.50             (#peak   641)
 &rst
  ixpk= 641, nxpk= 0, iat=1215,1255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  77 ARG  HB3    78 ALA  HN      4.01             (#peak   594)
 &rst
  ixpk= 594, nxpk= 0, iat=1216,1235, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  77 ARG  HB3    80 ALA  HN      6.00             (#peak   642)
 &rst
  ixpk= 642, nxpk= 0, iat=1216,1255, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  77 ARG  HG2    78 ALA  HN      5.24             (#peak  2592)
 &rst
  ixpk= 2592, nxpk= 0, iat=1218,1235, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  77 ARG  HG3    78 ALA  HN      5.24             (#peak  2604)
 &rst
  ixpk= 2604, nxpk= 0, iat=1219,1235, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  77 ARG  QB     77 ARG  QD      3.27             (#peak   817)
 &rst
  ixpk= 817, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1=1215,1216,
 igr2=1221,1222,
 &end
#
#  77 ARG  QB     78 ALA  HN      3.46             (#peak   593)
 &rst
  ixpk= 593, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr1=1215,1216,
 &end
#
#  77 ARG  QB     78 ALA  HA      4.50             (#peak  2584)
 &rst
  ixpk= 2584, nxpk= 0, iat=  -1,1237, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1215,1216,
 &end
#
#  77 ARG  QB     79 ALA  HN      5.34             (#peak   745)
 &rst
  ixpk= 745, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1215,1216,
 &end
#
#  77 ARG  QB     80 ALA  QB      5.01             (#peak   882)
 &rst
  ixpk= 882, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
 igr1=1215,1216,
 igr2=1259,1260,1261,
 &end
#
#  77 ARG  QB     81 GLN  HN      5.00             (#peak  2582)
 &rst
  ixpk= 2582, nxpk= 0, iat=  -1,1265, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1215,1216,
 &end
#
#  77 ARG  QD     78 ALA  HN      4.53             (#peak  2773)
 &rst
  ixpk= 2773, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1221,1222,
 &end
#
#  77 ARG  QG     78 ALA  HN      4.40             (#peak  2604)
 &rst
  ixpk= 2604, nxpk= 0, iat=  -1,1235, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1218,1219,
 &end
#
#  78 ALA  HN     78 ALA  QB      2.72             (#peak   595)
 &rst
  ixpk= 595, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
 igr2=1239,1240,1241,
 &end
#
#  78 ALA  HN     79 ALA  HN      2.94             (#peak   584)
 &rst
  ixpk= 584, nxpk= 0, iat=1235,1245, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
#  78 ALA  HN     79 ALA  QB      4.67             (#peak    77)
 &rst
  ixpk= 77, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1249,1250,1251,
 &end
#
#  78 ALA  HN     79 ALA  QB      5.50             (#peak 596  )
 &rst
  ixpk= 596, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1249,1250,1251,
 &end
#
#  78 ALA  HN     80 ALA  HN      4.03             (#peak   636)
 &rst
  ixpk= 636, nxpk= 0, iat=1235,1255, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  78 ALA  HN     96 ILE  QG2     4.78             (#peak   598)
 &rst
  ixpk= 598, nxpk= 0, iat=1235,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=1506,1507,1508,
 &end
#
#  78 ALA  HA     79 ALA  HA      5.13             (#peak   869)
 &rst
  ixpk= 869, nxpk= 0, iat=1237,1247, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#  78 ALA  HA     81 GLN  QB      3.86             (#peak   828)
 &rst
  ixpk= 828, nxpk= 0, iat=1237,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr2=1269,1270,
 &end
#
#  78 ALA  HA     82 ILE  HN      5.12             (#peak   823)
 &rst
  ixpk= 823, nxpk= 0, iat=1237,1282, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  78 ALA  HA     82 ILE  QD1     5.09             (#peak  2111)
 &rst
  ixpk= 2111, nxpk= 0, iat=1237,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2=1295,1296,1297,
 &end
#
#  78 ALA  HA     94 VAL  QQG     3.63             (#peak  1180)
 &rst
  ixpk= 1180, nxpk= 0, iat=1237,1472, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,  &end
#
#  78 ALA  HA     95 GLU  HG3     5.00             (#peak 827  )
 &rst
  ixpk= 827, nxpk= 0, iat=1237,1493, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  78 ALA  QB    107 LEU  QD1     5.28             (#peak   845)
 &rst
  ixpk= 845, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
 igr1=1239,1240,1241,
 igr2=1686,1687,1688,
 &end
#
#  78 ALA  QB    107 LEU  QD2     5.28             (#peak   845)
 &rst
  ixpk= 845, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
 igr1=1239,1240,1241,
 igr2=1690,1691,1692,
 &end
#
#  78 ALA  QB    107 LEU  QQD     4.58             (#peak   845)
 &rst
  ixpk= 845, nxpk= 0, iat=  -1,1683, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     79 ALA  HN      2.94             (#peak   749)
 &rst
  ixpk= 749, nxpk= 0, iat=  -1,1245, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     79 ALA  HA      4.03             (#peak   838)
 &rst
  ixpk= 838, nxpk= 0, iat=  -1,1247, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     80 ALA  HN      4.62             (#peak   833)
 &rst
  ixpk= 833, nxpk= 0, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     82 ILE  QD1     4.14             (#peak  2114)
 &rst
  ixpk= 2114, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1=1239,1240,1241,
 igr2=1295,1296,1297,
 &end
#
#  78 ALA  QB     94 VAL  QQG     4.47             (#peak   843)
 &rst
  ixpk= 843, nxpk= 0, iat=  -1,1472, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     95 GLU  HN      4.86             (#peak   833)
 &rst
  ixpk= 833, nxpk= 0, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     96 ILE  HA      3.29             (#peak   836)
 &rst
  ixpk= 836, nxpk= 0, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     96 ILE  HB      4.10             (#peak  1249)
 &rst
  ixpk= 1249, nxpk= 0, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1=1239,1240,1241,
 &end
#
#  78 ALA  QB     96 ILE  QD1     4.71             (#peak  1267)
 &rst
  ixpk= 1267, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=1239,1240,1241,
 igr2=1513,1514,1515,
 &end
#
#  78 ALA  QB     96 ILE  QG2     3.17             (#peak  2856)
 &rst
  ixpk= 2856, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1=1239,1240,1241,
 igr2=1506,1507,1508,
 &end
#
#  78 ALA  QB     97 ALA  HN      3.85             (#peak    73)
 &rst
  ixpk= 73, nxpk= 0, iat=  -1,1519, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=1239,1240,1241,
 &end
#
#  79 ALA  HN     79 ALA  QB      2.69             (#peak   750)
 &rst
  ixpk= 750, nxpk= 0, iat=1245,  -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
 igr2=1249,1250,1251,
 &end
#
#  79 ALA  HN     80 ALA  HN      3.09             (#peak   632)
 &rst
  ixpk= 632, nxpk= 0, iat=1245,1255, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#  79 ALA  HN     80 ALA  QB      4.34             (#peak   876)
 &rst
  ixpk= 876, nxpk= 0, iat=1245,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2=1259,1260,1261,
 &end
#
#  79 ALA  HN     82 ILE  HN      5.25             (#peak  1674)
 &rst
  ixpk= 1674, nxpk= 0, iat=1245,1282, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  79 ALA  HN     82 ILE  HB      5.50             (#peak   745)
 &rst
  ixpk= 745, nxpk= 0, iat=1245,1286, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  79 ALA  HN     96 ILE  QG2     3.87             (#peak   759)
 &rst
  ixpk= 759, nxpk= 0, iat=1245,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1506,1507,1508,
 &end
#
#  79 ALA  HA     80 ALA  HA      5.50             (#peak   869)
 &rst
  ixpk= 869, nxpk= 0, iat=1247,1257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  79 ALA  HA     82 ILE  HN      4.12             (#peak   694)
 &rst
  ixpk= 694, nxpk= 0, iat=1247,1282, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  79 ALA  HA     82 ILE  HA      5.50             (#peak   852)
 &rst
  ixpk= 852, nxpk= 0, iat=1247,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  79 ALA  HA     82 ILE  HB      3.92             (#peak   853)
 &rst
  ixpk= 853, nxpk= 0, iat=1247,1286, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#  79 ALA  HA     82 ILE  QD1     3.72             (#peak   856)
 &rst
  ixpk= 856, nxpk= 0, iat=1247,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2=1295,1296,1297,
 &end
#
#  79 ALA  HA     82 ILE  QG2     3.97             (#peak   859)
 &rst
  ixpk= 859, nxpk= 0, iat=1247,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1288,1289,1290,
 &end
#
#  79 ALA  HA     83 ALA  HN      4.35             (#peak   850)
 &rst
  ixpk= 850, nxpk= 0, iat=1247,1301, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  79 ALA  HA     96 ILE  QG2     3.45             (#peak  2844)
 &rst
  ixpk= 2844, nxpk= 0, iat=1247,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2=1506,1507,1508,
 &end
#
#  79 ALA  QB     80 ALA  HN      3.14             (#peak   644)
 &rst
  ixpk= 644, nxpk= 0, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1249,1250,1251,
 &end
#
#  79 ALA  QB     80 ALA  HA      3.97             (#peak   871)
 &rst
  ixpk= 871, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=1249,1250,1251,
 &end
#
#  79 ALA  QB     81 GLN  HN      4.95             (#peak  1077)
 &rst
  ixpk= 1077, nxpk= 0, iat=  -1,1265, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1249,1250,1251,
 &end
#
#  79 ALA  QB     82 ILE  HB      4.21             (#peak   865)
 &rst
  ixpk= 865, nxpk= 0, iat=  -1,1286, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1=1249,1250,1251,
 &end
#
#  79 ALA  QB     82 ILE  QD1     4.35             (#peak  2116)
 &rst
  ixpk= 2116, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=1249,1250,1251,
 igr2=1295,1296,1297,
 &end
#
#  79 ALA  QB     96 ILE  QG2     3.34             (#peak   867)
 &rst
  ixpk= 867, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1=1249,1250,1251,
 igr2=1506,1507,1508,
 &end
#
#  80 ALA  HN     80 ALA  HA      2.89             (#peak   637)
 &rst
  ixpk= 637, nxpk= 0, iat=1255,1257, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39,  &end
#
#  80 ALA  HN     80 ALA  QB      2.51             (#peak   643)
 &rst
  ixpk= 643, nxpk= 0, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2=1259,1260,1261,
 &end
#
#  80 ALA  HN     81 GLN  HN      3.08             (#peak  1064)
 &rst
  ixpk= 1064, nxpk= 0, iat=1255,1265, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,  &end
#
#  80 ALA  HN     82 ILE  HN      4.24             (#peak   634)
 &rst
  ixpk= 634, nxpk= 0, iat=1255,1282, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  80 ALA  HN     82 ILE  HB      5.50             (#peak   641)
 &rst
  ixpk= 641, nxpk= 0, iat=1255,1286, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  80 ALA  HN     83 ALA  HN      5.14             (#peak   635)
 &rst
  ixpk= 635, nxpk= 0, iat=1255,1301, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  80 ALA  HN     96 ILE  QG2     5.48             (#peak   645)
 &rst
  ixpk= 645, nxpk= 0, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr2=1506,1507,1508,
 &end
#
#  80 ALA  HA     82 ILE  HN      4.38             (#peak   692)
 &rst
  ixpk= 692, nxpk= 0, iat=1257,1282, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  80 ALA  HA     83 ALA  HN      3.71             (#peak   934)
 &rst
  ixpk= 934, nxpk= 0, iat=1257,1301, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  80 ALA  HA     83 ALA  QB      2.91             (#peak   917)
 &rst
  ixpk= 917, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2=1305,1306,1307,
 &end
#
#  80 ALA  HA     84 GLN  HN      4.47             (#peak  1250)
 &rst
  ixpk= 1250, nxpk= 0, iat=1257,1311, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  80 ALA  HA     84 GLN  HE21    4.83             (#peak   822)
 &rst
  ixpk= 822, nxpk= 0, iat=1257,1323, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  80 ALA  HA     84 GLN  HE22    5.50             (#peak 820  )
 &rst
  ixpk= 820, nxpk= 0, iat=1257,1324, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  80 ALA  QB     81 GLN  HN      3.05             (#peak  1076)
 &rst
  ixpk= 1076, nxpk= 0, iat=  -1,1265, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1259,1260,1261,
 &end
#
#  80 ALA  QB     81 GLN  HA      4.13             (#peak   245)
 &rst
  ixpk= 245, nxpk= 0, iat=  -1,1267, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1=1259,1260,1261,
 &end
#
#  80 ALA  QB     82 ILE  HN      4.65             (#peak   878)
 &rst
  ixpk= 878, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=1259,1260,1261,
 &end
#
#  80 ALA  QB     82 ILE  QD1     6.00             (#peak 883  )
 &rst
  ixpk= 883, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
 igr1=1259,1260,1261,
 igr2=1295,1296,1297,
 &end
#
#  80 ALA  QB     83 ALA  HN      4.83             (#peak   960)
 &rst
  ixpk= 960, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1=1259,1260,1261,
 &end
#
#  80 ALA  QB     84 GLN  HE21    4.47             (#peak   877)
 &rst
  ixpk= 877, nxpk= 0, iat=  -1,1323, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=1259,1260,1261,
 &end
#
#  80 ALA  QB     84 GLN  HG2     4.27             (#peak   881)
 &rst
  ixpk= 881, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1=1259,1260,1261,
 &end
#
#  81 GLN  HN     81 GLN  HB2     3.71             (#peak  1072)
 &rst
  ixpk= 1072, nxpk= 0, iat=1265,1269, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  81 GLN  HN     81 GLN  HB3     3.71             (#peak  1724)
 &rst
  ixpk= 1724, nxpk= 0, iat=1265,1270, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  81 GLN  HN     81 GLN  QB      2.95             (#peak  1072)
 &rst
  ixpk= 1072, nxpk= 0, iat=1265,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2=1269,1270,
 &end
#
#  81 GLN  HN     82 ILE  HN      3.20             (#peak  1067)
 &rst
  ixpk= 1067, nxpk= 0, iat=1265,1282, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  81 GLN  HN     83 ALA  HN      4.81             (#peak  1068)
 &rst
  ixpk= 1068, nxpk= 0, iat=1265,1301, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  81 GLN  HN     84 GLN  HG3     5.50   (#peak 1725 )
 &rst
  ixpk= 1725, nxpk= 0, iat=1265,1319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  81 GLN  HN     94 VAL  QG1     4.87             (#peak  1078)
 &rst
  ixpk= 1078, nxpk= 0, iat=1265,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2=1475,1476,1477,
 &end
#
#  81 GLN  HN     94 VAL  QG2     4.87             (#peak  1079)
 &rst
  ixpk= 1079, nxpk= 0, iat=1265,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2=1479,1480,1481,
 &end
#
#  81 GLN  HN     94 VAL  QQG     4.28             (#peak  1078)
 &rst
  ixpk= 1078, nxpk= 0, iat=1265,1472, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,  &end
#
#  81 GLN  HA     82 ILE  HA      5.50             (#peak   237)
 &rst
  ixpk= 237, nxpk= 0, iat=1267,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  81 GLN  HA     84 GLN  HN      4.06             (#peak   232)
 &rst
  ixpk= 232, nxpk= 0, iat=1267,1311, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  81 GLN  HA     94 VAL  QQG     4.35             (#peak  1178)
 &rst
  ixpk= 1178, nxpk= 0, iat=1267,1472, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,  &end
#
#  81 GLN  HB2    94 VAL  QG1     5.38             (#peak  1194)
 &rst
  ixpk= 1194, nxpk= 0, iat=1269,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1475,1476,1477,
 &end
#
#  81 GLN  HB2    94 VAL  QG2     5.38             (#peak  1174)
 &rst
  ixpk= 1174, nxpk= 0, iat=1269,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1479,1480,1481,
 &end
#
#  81 GLN  HB3    94 VAL  QG1     5.38             (#peak  1195)
 &rst
  ixpk= 1195, nxpk= 0, iat=1270,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1475,1476,1477,
 &end
#
#  81 GLN  HB3    94 VAL  QG2     5.38             (#peak  1174)
 &rst
  ixpk= 1174, nxpk= 0, iat=1270,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1479,1480,1481,
 &end
#
#  81 GLN  QB     81 GLN  QE2     3.37             (#peak  1406)
 &rst
  ixpk= 1406, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr1=1269,1270,
 igr2=1277,1278,
 &end
#
#  81 GLN  QB     82 ILE  HN      3.68             (#peak   696)
 &rst
  ixpk= 696, nxpk= 0, iat=  -1,1282, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1=1269,1270,
 &end
#
#  81 GLN  QB     82 ILE  HB      4.82             (#peak   888)
 &rst
  ixpk= 888, nxpk= 0, iat=  -1,1286, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1=1269,1270,
 &end
#
#  81 GLN  QB     94 VAL  QQG     3.05             (#peak  1174)
 &rst
  ixpk= 1174, nxpk= 0, iat=  -1,1472, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=1269,1270,
 &end
#
#  82 ILE  HN     82 ILE  HB      2.94             (#peak   697)
 &rst
  ixpk= 697, nxpk= 0, iat=1282,1286, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
#  82 ILE  HN     82 ILE  QD1     3.82             (#peak  2106)
 &rst
  ixpk= 2106, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2=1295,1296,1297,
 &end
#
#  82 ILE  HN     82 ILE  QG1     3.21             (#peak   698)
 &rst
  ixpk= 698, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1292,1293,
 &end
#
#  82 ILE  HN     82 ILE  QG2     3.74             (#peak  2130)
 &rst
  ixpk= 2130, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1288,1289,1290,
 &end
#
#  82 ILE  HN     83 ALA  HN      3.09             (#peak   933)
 &rst
  ixpk= 933, nxpk= 0, iat=1282,1301, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#  82 ILE  HN     83 ALA  QB      4.35             (#peak   700)
 &rst
  ixpk= 700, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1305,1306,1307,
 &end
#
#  82 ILE  HN     84 GLN  HN      4.31             (#peak  1247)
 &rst
  ixpk= 1247, nxpk= 0, iat=1282,1311, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  82 ILE  HN     86 LEU  HG      6.00             (#peak 703  )
 &rst
  ixpk= 703, nxpk= 0, iat=1282,1345, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  82 ILE  HN     94 VAL  HB      5.46             (#peak   699)
 &rst
  ixpk= 699, nxpk= 0, iat=1282,1473, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  82 ILE  HN     94 VAL  QG1     4.09             (#peak  1190)
 &rst
  ixpk= 1190, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1475,1476,1477,
 &end
#
#  82 ILE  HN     94 VAL  QG2     4.09             (#peak  1182)
 &rst
  ixpk= 1182, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1479,1480,1481,
 &end
#
#  82 ILE  HN     94 VAL  QQG     3.49             (#peak  1190)
 &rst
  ixpk= 1190, nxpk= 0, iat=1282,1472, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,  &end
#
#  82 ILE  HN     96 ILE  QG2     5.25             (#peak   704)
 &rst
  ixpk= 704, nxpk= 0, iat=1282,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2=1506,1507,1508,
 &end
#
#  82 ILE  HA     82 ILE  QD1     3.88             (#peak  2105)
 &rst
  ixpk= 2105, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2=1295,1296,1297,
 &end
#
#  82 ILE  HA     82 ILE  QG2     3.21             (#peak   896)
 &rst
  ixpk= 896, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2=1288,1289,1290,
 &end
#
#  82 ILE  HA     85 ALA  HN      3.80             (#peak   381)
 &rst
  ixpk= 381, nxpk= 0, iat=1284,1328, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  82 ILE  HA     85 ALA  HA      5.47             (#peak   936)
 &rst
  ixpk= 936, nxpk= 0, iat=1284,1330, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  82 ILE  HA     85 ALA  QB      3.38             (#peak   947)
 &rst
  ixpk= 947, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2=1332,1333,1334,
 &end
#
#  82 ILE  HA     94 VAL  QG1     5.00             (#peak  1193)
 &rst
  ixpk= 1193, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1475,1476,1477,
 &end
#
#  82 ILE  HA     94 VAL  QG2     4.77             (#peak  1176)
 &rst
  ixpk= 1176, nxpk= 0, iat=1284,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2=1479,1480,1481,
 &end
#
#  82 ILE  HA     94 VAL  QQG     3.74             (#peak  1176)
 &rst
  ixpk= 1176, nxpk= 0, iat=1284,1472, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
#  82 ILE  HB     82 ILE  QD1     3.28             (#peak  2115)
 &rst
  ixpk= 2115, nxpk= 0, iat=1286,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=1295,1296,1297,
 &end
#
#  82 ILE  HB     83 ALA  HN      3.15             (#peak   937)
 &rst
  ixpk= 937, nxpk= 0, iat=1286,1301, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  82 ILE  HB     83 ALA  QB      4.30             (#peak   901)
 &rst
  ixpk= 901, nxpk= 0, iat=1286,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=1305,1306,1307,
 &end
#
#  82 ILE  HB     86 LEU  HG      5.50             (#peak 904  )
 &rst
  ixpk= 904, nxpk= 0, iat=1286,1345, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  82 ILE  HB     94 VAL  QG2     5.50             (#peak 1172 )
 &rst
  ixpk= 1172, nxpk= 0, iat=1286,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1479,1480,1481,
 &end
#
#  82 ILE  QD1   112 VAL  HN      5.48             (#peak  2619)
 &rst
  ixpk= 2619, nxpk= 0, iat=  -1,1754, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    83 ALA  HN      4.55             (#peak  2107)
 &rst
  ixpk= 2107, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    86 LEU  HG      5.50             (#peak 2118 )
 &rst
  ixpk= 2118, nxpk= 0, iat=  -1,1345, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    94 VAL  HB      4.20             (#peak  2113)
 &rst
  ixpk= 2113, nxpk= 0, iat=  -1,1473, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    95 GLU  HN      5.06             (#peak    91)
 &rst
  ixpk= 91, nxpk= 0, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    96 ILE  HA      5.50             (#peak  2111)
 &rst
  ixpk= 2111, nxpk= 0, iat=  -1,1502, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    96 ILE  HB      4.25             (#peak  1248)
 &rst
  ixpk= 1248, nxpk= 0, iat=  -1,1504, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1=1295,1296,1297,
 &end
#
#  82 ILE  QD1    96 ILE  QD1     3.52             (#peak  2618)
 &rst
  ixpk= 2618, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1295,1296,1297,
 igr2=1513,1514,1515,
 &end
#
#  82 ILE  QD1    96 ILE  QG2     2.98             (#peak  2119)
 &rst
  ixpk= 2119, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr1=1295,1296,1297,
 igr2=1506,1507,1508,
 &end
#
#  82 ILE  QD1    98 PHE  HD      6.57             (#peak  2109)
 &rst
  ixpk= 2109, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.86, r4= 9.36,
 igr1=1295,1296,1297,
 igr2=1537,1545,
 &end
#
#  82 ILE  QG1    86 LEU  HG      5.00             (#peak 2616 )
 &rst
  ixpk= 2616, nxpk= 0, iat=  -1,1345, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1292,1293,
 &end
#
#  82 ILE  QG1    94 VAL  HB      4.56             (#peak  1161)
 &rst
  ixpk= 1161, nxpk= 0, iat=  -1,1473, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=1292,1293,
 &end
#
#  82 ILE  QG1    94 VAL  QG1     5.00             (#peak 1197 )
 &rst
  ixpk= 1197, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1292,1293,
 igr2=1475,1476,1477,
 &end
#
#  82 ILE  QG1    94 VAL  QQG     3.52             (#peak  1173)
 &rst
  ixpk= 1173, nxpk= 0, iat=  -1,1472, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1292,1293,
 &end
#
#  82 ILE  QG2   112 VAL  QQG     4.62             (#peak  2127)
 &rst
  ixpk= 2127, nxpk= 0, iat=  -1,1757, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    82 ILE  QG1     3.31             (#peak  2123)
 &rst
  ixpk= 2123, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1=1288,1289,1290,
 igr2=1292,1293,
 &end
#
#  82 ILE  QG2    83 ALA  HN      3.44             (#peak   941)
 &rst
  ixpk= 941, nxpk= 0, iat=  -1,1301, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    83 ALA  HA      4.07             (#peak   911)
 &rst
  ixpk= 911, nxpk= 0, iat=  -1,1303, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    83 ALA  QB      3.73             (#peak   923)
 &rst
  ixpk= 923, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1=1288,1289,1290,
 igr2=1305,1306,1307,
 &end
#
#  82 ILE  QG2    84 GLN  HN      4.64             (#peak  2131)
 &rst
  ixpk= 2131, nxpk= 0, iat=  -1,1311, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    85 ALA  HN      4.38             (#peak   374)
 &rst
  ixpk= 374, nxpk= 0, iat=  -1,1328, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    85 ALA  QB      4.30             (#peak  2125)
 &rst
  ixpk= 2125, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1288,1289,1290,
 igr2=1332,1333,1334,
 &end
#
#  82 ILE  QG2    86 LEU  HN      4.19             (#peak  1318)
 &rst
  ixpk= 1318, nxpk= 0, iat=  -1,1338, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1=1288,1289,1290,
 &end
#
#  82 ILE  QG2    86 LEU  QD1     3.32             (#peak   976)
 &rst
  ixpk= 976, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1=1288,1289,1290,
 igr2=1347,1348,1349,
 &end
#
#  82 ILE  QG2    86 LEU  QD2     3.84             (#peak  2124)
 &rst
  ixpk= 2124, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1=1288,1289,1290,
 igr2=1351,1352,1353,
 &end
#
#  82 ILE  QG2    96 ILE  QG2     4.49             (#peak  2127)
 &rst
  ixpk= 2127, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1=1288,1289,1290,
 igr2=1506,1507,1508,
 &end
#
#  83 ALA  HN     83 ALA  QB      2.62             (#peak   938)
 &rst
  ixpk= 938, nxpk= 0, iat=1301,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr2=1305,1306,1307,
 &end
#
#  83 ALA  HN     84 GLN  HN      3.14             (#peak   931)
 &rst
  ixpk= 931, nxpk= 0, iat=1301,1311, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,  &end
#
#  83 ALA  HN     85 ALA  HN      4.26             (#peak   932)
 &rst
  ixpk= 932, nxpk= 0, iat=1301,1328, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  83 ALA  HN     86 LEU  HG      5.00             (#peak 942  )
 &rst
  ixpk= 942, nxpk= 0, iat=1301,1345, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  83 ALA  HA     86 LEU  HN      4.32             (#peak  1313)
 &rst
  ixpk= 1313, nxpk= 0, iat=1303,1338, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  83 ALA  HA     86 LEU  HG      3.63             (#peak   960)
 &rst
  ixpk= 960, nxpk= 0, iat=1303,1345, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#  83 ALA  HA     86 LEU  QD1     4.46             (#peak   912)
 &rst
  ixpk= 912, nxpk= 0, iat=1303,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2=1347,1348,1349,
 &end
#
#  83 ALA  QB     84 GLN  HN      2.92             (#peak  1255)
 &rst
  ixpk= 1255, nxpk= 0, iat=  -1,1311, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     84 GLN  HA      3.98             (#peak   927)
 &rst
  ixpk= 927, nxpk= 0, iat=  -1,1313, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     84 GLN  HE21    3.29             (#peak   913)
 &rst
  ixpk= 913, nxpk= 0, iat=  -1,1323, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     84 GLN  HG2     5.02             (#peak  2634)
 &rst
  ixpk= 2634, nxpk= 0, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     84 GLN  HG3     5.16             (#peak  2635)
 &rst
  ixpk= 2635, nxpk= 0, iat=  -1,1319, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     85 ALA  HN      4.76             (#peak   915)
 &rst
  ixpk= 915, nxpk= 0, iat=  -1,1328, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     86 LEU  HG      5.00             (#peak 920  )
 &rst
  ixpk= 920, nxpk= 0, iat=  -1,1345, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     87 LEU  HN      5.40             (#peak  1220)
 &rst
  ixpk= 1220, nxpk= 0, iat=  -1,1357, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1305,1306,1307,
 &end
#
#  83 ALA  QB     87 LEU  QD1     5.00             (#peak 922  )
 &rst
  ixpk= 922, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1305,1306,1307,
 igr2=1366,1367,1368,
 &end
#
#  84 GLN  HN     84 GLN  HB2     2.91             (#peak  1254)
 &rst
  ixpk= 1254, nxpk= 0, iat=1311,1315, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
#  84 GLN  HN     84 GLN  HB3     3.66             (#peak  1726)
 &rst
  ixpk= 1726, nxpk= 0, iat=1311,1316, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  84 GLN  HN     84 GLN  HE21    3.74             (#peak  1248)
 &rst
  ixpk= 1248, nxpk= 0, iat=1311,1323, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  84 GLN  HN     84 GLN  HG2     3.58             (#peak  1747)
 &rst
  ixpk= 1747, nxpk= 0, iat=1311,1318, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,  &end
#
#  84 GLN  HN     84 GLN  HG3     4.12             (#peak  1746)
 &rst
  ixpk= 1746, nxpk= 0, iat=1311,1319, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  84 GLN  HN     85 ALA  HN      3.00             (#peak   388)
 &rst
  ixpk= 388, nxpk= 0, iat=1311,1328, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  84 GLN  HN     86 LEU  HN      4.36             (#peak  1249)
 &rst
  ixpk= 1249, nxpk= 0, iat=1311,1338, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  84 GLN  HN     87 LEU  QQD     5.19             (#peak  1256)
 &rst
  ixpk= 1256, nxpk= 0, iat=1311,1363, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,  &end
#
#  84 GLN  HA     84 GLN  HE22    4.75             (#peak   926)
 &rst
  ixpk= 926, nxpk= 0, iat=1313,1324, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#  84 GLN  HA     84 GLN  HG2     3.53             (#peak  2626)
 &rst
  ixpk= 2626, nxpk= 0, iat=1313,1318, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  84 GLN  HA     84 GLN  HG3     3.73             (#peak  2627)
 &rst
  ixpk= 2627, nxpk= 0, iat=1313,1319, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  84 GLN  HA     87 LEU  HN      3.94             (#peak  1214)
 &rst
  ixpk= 1214, nxpk= 0, iat=1313,1357, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  84 GLN  HA     87 LEU  HG      4.12             (#peak  1025)
 &rst
  ixpk= 1025, nxpk= 0, iat=1313,1364, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  84 GLN  HA     87 LEU  QQD     3.36             (#peak  1006)
 &rst
  ixpk= 1006, nxpk= 0, iat=1313,1363, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
#  84 GLN  HA     88 GLY  HN      4.98             (#peak  1554)
 &rst
  ixpk= 1554, nxpk= 0, iat=1313,1376, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  84 GLN  HB2    85 ALA  HN      3.52             (#peak   378)
 &rst
  ixpk= 378, nxpk= 0, iat=1315,1328, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  84 GLN  HB3    84 GLN  HE21    5.00             (#peak  1607)
 &rst
  ixpk= 1607, nxpk= 0, iat=1316,1323, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  84 GLN  HB3    85 ALA  HN      4.15             (#peak   379)
 &rst
  ixpk= 379, nxpk= 0, iat=1316,1328, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#  84 GLN  HB3    87 LEU  QQD     4.01             (#peak  1022)
 &rst
  ixpk= 1022, nxpk= 0, iat=1316,1363, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,  &end
#
#  84 GLN  HB3    89 ALA  HN      5.10             (#peak   914)
 &rst
  ixpk= 914, nxpk= 0, iat=1316,1383, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#  84 GLN  HE22   87 LEU  QQD     4.20             (#peak  1004)
 &rst
  ixpk= 1004, nxpk= 0, iat=1324,1363, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,  &end
#
#  84 GLN  HG2    84 GLN  HE22    4.02             (#peak  2624)
 &rst
  ixpk= 2624, nxpk= 0, iat=1318,1324, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  84 GLN  HG2    85 ALA  HN      4.66             (#peak   380)
 &rst
  ixpk= 380, nxpk= 0, iat=1318,1328, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  84 GLN  HG2    87 LEU  QQD     4.93             (#peak  2632)
 &rst
  ixpk= 2632, nxpk= 0, iat=1318,1363, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,  &end
#
#  84 GLN  HG3    84 GLN  HE21    3.51             (#peak  2622)
 &rst
  ixpk= 2622, nxpk= 0, iat=1319,1323, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  84 GLN  HG3    87 LEU  QQD     4.58             (#peak  1007)
 &rst
  ixpk= 1007, nxpk= 0, iat=1319,1363, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,  &end
#
#  85 ALA  HN     85 ALA  QB      2.66             (#peak   377)
 &rst
  ixpk= 377, nxpk= 0, iat=1328,  -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
 igr2=1332,1333,1334,
 &end
#
#  85 ALA  HN     86 LEU  HN      3.12             (#peak   384)
 &rst
  ixpk= 384, nxpk= 0, iat=1328,1338, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  85 ALA  HN     86 LEU  HG      4.34             (#peak   375)
 &rst
  ixpk= 375, nxpk= 0, iat=1328,1345, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  85 ALA  HN     86 LEU  QD2     4.29             (#peak   376)
 &rst
  ixpk= 376, nxpk= 0, iat=1328,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2=1351,1352,1353,
 &end
#
#  85 ALA  HN     87 LEU  HN      4.53             (#peak   385)
 &rst
  ixpk= 385, nxpk= 0, iat=1328,1357, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  85 ALA  HN     88 GLY  HN      5.50             (#peak  1550)
 &rst
  ixpk= 1550, nxpk= 0, iat=1328,1376, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  85 ALA  HA     86 LEU  QD2     4.35             (#peak   935)
 &rst
  ixpk= 935, nxpk= 0, iat=1330,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1351,1352,1353,
 &end
#
#  85 ALA  HA     87 LEU  HN      4.72             (#peak  1215)
 &rst
  ixpk= 1215, nxpk= 0, iat=1330,1357, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  85 ALA  HA     88 GLY  HN      4.32             (#peak  1553)
 &rst
  ixpk= 1553, nxpk= 0, iat=1330,1376, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  85 ALA  HA     89 ALA  HN      4.20             (#peak   903)
 &rst
  ixpk= 903, nxpk= 0, iat=1330,1383, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  85 ALA  QB     86 LEU  HN      3.28             (#peak  1316)
 &rst
  ixpk= 1316, nxpk= 0, iat=  -1,1338, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     87 LEU  HN      4.93             (#peak   943)
 &rst
  ixpk= 943, nxpk= 0, iat=  -1,1357, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     88 GLY  HN      5.26             (#peak  1560)
 &rst
  ixpk= 1560, nxpk= 0, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     89 ALA  HN      5.48             (#peak  1611)
 &rst
  ixpk= 1611, nxpk= 0, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     90 GLU  HN      4.85             (#peak  1122)
 &rst
  ixpk= 1122, nxpk= 0, iat=  -1,1393, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     92 ARG  HN      3.79             (#peak   945)
 &rst
  ixpk= 945, nxpk= 0, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1=1332,1333,1334,
 &end
#
#  85 ALA  QB     94 VAL  QG2     5.00             (#peak 949  )
 &rst
  ixpk= 949, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1332,1333,1334,
 igr2=1479,1480,1481,
 &end
#
#  85 ALA  QB     94 VAL  QQG     3.82             (#peak  1171)
 &rst
  ixpk= 1171, nxpk= 0, iat=  -1,1472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1=1332,1333,1334,
 &end
#
#  86 LEU  HN     86 LEU  HG      3.43             (#peak  1319)
 &rst
  ixpk= 1319, nxpk= 0, iat=1338,1345, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#  86 LEU  HN     86 LEU  QD1     4.26             (#peak  1320)
 &rst
  ixpk= 1320, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2=1347,1348,1349,
 &end
#
#  86 LEU  HN     86 LEU  QD2     2.94             (#peak  1315)
 &rst
  ixpk= 1315, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1351,1352,1353,
 &end
#
#  86 LEU  HN     87 LEU  HN      3.36             (#peak  1212)
 &rst
  ixpk= 1212, nxpk= 0, iat=1338,1357, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  86 LEU  HN     87 LEU  QD1     6.00             (#peak  1317)
 &rst
  ixpk= 1317, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1366,1367,1368,
 &end
#
#  86 LEU  HN     87 LEU  QD2     6.00             (#peak  1317)
 &rst
  ixpk= 1317, nxpk= 0, iat=1338,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1370,1371,1372,
 &end
#
#  86 LEU  HN     88 GLY  HN      4.36             (#peak  1309)
 &rst
  ixpk= 1309, nxpk= 0, iat=1338,1376, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  86 LEU  HA    127 LEU  QD1     6.00             (#peak 958  )
 &rst
  ixpk= 958, nxpk= 0, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1996,1997,1998,
 &end
#
#  86 LEU  HA     86 LEU  HG      4.17             (#peak   956)
 &rst
  ixpk= 956, nxpk= 0, iat=1340,1345, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  86 LEU  HA     86 LEU  QD1     3.92             (#peak   971)
 &rst
  ixpk= 971, nxpk= 0, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2=1347,1348,1349,
 &end
#
#  86 LEU  HA     86 LEU  QD2     3.77             (#peak   954)
 &rst
  ixpk= 954, nxpk= 0, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2=1351,1352,1353,
 &end
#
#  86 LEU  HA     88 GLY  HN      4.11             (#peak   950)
 &rst
  ixpk= 950, nxpk= 0, iat=1340,1376, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  86 LEU  HB2    86 LEU  QD1     4.08             (#peak   975)
 &rst
  ixpk= 975, nxpk= 0, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2=1347,1348,1349,
 &end
#
#  86 LEU  HB3    86 LEU  QD1     4.08             (#peak   975)
 &rst
  ixpk= 975, nxpk= 0, iat=1343,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2=1347,1348,1349,
 &end
#
#  86 LEU  HG     87 LEU  HN      4.37             (#peak  1223)
 &rst
  ixpk= 1223, nxpk= 0, iat=1345,1357, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  86 LEU  QD1   125 PHE  HB3     5.50             (#peak   973)
 &rst
  ixpk= 973, nxpk= 0, iat=  -1,1953, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1347,1348,1349,
 &end
#
#  86 LEU  QD1   125 PHE  HD      6.78             (#peak   978)
 &rst
  ixpk= 978, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1=1347,1348,1349,
 igr2=1956,1964,
 &end
#
#  86 LEU  QD1    87 LEU  HN      5.05             (#peak  1727)
 &rst
  ixpk= 1727, nxpk= 0, iat=  -1,1357, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1=1347,1348,1349,
 &end
#
#  86 LEU  QD2   112 VAL  QQG     4.16             (#peak  1493)
 &rst
  ixpk= 1493, nxpk= 0, iat=  -1,1757, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
 igr1=1351,1352,1353,
 &end
#
#  86 LEU  QD2    87 LEU  HN      4.50             (#peak  1219)
 &rst
  ixpk= 1219, nxpk= 0, iat=  -1,1357, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1351,1352,1353,
 &end
#
#  86 LEU  QD2    88 GLY  HN      5.25             (#peak  1559)
 &rst
  ixpk= 1559, nxpk= 0, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1351,1352,1353,
 &end
#
#  86 LEU  QD2    88 GLY  HN      6.00             (#peak 981  )
 &rst
  ixpk= 981, nxpk= 0, iat=  -1,1376, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1351,1352,1353,
 &end
#
#  87 LEU  HN     87 LEU  HB2     3.96             (#peak  1217)
 &rst
  ixpk= 1217, nxpk= 0, iat=1357,1361, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  87 LEU  HN     87 LEU  HB3     3.96             (#peak  1218)
 &rst
  ixpk= 1218, nxpk= 0, iat=1357,1362, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  87 LEU  HN     87 LEU  HG      4.22             (#peak  1218)
 &rst
  ixpk= 1218, nxpk= 0, iat=1357,1364, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  87 LEU  HN     87 LEU  QB      3.11             (#peak  1217)
 &rst
  ixpk= 1217, nxpk= 0, iat=1357,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2=1361,1362,
 &end
#
#  87 LEU  HN     87 LEU  QD1     4.06             (#peak  1222)
 &rst
  ixpk= 1222, nxpk= 0, iat=1357,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1366,1367,1368,
 &end
#
#  87 LEU  HN     87 LEU  QD2     4.06             (#peak  1014)
 &rst
  ixpk= 1014, nxpk= 0, iat=1357,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1370,1371,1372,
 &end
#
#  87 LEU  HN     87 LEU  QQD     3.54             (#peak  1014)
 &rst
  ixpk= 1014, nxpk= 0, iat=1357,1363, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#  87 LEU  HN     88 GLY  HN      3.00             (#peak  1547)
 &rst
  ixpk= 1547, nxpk= 0, iat=1357,1376, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  87 LEU  HA     87 LEU  HG      3.89             (#peak  1024)
 &rst
  ixpk= 1024, nxpk= 0, iat=1359,1364, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  87 LEU  HA     87 LEU  QD1     4.15             (#peak  1005)
 &rst
  ixpk= 1005, nxpk= 0, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2=1366,1367,1368,
 &end
#
#  87 LEU  HA     87 LEU  QD2     4.15             (#peak   995)
 &rst
  ixpk= 995, nxpk= 0, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2=1370,1371,1372,
 &end
#
#  87 LEU  HA     87 LEU  QD2     5.00             (#peak 1016 )
 &rst
  ixpk= 1016, nxpk= 0, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1370,1371,1372,
 &end
#
#  87 LEU  HA     87 LEU  QQD     3.48             (#peak   995)
 &rst
  ixpk= 995, nxpk= 0, iat=1359,1363, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
#  87 LEU  HB2    88 GLY  HN      4.43             (#peak  1557)
 &rst
  ixpk= 1557, nxpk= 0, iat=1361,1376, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  87 LEU  HB3    88 GLY  HN      4.43             (#peak  1558)
 &rst
  ixpk= 1558, nxpk= 0, iat=1362,1376, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  87 LEU  HG     88 GLY  HN      4.69             (#peak  1558)
 &rst
  ixpk= 1558, nxpk= 0, iat=1364,1376, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#  87 LEU  HG     89 ALA  HN      4.43             (#peak   916)
 &rst
  ixpk= 916, nxpk= 0, iat=1364,1383, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#  87 LEU  QB     87 LEU  QQD     2.71             (#peak  1018)
 &rst
  ixpk= 1018, nxpk= 0, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1361,1362,
 &end
#
#  87 LEU  QB     89 ALA  HN      4.09             (#peak   916)
 &rst
  ixpk= 916, nxpk= 0, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1361,1362,
 &end
#
#  87 LEU  QQD    88 GLY  HN      3.98             (#peak  1563)
 &rst
  ixpk= 1563, nxpk= 0, iat=1363,1376, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,  &end
#
#  87 LEU  QQD    89 ALA  HN      3.29             (#peak   918)
 &rst
  ixpk= 918, nxpk= 0, iat=1363,1383, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  87 LEU  QQD    89 ALA  HA      3.40             (#peak    64)
 &rst
  ixpk= 64, nxpk= 0, iat=1363,1385, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#  87 LEU  QQD    89 ALA  QB      2.91             (#peak  1034)
 &rst
  ixpk= 1034, nxpk= 0, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2=1387,1388,1389,
 &end
#
#  87 LEU  QQD    90 GLU  HN      4.59             (#peak  1124)
 &rst
  ixpk= 1124, nxpk= 0, iat=1363,1393, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,  &end
#
#  88 GLY  HN     89 ALA  HN      4.04             (#peak  1612)
 &rst
  ixpk= 1612, nxpk= 0, iat=1376,1383, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  88 GLY  HN     89 ALA  QB      4.73             (#peak  1562)
 &rst
  ixpk= 1562, nxpk= 0, iat=1376,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2=1387,1388,1389,
 &end
#
#  88 GLY  HN     90 GLU  HN      4.67             (#peak  1114)
 &rst
  ixpk= 1114, nxpk= 0, iat=1376,1393, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  88 GLY  QA     89 ALA  QB      4.67             (#peak  1037)
 &rst
  ixpk= 1037, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1378,1379,
 igr2=1387,1388,1389,
 &end
#
#  89 ALA  HN     89 ALA  QB      2.97             (#peak  1610)
 &rst
  ixpk= 1610, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2=1387,1388,1389,
 &end
#
#  89 ALA  HN     90 GLU  HN      3.23             (#peak  1113)
 &rst
  ixpk= 1113, nxpk= 0, iat=1383,1393, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  89 ALA  HN     90 GLU  QG      4.90             (#peak  1609)
 &rst
  ixpk= 1609, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1400,1401,
 &end
#
#  89 ALA  QB     90 GLU  HN      3.45             (#peak  1123)
 &rst
  ixpk= 1123, nxpk= 0, iat=  -1,1393, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1=1387,1388,1389,
 &end
#
#  89 ALA  QB     90 GLU  QG      4.45             (#peak  1042)
 &rst
  ixpk= 1042, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1=1387,1388,1389,
 igr2=1400,1401,
 &end
#
#  90 GLU  HN     90 GLU  HB2     4.00             (#peak  1118)
 &rst
  ixpk= 1118, nxpk= 0, iat=1393,1397, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  90 GLU  HN     90 GLU  HB3     4.00             (#peak  1120)
 &rst
  ixpk= 1120, nxpk= 0, iat=1393,1398, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#  90 GLU  HN     90 GLU  QB      3.47             (#peak  1120)
 &rst
  ixpk= 1120, nxpk= 0, iat=1393,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2=1397,1398,
 &end
#
#  90 GLU  HN     90 GLU  QG      3.61             (#peak  1117)
 &rst
  ixpk= 1117, nxpk= 0, iat=1393,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1400,1401,
 &end
#
#  90 GLU  HN     91 GLU  HN      4.55             (#peak   365)
 &rst
  ixpk= 365, nxpk= 0, iat=1393,1408, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  90 GLU  HA     90 GLU  QG      3.73             (#peak  1059)
 &rst
  ixpk= 1059, nxpk= 0, iat=1395,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2=1400,1401,
 &end
#
#  90 GLU  HG2    91 GLU  HN      5.39             (#peak  1058)
 &rst
  ixpk= 1058, nxpk= 0, iat=1400,1408, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  90 GLU  HG3    91 GLU  HN      5.39             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=1401,1408, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  90 GLU  QB     90 GLU  QG      2.25             (#peak  1061)
 &rst
  ixpk= 1061, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33,
 igr1=1397,1398,
 igr2=1400,1401,
 &end
#
#  90 GLU  QB     91 GLU  HN      2.92             (#peak   371)
 &rst
  ixpk= 371, nxpk= 0, iat=  -1,1408, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr1=1397,1398,
 &end
#
#  90 GLU  QG     91 GLU  HN      4.57             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=  -1,1408, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1=1400,1401,
 &end
#
#  91 GLU  HN     91 GLU  HG2     5.18             (#peak   369)
 &rst
  ixpk= 369, nxpk= 0, iat=1408,1415, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  91 GLU  HN     91 GLU  HG3     5.18             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=1408,1416, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  91 GLU  HN     91 GLU  QB      3.58             (#peak   372)
 &rst
  ixpk= 372, nxpk= 0, iat=1408,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2=1412,1413,
 &end
#
#  91 GLU  HN     91 GLU  QG      4.33             (#peak   369)
 &rst
  ixpk= 369, nxpk= 0, iat=1408,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2=1415,1416,
 &end
#
#  91 GLU  HN     92 ARG  HN      4.40             (#peak   364)
 &rst
  ixpk= 364, nxpk= 0, iat=1408,1423, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  91 GLU  HA    114 PRO  HD3     5.50             (#peak 1066 )
 &rst
  ixpk= 1066, nxpk= 0, iat=1410,1788, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  91 GLU  HA    114 PRO  QD      5.35             (#peak  2707)
 &rst
  ixpk= 2707, nxpk= 0, iat=1410,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr2=1787,1788,
 &end
#
#  91 GLU  HA    127 LEU  QD1     5.50             (#peak 1070 )
 &rst
  ixpk= 1070, nxpk= 0, iat=1410,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1996,1997,1998,
 &end
#
#  91 GLU  HA     91 GLU  HG2     4.16             (#peak  1073)
 &rst
  ixpk= 1073, nxpk= 0, iat=1410,1415, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  91 GLU  HA     91 GLU  HG3     4.16             (#peak  1069)
 &rst
  ixpk= 1069, nxpk= 0, iat=1410,1416, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  91 GLU  HA     91 GLU  QG      3.65             (#peak  1073)
 &rst
  ixpk= 1073, nxpk= 0, iat=1410,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2=1415,1416,
 &end
#
#  91 GLU  HA     92 ARG  HN      3.23             (#peak   212)
 &rst
  ixpk= 212, nxpk= 0, iat=1410,1423, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  91 GLU  HA     92 ARG  QB      4.65             (#peak  1068)
 &rst
  ixpk= 1068, nxpk= 0, iat=1410,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1427,1428,
 &end
#
#  91 GLU  HB2   114 PRO  HD2     5.50             (#peak 2706 )
 &rst
  ixpk= 2706, nxpk= 0, iat=1412,1787, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  91 GLU  HB2   114 PRO  HD3     5.50             (#peak 2705 )
 &rst
  ixpk= 2705, nxpk= 0, iat=1412,1788, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  91 GLU  HG2   127 LEU  QD1     5.50             (#peak 1082 )
 &rst
  ixpk= 1082, nxpk= 0, iat=1415,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1996,1997,1998,
 &end
#
#  91 GLU  HG3   127 LEU  QD1     6.00             (#peak 1083 )
 &rst
  ixpk= 1083, nxpk= 0, iat=1416,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1996,1997,1998,
 &end
#
#  91 GLU  QB     92 ARG  HN      4.27             (#peak   216)
 &rst
  ixpk= 216, nxpk= 0, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr1=1412,1413,
 &end
#
#  91 GLU  QG     92 ARG  HN      3.72             (#peak   217)
 &rst
  ixpk= 217, nxpk= 0, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1=1415,1416,
 &end
#
#  92 ARG  HN    114 PRO  HG3     4.71             (#peak   220)
 &rst
  ixpk= 220, nxpk= 0, iat=1423,1791, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  92 ARG  HN    114 PRO  QD      4.52             (#peak   213)
 &rst
  ixpk= 213, nxpk= 0, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=1787,1788,
 &end
#
#  92 ARG  HN    122 VAL  QQG     6.00             (#peak   224)
 &rst
  ixpk= 224, nxpk= 0, iat=1423,1899, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,  &end
#
#  92 ARG  HN    127 LEU  QD1     6.00             (#peak 222  )
 &rst
  ixpk= 222, nxpk= 0, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1996,1997,1998,
 &end
#
#  92 ARG  HN     92 ARG  HB2     3.62             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat=1423,1427, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  92 ARG  HN     92 ARG  HB3     3.62             (#peak   219)
 &rst
  ixpk= 219, nxpk= 0, iat=1423,1428, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  92 ARG  HN     92 ARG  QB      3.13             (#peak   218)
 &rst
  ixpk= 218, nxpk= 0, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2=1427,1428,
 &end
#
#  92 ARG  HN     94 VAL  QQG     5.01             (#peak   223)
 &rst
  ixpk= 223, nxpk= 0, iat=1423,1472, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,  &end
#
#  92 ARG  HA     92 ARG  HD2     5.00             (#peak  2757)
 &rst
  ixpk= 2757, nxpk= 0, iat=1425,1433, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  92 ARG  HA     92 ARG  HD3     4.16             (#peak  2764)
 &rst
  ixpk= 2764, nxpk= 0, iat=1425,1434, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  92 ARG  HA     92 ARG  QD      3.56             (#peak  2757)
 &rst
  ixpk= 2757, nxpk= 0, iat=1425,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1433,1434,
 &end
#
#  92 ARG  HA     93 LYS  QE      6.00             (#peak 1086 )
 &rst
  ixpk= 1086, nxpk= 0, iat=1425,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1460,1461,
 &end
#
#  92 ARG  HD2    93 LYS  HN      4.23             (#peak   603)
 &rst
  ixpk= 603, nxpk= 0, iat=1433,1447, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  92 ARG  HD3    93 LYS  HN      4.23             (#peak   604)
 &rst
  ixpk= 604, nxpk= 0, iat=1434,1447, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,  &end
#
#  92 ARG  HG2    92 ARG  HE      3.93             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=1430,1436, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  92 ARG  HG3    92 ARG  HE      3.93             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=1431,1436, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  92 ARG  QB     92 ARG  QD      3.19             (#peak  2761)
 &rst
  ixpk= 2761, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1=1427,1428,
 igr2=1433,1434,
 &end
#
#  92 ARG  QD     93 LYS  HN      3.66             (#peak   603)
 &rst
  ixpk= 603, nxpk= 0, iat=  -1,1447, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1433,1434,
 &end
#
#  92 ARG  QG     92 ARG  HE      3.39             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=  -1,1436, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr1=1430,1431,
 &end
#
#  92 ARG  QG     93 LYS  HN      2.85             (#peak   605)
 &rst
  ixpk= 605, nxpk= 0, iat=  -1,1447, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
 igr1=1430,1431,
 &end
#
#  93 LYS  HN    113 VAL  HA      4.93             (#peak   602)
 &rst
  ixpk= 602, nxpk= 0, iat=1447,1772, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  93 LYS  HN     93 LYS  QB      3.19             (#peak  1729)
 &rst
  ixpk= 1729, nxpk= 0, iat=1447,  -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
 igr2=1451,1452,
 &end
#
#  93 LYS  HN     93 LYS  QD      5.00             (#peak  1729)
 &rst
  ixpk= 1729, nxpk= 0, iat=1447,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1457,1458,
 &end
#
#  93 LYS  HN     93 LYS  QG      5.00             (#peak   644)
 &rst
  ixpk= 644, nxpk= 0, iat=1447,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2=1454,1455,
 &end
#
#  93 LYS  HN     94 VAL  HN      4.79             (#peak   599)
 &rst
  ixpk= 599, nxpk= 0, iat=1447,1469, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  93 LYS  HN     94 VAL  QQG     4.48             (#peak   609)
 &rst
  ixpk= 609, nxpk= 0, iat=1447,1472, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,  &end
#
#  93 LYS  HA    113 VAL  HA      3.68             (#peak  1109)
 &rst
  ixpk= 1109, nxpk= 0, iat=1449,1772, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  93 LYS  HA    127 LEU  QQD     5.00             (#peak  1113)
 &rst
  ixpk= 1113, nxpk= 0, iat=1449,1993, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,  &end
#
#  93 LYS  HA     93 LYS  QD      4.14             (#peak  1129)
 &rst
  ixpk= 1129, nxpk= 0, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1457,1458,
 &end
#
#  93 LYS  HA     93 LYS  QE      5.07             (#peak  1144)
 &rst
  ixpk= 1144, nxpk= 0, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2=1460,1461,
 &end
#
#  93 LYS  HA     93 LYS  QG      3.72             (#peak  1111)
 &rst
  ixpk= 1111, nxpk= 0, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=1454,1455,
 &end
#
#  93 LYS  HA     94 VAL  HN      2.86             (#peak   257)
 &rst
  ixpk= 257, nxpk= 0, iat=1449,1469, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#  93 LYS  HA     94 VAL  HB      5.50             (#peak  1165)
 &rst
  ixpk= 1165, nxpk= 0, iat=1449,1473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  93 LYS  HA     94 VAL  QQG     4.15             (#peak  1181)
 &rst
  ixpk= 1181, nxpk= 0, iat=1449,1472, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,  &end
#
#  93 LYS  HG2   113 VAL  HA      5.50             (#peak  1119)
 &rst
  ixpk= 1119, nxpk= 0, iat=1454,1772, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  93 LYS  HG2    95 GLU  HA      6.00             (#peak 1209 )
 &rst
  ixpk= 1209, nxpk= 0, iat=1454,1487, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  93 LYS  HG3   113 VAL  HA      5.50             (#peak  1529)
 &rst
  ixpk= 1529, nxpk= 0, iat=1455,1772, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  93 LYS  QB    112 VAL  HN      4.21             (#peak    43)
 &rst
  ixpk= 43, nxpk= 0, iat=  -1,1754, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1=1451,1452,
 &end
#
#  93 LYS  QB    113 VAL  HA      3.87             (#peak  1528)
 &rst
  ixpk= 1528, nxpk= 0, iat=  -1,1772, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=1451,1452,
 &end
#
#  93 LYS  QB     93 LYS  QE      2.98             (#peak  1146)
 &rst
  ixpk= 1146, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1=1451,1452,
 igr2=1460,1461,
 &end
#
#  93 LYS  QB     94 VAL  HN      5.00             (#peak   253)
 &rst
  ixpk= 253, nxpk= 0, iat=  -1,1469, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1451,1452,
 &end
#
#  93 LYS  QD     95 GLU  HA      6.00             (#peak 1132 )
 &rst
  ixpk= 1132, nxpk= 0, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1457,1458,
 &end
#
#  93 LYS  QD     95 GLU  HA      6.00             (#peak 1132 )
 &rst
  ixpk= 1132, nxpk= 0, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1457,1458,
 &end
#
#  93 LYS  QE    112 VAL  QG2     5.50             (#peak 1151 )
 &rst
  ixpk= 1151, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1460,1461,
 igr2=1764,1765,1766,
 &end
#
#  93 LYS  QE    113 VAL  HA      5.50             (#peak  1143)
 &rst
  ixpk= 1143, nxpk= 0, iat=  -1,1772, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1460,1461,
 &end
#
#  93 LYS  QG    113 VAL  HA      4.68             (#peak  1529)
 &rst
  ixpk= 1529, nxpk= 0, iat=  -1,1772, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=1454,1455,
 &end
#
#  93 LYS  QG     93 LYS  QE      2.98             (#peak  1148)
 &rst
  ixpk= 1148, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1=1454,1455,
 igr2=1460,1461,
 &end
#
#  93 LYS  QG     94 VAL  HN      4.11             (#peak   251)
 &rst
  ixpk= 251, nxpk= 0, iat=  -1,1469, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1=1454,1455,
 &end
#
#  94 VAL  HN    112 VAL  HN      4.02             (#peak   261)
 &rst
  ixpk= 261, nxpk= 0, iat=1469,1754, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  94 VAL  HN    112 VAL  HB      3.75             (#peak   254)
 &rst
  ixpk= 254, nxpk= 0, iat=1469,1758, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  94 VAL  HN    112 VAL  QG1     4.35             (#peak   246)
 &rst
  ixpk= 246, nxpk= 0, iat=1469,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1760,1761,1762,
 &end
#
#  94 VAL  HN    112 VAL  QG2     4.35             (#peak   249)
 &rst
  ixpk= 249, nxpk= 0, iat=1469,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1764,1765,1766,
 &end
#
#  94 VAL  HN    112 VAL  QQG     3.43             (#peak   249)
 &rst
  ixpk= 249, nxpk= 0, iat=1469,1757, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  94 VAL  HN    113 VAL  HA      5.50             (#peak   256)
 &rst
  ixpk= 256, nxpk= 0, iat=1469,1772, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  94 VAL  HN     94 VAL  HB      4.11             (#peak  1167)
 &rst
  ixpk= 1167, nxpk= 0, iat=1469,1473, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  94 VAL  HN     94 VAL  QG1     4.06             (#peak   248)
 &rst
  ixpk= 248, nxpk= 0, iat=1469,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1475,1476,1477,
 &end
#
#  94 VAL  HN     94 VAL  QG2     4.06             (#peak   250)
 &rst
  ixpk= 250, nxpk= 0, iat=1469,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1479,1480,1481,
 &end
#
#  94 VAL  HN     94 VAL  QQG     3.16             (#peak   250)
 &rst
  ixpk= 250, nxpk= 0, iat=1469,1472, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  94 VAL  HN     95 GLU  HN      4.52             (#peak   258)
 &rst
  ixpk= 258, nxpk= 0, iat=1469,1485, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  94 VAL  HN     96 ILE  QD1     5.50             (#peak   247)
 &rst
  ixpk= 247, nxpk= 0, iat=1469,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1513,1514,1515,
 &end
#
#  94 VAL  HA     94 VAL  QG1     3.51             (#peak  1158)
 &rst
  ixpk= 1158, nxpk= 0, iat=1471,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1475,1476,1477,
 &end
#
#  94 VAL  HA     94 VAL  QG2     3.51             (#peak  1179)
 &rst
  ixpk= 1179, nxpk= 0, iat=1471,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1479,1480,1481,
 &end
#
#  94 VAL  HA     94 VAL  QQG     2.96             (#peak  1179)
 &rst
  ixpk= 1179, nxpk= 0, iat=1471,1472, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  94 VAL  HA     95 GLU  HN      2.72             (#peak    84)
 &rst
  ixpk= 84, nxpk= 0, iat=1471,1485, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
#  94 VAL  HA     95 GLU  HA      4.89             (#peak  1211)
 &rst
  ixpk= 1211, nxpk= 0, iat=1471,1487, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  94 VAL  HA     95 GLU  QB      4.25             (#peak  1214)
 &rst
  ixpk= 1214, nxpk= 0, iat=1471,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1489,1490,
 &end
#
#  94 VAL  HB    112 VAL  HN      6.00             (#peak 1168 )
 &rst
  ixpk= 1168, nxpk= 0, iat=1473,1754, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  94 VAL  HB    112 VAL  QG1     5.50             (#peak  1164)
 &rst
  ixpk= 1164, nxpk= 0, iat=1473,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1760,1761,1762,
 &end
#
#  94 VAL  HB    112 VAL  QG2     5.50             (#peak  1020)
 &rst
  ixpk= 1020, nxpk= 0, iat=1473,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1764,1765,1766,
 &end
#
#  94 VAL  HB    112 VAL  QQG     4.29             (#peak  1020)
 &rst
  ixpk= 1020, nxpk= 0, iat=1473,1757, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,  &end
#
#  94 VAL  HB     95 GLU  HN      4.01             (#peak    88)
 &rst
  ixpk= 88, nxpk= 0, iat=1473,1485, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  94 VAL  HB     95 GLU  HA      4.81             (#peak  1208)
 &rst
  ixpk= 1208, nxpk= 0, iat=1473,1487, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  94 VAL  HB     96 ILE  QG2     5.50             (#peak  1164)
 &rst
  ixpk= 1164, nxpk= 0, iat=1473,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1506,1507,1508,
 &end
#
#  94 VAL  QG1    95 GLU  HN      4.12             (#peak    90)
 &rst
  ixpk= 90, nxpk= 0, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1475,1476,1477,
 &end
#
#  94 VAL  QG1    96 ILE  HN      5.50             (#peak 146  )
 &rst
  ixpk= 146, nxpk= 0, iat=  -1,1500, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1475,1476,1477,
 &end
#
#  94 VAL  QG2    95 GLU  HN      4.12             (#peak  1184)
 &rst
  ixpk= 1184, nxpk= 0, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1479,1480,1481,
 &end
#
#  94 VAL  QQG    95 GLU  HN      2.96             (#peak    90)
 &rst
  ixpk= 90, nxpk= 0, iat=1472,1485, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  94 VAL  QQG    95 GLU  HA      4.17             (#peak  1192)
 &rst
  ixpk= 1192, nxpk= 0, iat=1472,1487, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,  &end
#
#  95 GLU  HN    107 LEU  QD2     6.00             (#peak 1439 )
 &rst
  ixpk= 1439, nxpk= 0, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1690,1691,1692,
 &end
#
#  95 GLU  HN    112 VAL  QQG     5.36             (#peak    91)
 &rst
  ixpk= 91, nxpk= 0, iat=1485,1757, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,  &end
#
#  95 GLU  HN     95 GLU  HG2     4.02             (#peak    85)
 &rst
  ixpk= 85, nxpk= 0, iat=1485,1492, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  95 GLU  HN     95 GLU  HG3     4.02             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat=1485,1493, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  95 GLU  HN     95 GLU  QB      3.02             (#peak    86)
 &rst
  ixpk= 86, nxpk= 0, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2=1489,1490,
 &end
#
#  95 GLU  HN     95 GLU  QG      3.35             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2=1492,1493,
 &end
#
#  95 GLU  HN     96 ILE  HN      4.77             (#peak   135)
 &rst
  ixpk= 135, nxpk= 0, iat=1485,1500, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#  95 GLU  HN     96 ILE  HA      5.31             (#peak  1236)
 &rst
  ixpk= 1236, nxpk= 0, iat=1485,1502, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  95 GLU  HN     96 ILE  QG2     5.50             (#peak  2853)
 &rst
  ixpk= 2853, nxpk= 0, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1506,1507,1508,
 &end
#
#  95 GLU  HA    111 ASP  HA      6.00             (#peak 1204 )
 &rst
  ixpk= 1204, nxpk= 0, iat=1487,1744, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  95 GLU  HA    112 VAL  HN      5.00             (#peak  1201)
 &rst
  ixpk= 1201, nxpk= 0, iat=1487,1754, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  95 GLU  HA    112 VAL  QQG     3.74             (#peak  1210)
 &rst
  ixpk= 1210, nxpk= 0, iat=1487,1757, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
#  95 GLU  HA     95 GLU  HG2     4.24             (#peak  1223)
 &rst
  ixpk= 1223, nxpk= 0, iat=1487,1492, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  95 GLU  HA     95 GLU  HG3     4.24             (#peak  1224)
 &rst
  ixpk= 1224, nxpk= 0, iat=1487,1493, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  95 GLU  HA     95 GLU  QG      3.71             (#peak  1223)
 &rst
  ixpk= 1223, nxpk= 0, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1492,1493,
 &end
#
#  95 GLU  HA     96 ILE  HN      3.05             (#peak   132)
 &rst
  ixpk= 132, nxpk= 0, iat=1487,1500, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#  95 GLU  HA     96 ILE  HA      5.28             (#peak  1211)
 &rst
  ixpk= 1211, nxpk= 0, iat=1487,1502, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  95 GLU  HA     96 ILE  QD1     4.09             (#peak  1261)
 &rst
  ixpk= 1261, nxpk= 0, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1513,1514,1515,
 &end
#
#  95 GLU  HB2   107 LEU  QD1     5.41             (#peak  1433)
 &rst
  ixpk= 1433, nxpk= 0, iat=1489,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1686,1687,1688,
 &end
#
#  95 GLU  HB2   107 LEU  QD2     5.41             (#peak  1446)
 &rst
  ixpk= 1446, nxpk= 0, iat=1489,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1690,1691,1692,
 &end
#
#  95 GLU  HB3   107 LEU  QD1     5.41             (#peak  1433)
 &rst
  ixpk= 1433, nxpk= 0, iat=1490,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1686,1687,1688,
 &end
#
#  95 GLU  HB3   107 LEU  QD2     5.41             (#peak  1433)
 &rst
  ixpk= 1433, nxpk= 0, iat=1490,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1690,1691,1692,
 &end
#
#  95 GLU  HG2   107 LEU  QD1     5.85             (#peak  1231)
 &rst
  ixpk= 1231, nxpk= 0, iat=1492,  -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
 igr2=1686,1687,1688,
 &end
#
#  95 GLU  HG2   107 LEU  QD2     5.85             (#peak  1443)
 &rst
  ixpk= 1443, nxpk= 0, iat=1492,  -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
 igr2=1690,1691,1692,
 &end
#
#  95 GLU  HG3   107 LEU  QD1     5.85             (#peak  1443)
 &rst
  ixpk= 1443, nxpk= 0, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
 igr2=1686,1687,1688,
 &end
#
#  95 GLU  HG3   107 LEU  QD2     5.85             (#peak  1443)
 &rst
  ixpk= 1443, nxpk= 0, iat=1493,  -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
 igr2=1690,1691,1692,
 &end
#
#  95 GLU  QB    107 LEU  QQD     3.12             (#peak  1433)
 &rst
  ixpk= 1433, nxpk= 0, iat=  -1,1683, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1=1489,1490,
 &end
#
#  95 GLU  QB    110 VAL  HN      4.53             (#peak   230)
 &rst
  ixpk= 230, nxpk= 0, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1489,1490,
 &end
#
#  95 GLU  QB     96 ILE  HN      3.38             (#peak   140)
 &rst
  ixpk= 140, nxpk= 0, iat=  -1,1500, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr1=1489,1490,
 &end
#
#  95 GLU  QB     96 ILE  QD1     4.31             (#peak  1266)
 &rst
  ixpk= 1266, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1489,1490,
 igr2=1513,1514,1515,
 &end
#
#  95 GLU  QG    107 LEU  HG      4.80             (#peak  1420)
 &rst
  ixpk= 1420, nxpk= 0, iat=  -1,1684, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1492,1493,
 &end
#
#  95 GLU  QG    107 LEU  QQD     3.53             (#peak  1443)
 &rst
  ixpk= 1443, nxpk= 0, iat=  -1,1683, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1=1492,1493,
 &end
#
#  95 GLU  QG     96 ILE  HN      3.74             (#peak   139)
 &rst
  ixpk= 139, nxpk= 0, iat=  -1,1500, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1492,1493,
 &end
#
#  96 ILE  HN    107 LEU  HG      5.50             (#peak 142  )
 &rst
  ixpk= 142, nxpk= 0, iat=1500,1684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  96 ILE  HN    107 LEU  QD1     4.47             (#peak   145)
 &rst
  ixpk= 145, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2=1686,1687,1688,
 &end
#
#  96 ILE  HN    107 LEU  QD2     5.00             (#peak  1436)
 &rst
  ixpk= 1436, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1690,1691,1692,
 &end
#
#  96 ILE  HN    107 LEU  QQD     3.45             (#peak   145)
 &rst
  ixpk= 145, nxpk= 0, iat=1500,1683, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,  &end
#
#  96 ILE  HN    108 CYS  HB2     6.00             (#peak 2830 )
 &rst
  ixpk= 2830, nxpk= 0, iat=1500,1700, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  96 ILE  HN    110 VAL  HN      4.41             (#peak   238)
 &rst
  ixpk= 238, nxpk= 0, iat=1500,1726, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  96 ILE  HN    112 VAL  QG2     5.50             (#peak 144  )
 &rst
  ixpk= 144, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1764,1765,1766,
 &end
#
#  96 ILE  HN    112 VAL  QQG     4.75             (#peak  1506)
 &rst
  ixpk= 1506, nxpk= 0, iat=1500,1757, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,  &end
#
#  96 ILE  HN     96 ILE  HB      4.06             (#peak   143)
 &rst
  ixpk= 143, nxpk= 0, iat=1500,1504, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  96 ILE  HN     96 ILE  QD1     2.95             (#peak   149)
 &rst
  ixpk= 149, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=1513,1514,1515,
 &end
#
#  96 ILE  HN     96 ILE  QG2     4.20             (#peak   148)
 &rst
  ixpk= 148, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1506,1507,1508,
 &end
#
#  96 ILE  HN     97 ALA  HN      4.55             (#peak    80)
 &rst
  ixpk= 80, nxpk= 0, iat=1500,1519, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  96 ILE  HN     98 PHE  HD      6.72             (#peak   133)
 &rst
  ixpk= 133, nxpk= 0, iat=1500,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr2=1537,1545,
 &end
#
#  96 ILE  HA    107 LEU  QD1     4.64             (#peak  1242)
 &rst
  ixpk= 1242, nxpk= 0, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=1686,1687,1688,
 &end
#
#  96 ILE  HA    107 LEU  QD2     4.64             (#peak  1442)
 &rst
  ixpk= 1442, nxpk= 0, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=1690,1691,1692,
 &end
#
#  96 ILE  HA     96 ILE  QD1     3.76             (#peak  1262)
 &rst
  ixpk= 1262, nxpk= 0, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2=1513,1514,1515,
 &end
#
#  96 ILE  HA     96 ILE  QG2     3.47             (#peak  2845)
 &rst
  ixpk= 2845, nxpk= 0, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2=1506,1507,1508,
 &end
#
#  96 ILE  HA     97 ALA  HN      3.21             (#peak    75)
 &rst
  ixpk= 75, nxpk= 0, iat=1502,1519, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  96 ILE  HA     97 ALA  QB      4.11             (#peak  1239)
 &rst
  ixpk= 1239, nxpk= 0, iat=1502,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=1523,1524,1525,
 &end
#
#  96 ILE  HB     96 ILE  QD1     3.36             (#peak  1269)
 &rst
  ixpk= 1269, nxpk= 0, iat=1504,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=1513,1514,1515,
 &end
#
#  96 ILE  HB     97 ALA  HN      3.91             (#peak    71)
 &rst
  ixpk= 71, nxpk= 0, iat=1504,1519, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#  96 ILE  QD1   108 CYS  HB2     6.00             (#peak 1265 )
 &rst
  ixpk= 1265, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1   110 VAL  HN      4.48             (#peak   225)
 &rst
  ixpk= 225, nxpk= 0, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1   111 ASP  HN      5.39             (#peak    94)
 &rst
  ixpk= 94, nxpk= 0, iat=  -1,1742, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1   112 VAL  HN      4.39             (#peak  1256)
 &rst
  ixpk= 1256, nxpk= 0, iat=  -1,1754, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1   112 VAL  HA      5.50             (#peak  1263)
 &rst
  ixpk= 1263, nxpk= 0, iat=  -1,1756, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1   112 VAL  QQG     2.86             (#peak  1270)
 &rst
  ixpk= 1270, nxpk= 0, iat=  -1,1757, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1    97 ALA  HN      4.66             (#peak  1258)
 &rst
  ixpk= 1258, nxpk= 0, iat=  -1,1519, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1    98 PHE  HN      5.49             (#peak   307)
 &rst
  ixpk= 307, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1=1513,1514,1515,
 &end
#
#  96 ILE  QD1    98 PHE  HD      5.71             (#peak  1260)
 &rst
  ixpk= 1260, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
 igr1=1513,1514,1515,
 igr2=1537,1545,
 &end
#
#  96 ILE  QG2   129 PHE  HD      7.50             (#peak  2850)
 &rst
  ixpk= 2850, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1=1506,1507,1508,
 igr2=2028,2036,
 &end
#
#  96 ILE  QG2    96 ILE  QD1     3.38             (#peak  1272)
 &rst
  ixpk= 1272, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1=1506,1507,1508,
 igr2=1513,1514,1515,
 &end
#
#  96 ILE  QG2    97 ALA  HN      3.69             (#peak    67)
 &rst
  ixpk= 67, nxpk= 0, iat=  -1,1519, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr1=1506,1507,1508,
 &end
#
#  96 ILE  QG2    98 PHE  HD      5.97             (#peak  2849)
 &rst
  ixpk= 2849, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.05, r4= 8.55,
 igr1=1506,1507,1508,
 igr2=1537,1545,
 &end
#
#  97 ALA  HN    107 LEU  QQD     4.28             (#peak    69)
 &rst
  ixpk= 69, nxpk= 0, iat=1519,1683, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,  &end
#
#  97 ALA  HN     97 ALA  QB      3.19             (#peak    70)
 &rst
  ixpk= 70, nxpk= 0, iat=1519,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2=1523,1524,1525,
 &end
#
#  97 ALA  HN     98 PHE  HN      4.67             (#peak   294)
 &rst
  ixpk= 294, nxpk= 0, iat=1519,1529, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  97 ALA  HN     98 PHE  HD      7.26             (#peak  1628)
 &rst
  ixpk= 1628, nxpk= 0, iat=1519,  -1, r1= 1.30, r2= 1.80, r3= 8.15, r4= 8.65,
 igr2=1537,1545,
 &end
#
#  97 ALA  HA    107 LEU  QD1     4.49             (#peak  1275)
 &rst
  ixpk= 1275, nxpk= 0, iat=1521,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1686,1687,1688,
 &end
#
#  97 ALA  HA    107 LEU  QD2     4.49             (#peak  1440)
 &rst
  ixpk= 1440, nxpk= 0, iat=1521,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2=1690,1691,1692,
 &end
#
#  97 ALA  HA    107 LEU  QQD     3.78             (#peak  1275)
 &rst
  ixpk= 1275, nxpk= 0, iat=1521,1683, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
#  97 ALA  QB    107 LEU  HN      4.00             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat=  -1,1677, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1=1523,1524,1525,
 &end
#
#  97 ALA  QB    107 LEU  HA      2.99             (#peak  1288)
 &rst
  ixpk= 1288, nxpk= 0, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr1=1523,1524,1525,
 &end
#
#  97 ALA  QB    107 LEU  QB      3.45             (#peak  1296)
 &rst
  ixpk= 1296, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1=1523,1524,1525,
 igr2=1681,1682,
 &end
#
#  97 ALA  QB     98 PHE  HN      3.48             (#peak   305)
 &rst
  ixpk= 305, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1=1523,1524,1525,
 &end
#
#  98 PHE  HN    106 PHE  HN      5.00             (#peak 105  )
 &rst
  ixpk= 105, nxpk= 0, iat=1529,1657, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#  98 PHE  HN    107 LEU  HA      3.93             (#peak   301)
 &rst
  ixpk= 301, nxpk= 0, iat=1529,1679, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  98 PHE  HN    107 LEU  QQD     5.00             (#peak   306)
 &rst
  ixpk= 306, nxpk= 0, iat=1529,1683, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,  &end
#
#  98 PHE  HN     98 PHE  HB2     3.54             (#peak   304)
 &rst
  ixpk= 304, nxpk= 0, iat=1529,1533, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  98 PHE  HN     98 PHE  HB3     3.91             (#peak   303)
 &rst
  ixpk= 303, nxpk= 0, iat=1529,1534, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#  98 PHE  HN     98 PHE  HD      5.76             (#peak   297)
 &rst
  ixpk= 297, nxpk= 0, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2=1537,1545,
 &end
#
#  98 PHE  HA     98 PHE  HD      5.44             (#peak  1301)
 &rst
  ixpk= 1301, nxpk= 0, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2=1537,1545,
 &end
#
#  98 PHE  HB2    99 TYR  HN      4.16             (#peak  1160)
 &rst
  ixpk= 1160, nxpk= 0, iat=1533,1549, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  98 PHE  HB3   106 PHE  HN      6.00             (#peak 114  )
 &rst
  ixpk= 114, nxpk= 0, iat=1534,1657, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  98 PHE  HB3    99 TYR  HN      3.79             (#peak  1157)
 &rst
  ixpk= 1157, nxpk= 0, iat=1534,1549, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  98 PHE  HD    108 CYS  HB2     6.76             (#peak  2832)
 &rst
  ixpk= 2832, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
 igr1=1537,1545,
 &end
#
#  98 PHE  HD    108 CYS  HB3     7.50             (#peak  2833)
 &rst
  ixpk= 2833, nxpk= 0, iat=  -1,1701, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr1=1537,1545,
 &end
#
#  98 PHE  HD    108 CYS  QB      6.00             (#peak  2832)
 &rst
  ixpk= 2832, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
 igr1=1537,1545,
 igr2=1700,1701,
 &end
#
#  98 PHE  HD    110 VAL  HN      7.01             (#peak   235)
 &rst
  ixpk= 235, nxpk= 0, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
 igr1=1537,1545,
 &end
#
#  98 PHE  HD    111 ASP  HN      7.50             (#peak   102)
 &rst
  ixpk= 102, nxpk= 0, iat=  -1,1742, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr1=1537,1545,
 &end
#
#  98 PHE  HD    112 VAL  QG2     7.50             (#peak 1511 )
 &rst
  ixpk= 1511, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1=1537,1545,
 igr2=1764,1765,1766,
 &end
#
#  98 PHE  HD    131 VAL  QG1     6.58             (#peak  1935)
 &rst
  ixpk= 1935, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
 igr1=1537,1545,
 igr2=2061,2062,2063,
 &end
#
#  98 PHE  HD    131 VAL  QG2     6.58             (#peak  1951)
 &rst
  ixpk= 1951, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
 igr1=1537,1545,
 igr2=2065,2066,2067,
 &end
#
#  98 PHE  HD    131 VAL  QQG     5.55             (#peak  1935)
 &rst
  ixpk= 1935, nxpk= 0, iat=  -1,2058, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
 igr1=1537,1545,
 &end
#
#  99 TYR  HN     99 TYR  HB3     3.99             (#peak  1159)
 &rst
  ixpk= 1159, nxpk= 0, iat=1549,1554, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  99 TYR  HN     99 TYR  HD      5.61             (#peak  1155)
 &rst
  ixpk= 1155, nxpk= 0, iat=1549,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2=1557,1566,
 &end
#
#  99 TYR  HA    105 CYS  HA      4.11             (#peak  1312)
 &rst
  ixpk= 1312, nxpk= 0, iat=1551,1648, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  99 TYR  HA    106 PHE  HN      4.41             (#peak  1314)
 &rst
  ixpk= 1314, nxpk= 0, iat=1551,1657, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  99 TYR  HA     99 TYR  HD      6.08             (#peak  1311)
 &rst
  ixpk= 1311, nxpk= 0, iat=1551,  -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
 igr2=1557,1566,
 &end
#
#  99 TYR  HB2   100 ARG  HN      4.54             (#peak   811)
 &rst
  ixpk= 811, nxpk= 0, iat=1553,1570, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  99 TYR  HB3   100 ARG  HN      4.54             (#peak   812)
 &rst
  ixpk= 812, nxpk= 0, iat=1554,1570, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  99 TYR  HD    100 ARG  HN      6.09             (#peak   805)
 &rst
  ixpk= 805, nxpk= 0, iat=  -1,1570, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr1=1557,1566,
 &end
#
#  99 TYR  HD    101 LYS  HN      7.12             (#peak   319)
 &rst
  ixpk= 319, nxpk= 0, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
 igr1=1557,1566,
 &end
#
# 100 ARG  HN    100 ARG  HE      5.50             (#peak   807)
 &rst
  ixpk= 807, nxpk= 0, iat=1570,1583, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 LYS  HN    101 LYS  HB2     3.80             (#peak   312)
 &rst
  ixpk= 312, nxpk= 0, iat=1594,1598, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 101 LYS  HN    101 LYS  HB3     3.80             (#peak   309)
 &rst
  ixpk= 309, nxpk= 0, iat=1594,1599, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 101 LYS  HN    101 LYS  QB      3.28             (#peak   312)
 &rst
  ixpk= 312, nxpk= 0, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
 igr2=1598,1599,
 &end
#
# 101 LYS  HN    101 LYS  QD      4.04             (#peak   312)
 &rst
  ixpk= 312, nxpk= 0, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2=1604,1605,
 &end
#
# 101 LYS  HN    102 ASP  HN      3.85             (#peak  1351)
 &rst
  ixpk= 1351, nxpk= 0, iat=1594,1616, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 101 LYS  HN    103 GLY  HN      4.73             (#peak   414)
 &rst
  ixpk= 414, nxpk= 0, iat=1594,1628, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 101 LYS  HN    104 SER  HN      5.50             (#peak  1108)
 &rst
  ixpk= 1108, nxpk= 0, iat=1594,1635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 LYS  HA    101 LYS  HD2     4.61             (#peak  1336)
 &rst
  ixpk= 1336, nxpk= 0, iat=1596,1604, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 101 LYS  HA    101 LYS  HD3     4.61             (#peak  1325)
 &rst
  ixpk= 1325, nxpk= 0, iat=1596,1605, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 101 LYS  HA    101 LYS  HE2     5.50             (#peak 1322 )
 &rst
  ixpk= 1322, nxpk= 0, iat=1596,1607, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 101 LYS  HA    101 LYS  QD      3.81             (#peak  1325)
 &rst
  ixpk= 1325, nxpk= 0, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2=1604,1605,
 &end
#
# 101 LYS  HD2   102 ASP  HA      4.83             (#peak  1337)
 &rst
  ixpk= 1337, nxpk= 0, iat=1604,1618, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 101 LYS  HD3   102 ASP  HA      4.83             (#peak  1335)
 &rst
  ixpk= 1335, nxpk= 0, iat=1605,1618, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
# 101 LYS  QB    101 LYS  QD      3.31             (#peak  1340)
 &rst
  ixpk= 1340, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1=1598,1599,
 igr2=1604,1605,
 &end
#
# 101 LYS  QB    101 LYS  QE      3.92             (#peak  1358)
 &rst
  ixpk= 1358, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1598,1599,
 igr2=1607,1608,
 &end
#
# 101 LYS  QB    102 ASP  HN      4.24             (#peak  1362)
 &rst
  ixpk= 1362, nxpk= 0, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1598,1599,
 &end
#
# 101 LYS  QB    103 GLY  HN      5.34             (#peak   421)
 &rst
  ixpk= 421, nxpk= 0, iat=  -1,1628, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1598,1599,
 &end
#
# 101 LYS  QD    102 ASP  HN      3.35             (#peak  1359)
 &rst
  ixpk= 1359, nxpk= 0, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr1=1604,1605,
 &end
#
# 101 LYS  QD    102 ASP  HA      4.13             (#peak  1335)
 &rst
  ixpk= 1335, nxpk= 0, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1=1604,1605,
 &end
#
# 101 LYS  QD    103 GLY  HN      5.34             (#peak   421)
 &rst
  ixpk= 421, nxpk= 0, iat=  -1,1628, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1604,1605,
 &end
#
# 101 LYS  QE    102 ASP  HA      4.53             (#peak  1360)
 &rst
  ixpk= 1360, nxpk= 0, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1607,1608,
 &end
#
# 102 ASP  HN    102 ASP  HB2     3.66             (#peak  1355)
 &rst
  ixpk= 1355, nxpk= 0, iat=1616,1620, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 102 ASP  HN    102 ASP  HB3     3.66             (#peak  1356)
 &rst
  ixpk= 1356, nxpk= 0, iat=1616,1621, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 102 ASP  HN    102 ASP  QB      3.17             (#peak  1356)
 &rst
  ixpk= 1356, nxpk= 0, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2=1620,1621,
 &end
#
# 102 ASP  HN    103 GLY  HN      3.73             (#peak  1350)
 &rst
  ixpk= 1350, nxpk= 0, iat=1616,1628, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 102 ASP  HN    104 SER  HN      4.54             (#peak  1109)
 &rst
  ixpk= 1109, nxpk= 0, iat=1616,1635, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 103 GLY  HN    104 SER  HN      3.83             (#peak  1107)
 &rst
  ixpk= 1107, nxpk= 0, iat=1628,1635, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 103 GLY  QA    104 SER  HA      4.52             (#peak  1380)
 &rst
  ixpk= 1380, nxpk= 0, iat=  -1,1637, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1=1630,1631,
 &end
#
# 104 SER  HA    105 CYS  HN      3.29             (#peak   610)
 &rst
  ixpk= 610, nxpk= 0, iat=1637,1646, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 105 CYS  HN    105 CYS  QB      3.70             (#peak   613)
 &rst
  ixpk= 613, nxpk= 0, iat=1646,  -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
 igr2=1650,1651,
 &end
#
# 105 CYS  HN    106 PHE  HN      4.98             (#peak  1661)
 &rst
  ixpk= 1661, nxpk= 0, iat=1646,1657, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
# 105 CYS  HN    106 PHE  HD      6.54             (#peak   615)
 &rst
  ixpk= 615, nxpk= 0, iat=1646,  -1, r1= 1.30, r2= 1.80, r3= 7.34, r4= 7.84,
 igr2=1665,1673,
 &end
#
# 105 CYS  HB2   106 PHE  HN      5.50             (#peak  2514)
 &rst
  ixpk= 2514, nxpk= 0, iat=1650,1657, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 105 CYS  HB3   106 PHE  HN      5.50             (#peak  2514)
 &rst
  ixpk= 2514, nxpk= 0, iat=1651,1657, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 106 PHE  HN    106 PHE  HB3     4.06             (#peak   110)
 &rst
  ixpk= 110, nxpk= 0, iat=1657,1662, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
# 106 PHE  HN    106 PHE  HD      5.39             (#peak   107)
 &rst
  ixpk= 107, nxpk= 0, iat=1657,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1665,1673,
 &end
#
# 106 PHE  HN    107 LEU  HN      4.66             (#peak   324)
 &rst
  ixpk= 324, nxpk= 0, iat=1657,1677, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 106 PHE  HA    106 PHE  HD      6.41             (#peak  1387)
 &rst
  ixpk= 1387, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr2=1665,1673,
 &end
#
# 106 PHE  HA    107 LEU  HN      3.33             (#peak   325)
 &rst
  ixpk= 325, nxpk= 0, iat=1659,1677, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
# 106 PHE  HA    107 LEU  QB      4.47             (#peak  1390)
 &rst
  ixpk= 1390, nxpk= 0, iat=1659,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2=1681,1682,
 &end
#
# 106 PHE  HB2   107 LEU  HN      4.00             (#peak   327)
 &rst
  ixpk= 327, nxpk= 0, iat=1661,1677, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 106 PHE  HB2   107 LEU  QB      5.28             (#peak  1397)
 &rst
  ixpk= 1397, nxpk= 0, iat=1661,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2=1681,1682,
 &end
#
# 106 PHE  QB    107 LEU  HB2     6.00             (#peak 1396 )
 &rst
  ixpk= 1396, nxpk= 0, iat=  -1,1681, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr1=1661,1662,
 &end
#
# 106 PHE  HD    107 LEU  HN      6.02             (#peak   322)
 &rst
  ixpk= 322, nxpk= 0, iat=  -1,1677, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr1=1665,1673,
 &end
#
# 106 PHE  HD    108 CYS  HB2     7.00             (#peak  2835)
 &rst
  ixpk= 2835, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1665,1673,
 &end
#
# 106 PHE  HD    108 CYS  HB3     6.62             (#peak  2834)
 &rst
  ixpk= 2834, nxpk= 0, iat=  -1,1701, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
 igr1=1665,1673,
 &end
#
# 106 PHE  HD    131 VAL  HB      6.43             (#peak  1923)
 &rst
  ixpk= 1923, nxpk= 0, iat=  -1,2059, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
 igr1=1665,1673,
 &end
#
# 106 PHE  HD    131 VAL  QG1     7.50             (#peak 1936 )
 &rst
  ixpk= 1936, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.11, r4=10.61,
 igr1=1665,1673,
 igr2=2061,2062,2063,
 &end
#
# 106 PHE  HD    131 VAL  QQG     6.29             (#peak  1950)
 &rst
  ixpk= 1950, nxpk= 0, iat=  -1,2058, r1= 1.30, r2= 1.80, r3= 9.26, r4= 9.76,
 igr1=1665,1673,
 &end
#
# 106 PHE  HD    132 VAL  HN      7.50             (#peak    55)
 &rst
  ixpk= 55, nxpk= 0, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr1=1665,1673,
 &end
#
# 107 LEU  HN    107 LEU  HB2     3.23             (#peak   329)
 &rst
  ixpk= 329, nxpk= 0, iat=1677,1681, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 107 LEU  HN    107 LEU  HB3     3.23             (#peak   330)
 &rst
  ixpk= 330, nxpk= 0, iat=1677,1682, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 107 LEU  HN    107 LEU  HG      4.68             (#peak  1415)
 &rst
  ixpk= 1415, nxpk= 0, iat=1677,1684, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 107 LEU  HN    107 LEU  QB      2.77             (#peak   330)
 &rst
  ixpk= 330, nxpk= 0, iat=1677,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2=1681,1682,
 &end
#
# 107 LEU  HN    107 LEU  QD1     4.57             (#peak   333)
 &rst
  ixpk= 333, nxpk= 0, iat=1677,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2=1686,1687,1688,
 &end
#
# 107 LEU  HN    107 LEU  QD2     4.57             (#peak  1438)
 &rst
  ixpk= 1438, nxpk= 0, iat=1677,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2=1690,1691,1692,
 &end
#
# 107 LEU  HN    107 LEU  QQD     4.01             (#peak   333)
 &rst
  ixpk= 333, nxpk= 0, iat=1677,1683, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,  &end
#
# 107 LEU  HA    107 LEU  HG      4.14             (#peak  1419)
 &rst
  ixpk= 1419, nxpk= 0, iat=1679,1684, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 107 LEU  HA    107 LEU  QD1     4.09             (#peak  1402)
 &rst
  ixpk= 1402, nxpk= 0, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1686,1687,1688,
 &end
#
# 107 LEU  HA    107 LEU  QD2     4.09             (#peak  1441)
 &rst
  ixpk= 1441, nxpk= 0, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1690,1691,1692,
 &end
#
# 107 LEU  HA    107 LEU  QQD     3.26             (#peak  1402)
 &rst
  ixpk= 1402, nxpk= 0, iat=1679,1683, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 107 LEU  HA    131 VAL  QG2     5.50             (#peak 2363 )
 &rst
  ixpk= 2363, nxpk= 0, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2065,2066,2067,
 &end
#
# 107 LEU  HB2   107 LEU  QD1     3.71             (#peak  1434)
 &rst
  ixpk= 1434, nxpk= 0, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1686,1687,1688,
 &end
#
# 107 LEU  HB2   107 LEU  QD2     3.71             (#peak  1445)
 &rst
  ixpk= 1445, nxpk= 0, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1690,1691,1692,
 &end
#
# 107 LEU  HB3   107 LEU  QD1     3.71             (#peak  1413)
 &rst
  ixpk= 1413, nxpk= 0, iat=1682,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1686,1687,1688,
 &end
#
# 107 LEU  HB3   107 LEU  QD2     3.71             (#peak  1447)
 &rst
  ixpk= 1447, nxpk= 0, iat=1682,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2=1690,1691,1692,
 &end
#
# 107 LEU  QB    107 LEU  QQD     2.78             (#peak  1434)
 &rst
  ixpk= 1434, nxpk= 0, iat=  -1,1683, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1=1681,1682,
 &end
#
# 107 LEU  QD1   132 VAL  HN      6.00             (#peak 65   )
 &rst
  ixpk= 65, nxpk= 0, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1686,1687,1688,
 &end
#
# 107 LEU  QQD   110 VAL  HN      4.00             (#peak   226)
 &rst
  ixpk= 226, nxpk= 0, iat=1683,1726, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,  &end
#
# 108 CYS  HB2   110 VAL  HN      5.00             (#peak 231  )
 &rst
  ixpk= 231, nxpk= 0, iat=1700,1726, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 108 CYS  HB2   110 VAL  HN      5.17             (#peak  2828)
 &rst
  ixpk= 2828, nxpk= 0, iat=1700,1726, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 108 CYS  HB2   110 VAL  HA      5.50             (#peak 1453 )
 &rst
  ixpk= 1453, nxpk= 0, iat=1700,1728, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 108 CYS  HB2   132 VAL  QQG     6.00             (#peak 2841 )
 &rst
  ixpk= 2841, nxpk= 0, iat=1700,2074, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,  &end
#
# 108 CYS  HB3   110 VAL  HN      5.00             (#peak 231  )
 &rst
  ixpk= 231, nxpk= 0, iat=1701,1726, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 108 CYS  HB3   110 VAL  HN      5.17             (#peak  2829)
 &rst
  ixpk= 2829, nxpk= 0, iat=1701,1726, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 108 CYS  QB    110 VAL  HN      4.31             (#peak  2829)
 &rst
  ixpk= 2829, nxpk= 0, iat=  -1,1726, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1700,1701,
 &end
#
# 108 CYS  QB    110 VAL  HA      4.90             (#peak  2836)
 &rst
  ixpk= 2836, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1700,1701,
 &end
#
# 108 CYS  QB    132 VAL  QQG     5.28             (#peak  2842)
 &rst
  ixpk= 2842, nxpk= 0, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
 igr1=1700,1701,
 &end
#
# 109 LEU  HA    110 VAL  HN      3.23             (#peak   233)
 &rst
  ixpk= 233, nxpk= 0, iat=1709,1726, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 109 LEU  HB2   132 VAL  QG1     5.93             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat=1711,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2077,2078,2079,
 &end
#
# 109 LEU  HB2   132 VAL  QG2     5.50             (#peak 1965 )
 &rst
  ixpk= 1965, nxpk= 0, iat=1711,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2081,2082,2083,
 &end
#
# 109 LEU  HB2   132 VAL  QG2     5.93             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat=1711,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2081,2082,2083,
 &end
#
# 109 LEU  HB3   110 VAL  HN      5.00             (#peak 228  )
 &rst
  ixpk= 228, nxpk= 0, iat=1712,1726, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 109 LEU  HB3   132 VAL  QG1     5.93             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat=1712,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2077,2078,2079,
 &end
#
# 109 LEU  HB3   132 VAL  QG2     5.93             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat=1712,  -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr2=2081,2082,2083,
 &end
#
# 109 LEU  QB    110 VAL  HA      5.34             (#peak  1456)
 &rst
  ixpk= 1456, nxpk= 0, iat=  -1,1728, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1711,1712,
 &end
#
# 109 LEU  QB    132 VAL  HN      5.00             (#peak    62)
 &rst
  ixpk= 62, nxpk= 0, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1711,1712,
 &end
#
# 109 LEU  QB    132 VAL  QQG     3.52             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1711,1712,
 &end
#
# 109 LEU  QB    133 MET  HN      5.34             (#peak   460)
 &rst
  ixpk= 460, nxpk= 0, iat=  -1,2087, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1=1711,1712,
 &end
#
# 110 VAL  HN    111 ASP  HN      4.76             (#peak  1771)
 &rst
  ixpk= 1771, nxpk= 0, iat=1726,1742, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 110 VAL  HN    132 VAL  QG1     5.50             (#peak 227  )
 &rst
  ixpk= 227, nxpk= 0, iat=1726,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2077,2078,2079,
 &end
#
# 110 VAL  HA    111 ASP  HN      2.94             (#peak   101)
 &rst
  ixpk= 101, nxpk= 0, iat=1728,1742, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 110 VAL  HA    111 ASP  HB2     4.67             (#peak  1455)
 &rst
  ixpk= 1455, nxpk= 0, iat=1728,1746, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 110 VAL  HA    111 ASP  HB3     5.50             (#peak  1456)
 &rst
  ixpk= 1456, nxpk= 0, iat=1728,1747, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 110 VAL  HA    130 GLU  HN      4.54             (#peak   436)
 &rst
  ixpk= 436, nxpk= 0, iat=1728,2040, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 110 VAL  HA    131 VAL  HA      3.87             (#peak  1448)
 &rst
  ixpk= 1448, nxpk= 0, iat=1728,2057, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 110 VAL  HA    131 VAL  HB      6.00             (#peak  1924)
 &rst
  ixpk= 1924, nxpk= 0, iat=1728,2059, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 110 VAL  HA    132 VAL  HN      4.00             (#peak    54)
 &rst
  ixpk= 54, nxpk= 0, iat=1728,2071, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 110 VAL  HA    132 VAL  QQG     3.58             (#peak  1457)
 &rst
  ixpk= 1457, nxpk= 0, iat=1728,2074, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
# 111 ASP  HN    111 ASP  HB2     3.45             (#peak    96)
 &rst
  ixpk= 96, nxpk= 0, iat=1742,1746, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
# 111 ASP  HN    111 ASP  HB3     3.42             (#peak    95)
 &rst
  ixpk= 95, nxpk= 0, iat=1742,1747, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 111 ASP  HN    112 VAL  HN      3.82             (#peak    51)
 &rst
  ixpk= 51, nxpk= 0, iat=1742,1754, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 111 ASP  HN    112 VAL  QG1     6.00             (#peak 1504 )
 &rst
  ixpk= 1504, nxpk= 0, iat=1742,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1760,1761,1762,
 &end
#
# 111 ASP  HN    112 VAL  QG2     6.00             (#peak 93   )
 &rst
  ixpk= 93, nxpk= 0, iat=1742,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1764,1765,1766,
 &end
#
# 111 ASP  HN    112 VAL  QQG     4.74             (#peak   115)
 &rst
  ixpk= 115, nxpk= 0, iat=1742,1757, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,  &end
#
# 111 ASP  HN    113 VAL  HN      6.00             (#peak 161  )
 &rst
  ixpk= 161, nxpk= 0, iat=1742,1770, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 111 ASP  HN    129 PHE  HB3     5.50             (#peak 98   )
 &rst
  ixpk= 98, nxpk= 0, iat=1742,2025, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 111 ASP  HN    130 GLU  HN      3.47             (#peak   103)
 &rst
  ixpk= 103, nxpk= 0, iat=1742,2040, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
# 111 ASP  HN    130 GLU  HB2     5.50             (#peak  1906)
 &rst
  ixpk= 1906, nxpk= 0, iat=1742,2044, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 111 ASP  HN    130 GLU  HB3     5.50             (#peak  1906)
 &rst
  ixpk= 1906, nxpk= 0, iat=1742,2045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 111 ASP  HN    130 GLU  HG2     4.35             (#peak   111)
 &rst
  ixpk= 111, nxpk= 0, iat=1742,2047, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
# 111 ASP  HN    130 GLU  QB      5.50             (#peak 98   )
 &rst
  ixpk= 98, nxpk= 0, iat=1742,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2044,2045,
 &end
#
# 111 ASP  HN    131 VAL  HA      6.00             (#peak   100)
 &rst
  ixpk= 100, nxpk= 0, iat=1742,2057, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 111 ASP  HN    132 VAL  HN      6.00             (#peak 58   )
 &rst
  ixpk= 58, nxpk= 0, iat=1742,2071, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 111 ASP  HN    132 VAL  QQG     4.36             (#peak  1971)
 &rst
  ixpk= 1971, nxpk= 0, iat=1742,2074, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,  &end
#
# 111 ASP  HA    112 VAL  HB      5.50             (#peak  1487)
 &rst
  ixpk= 1487, nxpk= 0, iat=1744,1758, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 111 ASP  HA    112 VAL  QQG     4.26             (#peak  1513)
 &rst
  ixpk= 1513, nxpk= 0, iat=1744,1757, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,  &end
#
# 111 ASP  HB2   112 VAL  HN      4.92             (#peak    42)
 &rst
  ixpk= 42, nxpk= 0, iat=1746,1754, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 111 ASP  HB2   130 GLU  HN      5.30             (#peak  2987)
 &rst
  ixpk= 2987, nxpk= 0, iat=1746,2040, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
# 111 ASP  HB2   130 GLU  HG2     3.81             (#peak  1918)
 &rst
  ixpk= 1918, nxpk= 0, iat=1746,2047, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 111 ASP  HB2   130 GLU  HG3     4.12             (#peak  1917)
 &rst
  ixpk= 1917, nxpk= 0, iat=1746,2048, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
# 111 ASP  HB2   130 GLU  QB      5.50             (#peak 1470 )
 &rst
  ixpk= 1470, nxpk= 0, iat=1746,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2044,2045,
 &end
#
# 111 ASP  HB2   132 VAL  QQG     4.23             (#peak  1476)
 &rst
  ixpk= 1476, nxpk= 0, iat=1746,2074, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,  &end
#
# 111 ASP  HB3   112 VAL  HN      4.50             (#peak    41)
 &rst
  ixpk= 41, nxpk= 0, iat=1747,1754, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 111 ASP  HB3   113 VAL  HN      5.27             (#peak   153)
 &rst
  ixpk= 153, nxpk= 0, iat=1747,1770, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 111 ASP  HB3   130 GLU  HN      4.79             (#peak   450)
 &rst
  ixpk= 450, nxpk= 0, iat=1747,2040, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 111 ASP  HB3   130 GLU  HG2     4.34             (#peak  1916)
 &rst
  ixpk= 1916, nxpk= 0, iat=1747,2047, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 111 ASP  HB3   130 GLU  HG3     4.33             (#peak  1915)
 &rst
  ixpk= 1915, nxpk= 0, iat=1747,2048, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 111 ASP  HB3   130 GLU  QB      5.50             (#peak 1471 )
 &rst
  ixpk= 1471, nxpk= 0, iat=1747,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2044,2045,
 &end
#
# 111 ASP  HB3   132 VAL  QG1     5.50             (#peak 1472 )
 &rst
  ixpk= 1472, nxpk= 0, iat=1747,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2077,2078,2079,
 &end
#
# 112 VAL  HN    112 VAL  HB      3.18             (#peak    44)
 &rst
  ixpk= 44, nxpk= 0, iat=1754,1758, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 112 VAL  HN    112 VAL  QG1     3.83             (#peak    38)
 &rst
  ixpk= 38, nxpk= 0, iat=1754,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1760,1761,1762,
 &end
#
# 112 VAL  HN    112 VAL  QG2     3.83             (#peak    40)
 &rst
  ixpk= 40, nxpk= 0, iat=1754,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1764,1765,1766,
 &end
#
# 112 VAL  HN    112 VAL  QQG     2.94             (#peak    40)
 &rst
  ixpk= 40, nxpk= 0, iat=1754,1757, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
# 112 VAL  HN    113 VAL  HN      4.54             (#peak   162)
 &rst
  ixpk= 162, nxpk= 0, iat=1754,1770, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 112 VAL  HN    130 GLU  HN      6.00             (#peak 451  )
 &rst
  ixpk= 451, nxpk= 0, iat=1754,2040, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 112 VAL  HA    112 VAL  QG1     3.37             (#peak  1490)
 &rst
  ixpk= 1490, nxpk= 0, iat=1756,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1760,1761,1762,
 &end
#
# 112 VAL  HA    112 VAL  QG2     3.37             (#peak  1481)
 &rst
  ixpk= 1481, nxpk= 0, iat=1756,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1764,1765,1766,
 &end
#
# 112 VAL  HA    112 VAL  QQG     2.95             (#peak  1481)
 &rst
  ixpk= 1481, nxpk= 0, iat=1756,1757, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 112 VAL  HA    113 VAL  HN      3.02             (#peak   158)
 &rst
  ixpk= 158, nxpk= 0, iat=1756,1770, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
# 112 VAL  HA    128 ASN  HN      4.73             (#peak   678)
 &rst
  ixpk= 678, nxpk= 0, iat=1756,2006, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 112 VAL  HA    130 GLU  HN      5.50             (#peak   437)
 &rst
  ixpk= 437, nxpk= 0, iat=1756,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 112 VAL  HB    113 VAL  HN      4.61             (#peak   155)
 &rst
  ixpk= 155, nxpk= 0, iat=1758,1770, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 112 VAL  HB    127 LEU  QQD     5.16             (#peak  1858)
 &rst
  ixpk= 1858, nxpk= 0, iat=1758,1993, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,  &end
#
# 112 VAL  QG1   113 VAL  HN      4.55             (#peak   151)
 &rst
  ixpk= 151, nxpk= 0, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1760,1761,1762,
 &end
#
# 112 VAL  QG1   129 PHE  HA      4.73             (#peak  1496)
 &rst
  ixpk= 1496, nxpk= 0, iat=  -1,2022, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1=1760,1761,1762,
 &end
#
# 112 VAL  QG2   113 VAL  HN      4.55             (#peak  1508)
 &rst
  ixpk= 1508, nxpk= 0, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1764,1765,1766,
 &end
#
# 112 VAL  QG2   129 PHE  HA      4.73             (#peak  1512)
 &rst
  ixpk= 1512, nxpk= 0, iat=  -1,2022, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1=1764,1765,1766,
 &end
#
# 112 VAL  QG2   130 GLU  HG3     5.50             (#peak 1914 )
 &rst
  ixpk= 1914, nxpk= 0, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1764,1765,1766,
 &end
#
# 112 VAL  QQG   113 VAL  HN      3.42             (#peak   151)
 &rst
  ixpk= 151, nxpk= 0, iat=1757,1770, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,  &end
#
# 112 VAL  QQG   113 VAL  HA      4.46             (#peak  1497)
 &rst
  ixpk= 1497, nxpk= 0, iat=1757,1772, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,  &end
#
# 112 VAL  QQG   127 LEU  HA      4.32             (#peak  1498)
 &rst
  ixpk= 1498, nxpk= 0, iat=1757,1989, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,  &end
#
# 112 VAL  QQG   127 LEU  HG      4.20             (#peak  1492)
 &rst
  ixpk= 1492, nxpk= 0, iat=1757,1994, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,  &end
#
# 112 VAL  QQG   127 LEU  QQD     3.04             (#peak  1859)
 &rst
  ixpk= 1859, nxpk= 0, iat=1757,1993, r1= 1.30, r2= 1.80, r3= 7.44, r4= 7.94,  &end
#
# 112 VAL  QQG   128 ASN  HN      4.32             (#peak  1500)
 &rst
  ixpk= 1500, nxpk= 0, iat=1757,2006, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,  &end
#
# 112 VAL  QQG   129 PHE  HD      5.96             (#peak  1509)
 &rst
  ixpk= 1509, nxpk= 0, iat=1757,  -1, r1= 1.30, r2= 1.80, r3= 8.89, r4= 9.39,
 igr2=2028,2036,
 &end
#
# 113 VAL  HN    127 LEU  QQD     3.71             (#peak   117)
 &rst
  ixpk= 117, nxpk= 0, iat=1770,1993, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
# 113 VAL  HN    128 ASN  HN      3.61             (#peak   160)
 &rst
  ixpk= 160, nxpk= 0, iat=1770,2006, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
# 113 VAL  HN    128 ASN  HB2     4.21             (#peak   157)
 &rst
  ixpk= 157, nxpk= 0, iat=1770,2010, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 113 VAL  HN    129 PHE  HA      6.00             (#peak  1885)
 &rst
  ixpk= 1885, nxpk= 0, iat=1770,2022, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 113 VAL  HN    130 GLU  HN      6.00             (#peak   441)
 &rst
  ixpk= 441, nxpk= 0, iat=1770,2040, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 113 VAL  HA    127 LEU  QD2     6.00             (#peak 1872 )
 &rst
  ixpk= 1872, nxpk= 0, iat=1772,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=2000,2001,2002,
 &end
#
# 113 VAL  HA    127 LEU  QQD     4.09             (#peak  1530)
 &rst
  ixpk= 1530, nxpk= 0, iat=1772,1993, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,  &end
#
# 114 PRO  HA    115 VAL  HN      3.07             (#peak   288)
 &rst
  ixpk= 288, nxpk= 0, iat=1796,1800, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 114 PRO  HA    122 VAL  QQG     4.66             (#peak  1543)
 &rst
  ixpk= 1543, nxpk= 0, iat=1796,1899, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,  &end
#
# 114 PRO  HA    125 PHE  HA      4.42             (#peak  1536)
 &rst
  ixpk= 1536, nxpk= 0, iat=1796,1950, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 114 PRO  HA    125 PHE  HD      6.27             (#peak  1535)
 &rst
  ixpk= 1535, nxpk= 0, iat=1796,  -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr2=1956,1964,
 &end
#
# 114 PRO  HA    126 ILE  HN      4.43             (#peak  1532)
 &rst
  ixpk= 1532, nxpk= 0, iat=1796,1968, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
# 114 PRO  HA    127 LEU  HA      4.45             (#peak  1537)
 &rst
  ixpk= 1537, nxpk= 0, iat=1796,1989, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 114 PRO  HA    127 LEU  HG      4.50             (#peak  1539)
 &rst
  ixpk= 1539, nxpk= 0, iat=1796,1994, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 114 PRO  HA    127 LEU  QD1     4.30             (#peak  1541)
 &rst
  ixpk= 1541, nxpk= 0, iat=1796,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=1996,1997,1998,
 &end
#
# 114 PRO  HA    127 LEU  QD2     4.30             (#peak  1874)
 &rst
  ixpk= 1874, nxpk= 0, iat=1796,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=2000,2001,2002,
 &end
#
# 114 PRO  HA    127 LEU  QQD     3.35             (#peak  1541)
 &rst
  ixpk= 1541, nxpk= 0, iat=1796,1993, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 114 PRO  HA    128 ASN  HN      5.50             (#peak   679)
 &rst
  ixpk= 679, nxpk= 0, iat=1796,2006, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 114 PRO  HD2   127 LEU  QD1     6.63             (#peak  2711)
 &rst
  ixpk= 2711, nxpk= 0, iat=1787,  -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
 igr2=1996,1997,1998,
 &end
#
# 114 PRO  HD2   127 LEU  QD2     6.63             (#peak  2710)
 &rst
  ixpk= 2710, nxpk= 0, iat=1787,  -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
 igr2=2000,2001,2002,
 &end
#
# 114 PRO  HD3   122 VAL  QG1     6.00             (#peak 2702 )
 &rst
  ixpk= 2702, nxpk= 0, iat=1788,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=1902,1903,1904,
 &end
#
# 114 PRO  HD3   127 LEU  QD1     6.63             (#peak  2711)
 &rst
  ixpk= 2711, nxpk= 0, iat=1788,  -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
 igr2=1996,1997,1998,
 &end
#
# 114 PRO  HD3   127 LEU  QD2     6.63             (#peak  2711)
 &rst
  ixpk= 2711, nxpk= 0, iat=1788,  -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
 igr2=2000,2001,2002,
 &end
#
# 114 PRO  HG2   115 VAL  HN      4.05             (#peak   284)
 &rst
  ixpk= 284, nxpk= 0, iat=1790,1800, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 114 PRO  HG2   122 VAL  QQG     4.03             (#peak  1692)
 &rst
  ixpk= 1692, nxpk= 0, iat=1790,1899, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,  &end
#
# 114 PRO  HG2   125 PHE  HD      7.50             (#peak  2592)
 &rst
  ixpk= 2592, nxpk= 0, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 8.42, r4= 8.92,
 igr2=1956,1964,
 &end
#
# 114 PRO  HG3   115 VAL  HN      4.97             (#peak   285)
 &rst
  ixpk= 285, nxpk= 0, iat=1791,1800, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
# 114 PRO  HG3   127 LEU  QQD     5.40             (#peak  1858)
 &rst
  ixpk= 1858, nxpk= 0, iat=1791,1993, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,  &end
#
# 114 PRO  QB    115 VAL  HN      3.76             (#peak   286)
 &rst
  ixpk= 286, nxpk= 0, iat=  -1,1800, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr1=1793,1794,
 &end
#
# 114 PRO  QB    122 VAL  QQG     3.61             (#peak  1690)
 &rst
  ixpk= 1690, nxpk= 0, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1=1793,1794,
 &end
#
# 114 PRO  QB    127 LEU  HG      3.92             (#peak  1548)
 &rst
  ixpk= 1548, nxpk= 0, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1793,1794,
 &end
#
# 114 PRO  QD    127 LEU  QQD     4.21             (#peak  2711)
 &rst
  ixpk= 2711, nxpk= 0, iat=  -1,1993, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1787,1788,
 &end
#
# 115 VAL  HN    115 VAL  HB      3.99             (#peak   283)
 &rst
  ixpk= 283, nxpk= 0, iat=1800,1804, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 115 VAL  HN    115 VAL  QG1     4.10             (#peak   278)
 &rst
  ixpk= 278, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1806,1807,1808,
 &end
#
# 115 VAL  HN    115 VAL  QG2     4.10             (#peak   278)
 &rst
  ixpk= 278, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1810,1811,1812,
 &end
#
# 115 VAL  HN    115 VAL  QQG     3.39             (#peak   278)
 &rst
  ixpk= 278, nxpk= 0, iat=1800,1803, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
# 115 VAL  HN    116 LYS  HN      4.63             (#peak   292)
 &rst
  ixpk= 292, nxpk= 0, iat=1800,1816, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
# 115 VAL  HN    122 VAL  HA      5.44             (#peak  1661)
 &rst
  ixpk= 1661, nxpk= 0, iat=1800,1898, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,  &end
#
# 115 VAL  HN    122 VAL  HB      5.50             (#peak   285)
 &rst
  ixpk= 285, nxpk= 0, iat=1800,1900, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 VAL  HN    122 VAL  QG1     5.50             (#peak 279  )
 &rst
  ixpk= 279, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1902,1903,1904,
 &end
#
# 115 VAL  HN    122 VAL  QQG     3.48             (#peak   277)
 &rst
  ixpk= 277, nxpk= 0, iat=1800,1899, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
# 115 VAL  HN    123 ILE  QD1     5.18             (#peak   280)
 &rst
  ixpk= 280, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2=1925,1926,1927,
 &end
#
# 115 VAL  HN    124 MET  HN      5.50             (#peak 291  )
 &rst
  ixpk= 291, nxpk= 0, iat=1800,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 VAL  HN    125 PHE  HA      4.01             (#peak   289)
 &rst
  ixpk= 289, nxpk= 0, iat=1800,1950, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
# 115 VAL  HN    125 PHE  HD      6.24             (#peak   290)
 &rst
  ixpk= 290, nxpk= 0, iat=1800,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr2=1956,1964,
 &end
#
# 115 VAL  HN    126 ILE  HN      4.33             (#peak   558)
 &rst
  ixpk= 558, nxpk= 0, iat=1800,1968, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 115 VAL  HA    116 LYS  HN      2.69             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat=1802,1816, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,  &end
#
# 115 VAL  HA    116 LYS  QB      5.34             (#peak  1549)
 &rst
  ixpk= 1549, nxpk= 0, iat=1802,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1820,1821,
 &end
#
# 115 VAL  HA    126 ILE  QD1     5.50             (#peak  1834)
 &rst
  ixpk= 1834, nxpk= 0, iat=1802,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1981,1982,1983,
 &end
#
# 115 VAL  HB    116 LYS  HN      4.40             (#peak   187)
 &rst
  ixpk= 187, nxpk= 0, iat=1804,1816, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
# 115 VAL  HB    124 MET  HN      5.12             (#peak   748)
 &rst
  ixpk= 748, nxpk= 0, iat=1804,1931, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 115 VAL  HB    124 MET  HN      5.50             (#peak 747  )
 &rst
  ixpk= 747, nxpk= 0, iat=1804,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 115 VAL  QG1   116 LYS  HN      4.30             (#peak  1556)
 &rst
  ixpk= 1556, nxpk= 0, iat=  -1,1816, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1806,1807,1808,
 &end
#
# 115 VAL  QG1   126 ILE  HN      4.37             (#peak  1557)
 &rst
  ixpk= 1557, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=1806,1807,1808,
 &end
#
# 115 VAL  QG1   126 ILE  QD1     3.38             (#peak  1840)
 &rst
  ixpk= 1840, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1=1806,1807,1808,
 igr2=1981,1982,1983,
 &end
#
# 115 VAL  QG2   116 LYS  HN      4.30             (#peak  1556)
 &rst
  ixpk= 1556, nxpk= 0, iat=  -1,1816, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1810,1811,1812,
 &end
#
# 115 VAL  QG2   126 ILE  HN      4.37             (#peak  1557)
 &rst
  ixpk= 1557, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1=1810,1811,1812,
 &end
#
# 115 VAL  QG2   126 ILE  QD1     3.38             (#peak  1840)
 &rst
  ixpk= 1840, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1=1810,1811,1812,
 igr2=1981,1982,1983,
 &end
#
# 115 VAL  QQG   116 LYS  HN      3.59             (#peak  1556)
 &rst
  ixpk= 1556, nxpk= 0, iat=1803,1816, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,  &end
#
# 115 VAL  QQG   123 ILE  HG12    4.13             (#peak  1712)
 &rst
  ixpk= 1712, nxpk= 0, iat=1803,1922, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,  &end
#
# 115 VAL  QQG   124 MET  HN      3.95             (#peak   756)
 &rst
  ixpk= 756, nxpk= 0, iat=1803,1931, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 115 VAL  QQG   124 MET  QB      3.18             (#peak  1564)
 &rst
  ixpk= 1564, nxpk= 0, iat=1803,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2=1935,1936,
 &end
#
# 115 VAL  QQG   124 MET  QG      4.22             (#peak  2685)
 &rst
  ixpk= 2685, nxpk= 0, iat=1803,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2=1938,1939,
 &end
#
# 115 VAL  QQG   125 PHE  HN      4.08             (#peak  1298)
 &rst
  ixpk= 1298, nxpk= 0, iat=1803,1948, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,  &end
#
# 115 VAL  QQG   125 PHE  HA      3.46             (#peak  1562)
 &rst
  ixpk= 1562, nxpk= 0, iat=1803,1950, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
# 115 VAL  QQG   126 ILE  HN      3.61             (#peak  1557)
 &rst
  ixpk= 1557, nxpk= 0, iat=1803,1968, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
# 115 VAL  QQG   126 ILE  HB      3.81             (#peak  1802)
 &rst
  ixpk= 1802, nxpk= 0, iat=1803,1972, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,  &end
#
# 115 VAL  QQG   126 ILE  QD1     2.83             (#peak  1840)
 &rst
  ixpk= 1840, nxpk= 0, iat=1803,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=1981,1982,1983,
 &end
#
# 115 VAL  QQG   126 ILE  QG2     3.29             (#peak  1813)
 &rst
  ixpk= 1813, nxpk= 0, iat=1803,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2=1974,1975,1976,
 &end
#
# 115 VAL  QQG   128 ASN  QD2     5.00             (#peak  1559)
 &rst
  ixpk= 1559, nxpk= 0, iat=1803,  -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
 igr2=2015,2016,
 &end
#
# 116 LYS  HN    116 LYS  HG2     4.50             (#peak  1575)
 &rst
  ixpk= 1575, nxpk= 0, iat=1816,1823, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS  HN    116 LYS  HG3     4.50             (#peak  1576)
 &rst
  ixpk= 1576, nxpk= 0, iat=1816,1824, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 116 LYS  HN    116 LYS  QB      3.67             (#peak   186)
 &rst
  ixpk= 186, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2=1820,1821,
 &end
#
# 116 LYS  HN    116 LYS  QG      3.90             (#peak  1575)
 &rst
  ixpk= 1575, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2=1823,1824,
 &end
#
# 116 LYS  HN    117 ASN  HN      4.44             (#peak  1091)
 &rst
  ixpk= 1091, nxpk= 0, iat=1816,1838, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 116 LYS  HN    122 VAL  HA      4.62             (#peak  1664)
 &rst
  ixpk= 1664, nxpk= 0, iat=1816,1898, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 116 LYS  HN    122 VAL  QQG     5.15             (#peak   181)
 &rst
  ixpk= 181, nxpk= 0, iat=1816,1899, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,  &end
#
# 116 LYS  HN    123 ILE  QG2     5.50             (#peak 1279 )
 &rst
  ixpk= 1279, nxpk= 0, iat=1816,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1918,1919,1920,
 &end
#
# 116 LYS  HN    124 MET  HN      5.50             (#peak   192)
 &rst
  ixpk= 192, nxpk= 0, iat=1816,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS  HN    124 MET  HN      5.50             (#peak 736  )
 &rst
  ixpk= 736, nxpk= 0, iat=1816,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS  HA    117 ASN  HN      2.98             (#peak  1097)
 &rst
  ixpk= 1097, nxpk= 0, iat=1818,1838, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
# 116 LYS  HA    122 VAL  HA      3.73             (#peak  1212)
 &rst
  ixpk= 1212, nxpk= 0, iat=1818,1898, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 116 LYS  HA    122 VAL  QG1     5.00             (#peak  1682)
 &rst
  ixpk= 1682, nxpk= 0, iat=1818,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1902,1903,1904,
 &end
#
# 116 LYS  HA    122 VAL  QG2     5.00             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=1818,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1906,1907,1908,
 &end
#
# 116 LYS  HA    122 VAL  QQG     4.04             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=1818,1899, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,  &end
#
# 116 LYS  HA    123 ILE  QD1     4.64             (#peak  1727)
 &rst
  ixpk= 1727, nxpk= 0, iat=1818,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=1925,1926,1927,
 &end
#
# 116 LYS  HA    123 ILE  QG2     4.24             (#peak  1286)
 &rst
  ixpk= 1286, nxpk= 0, iat=1818,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2=1918,1919,1920,
 &end
#
# 116 LYS  HB2   121 ALA  HA      5.50             (#peak  1643)
 &rst
  ixpk= 1643, nxpk= 0, iat=1820,1888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS  HB2   122 VAL  HA      5.42             (#peak  1667)
 &rst
  ixpk= 1667, nxpk= 0, iat=1820,1898, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 116 LYS  HB3   121 ALA  HA      5.50             (#peak  1643)
 &rst
  ixpk= 1643, nxpk= 0, iat=1821,1888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 116 LYS  HB3   122 VAL  HA      5.42             (#peak  1667)
 &rst
  ixpk= 1667, nxpk= 0, iat=1821,1898, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 116 LYS  HG2   117 ASN  HN      4.39             (#peak  1102)
 &rst
  ixpk= 1102, nxpk= 0, iat=1823,1838, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 116 LYS  HG3   117 ASN  HN      4.39             (#peak  1104)
 &rst
  ixpk= 1104, nxpk= 0, iat=1824,1838, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 116 LYS  QB    117 ASN  HN      3.48             (#peak  1101)
 &rst
  ixpk= 1101, nxpk= 0, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1=1820,1821,
 &end
#
# 116 LYS  QB    119 ASP  HN      5.50     (#peak 1209 )
 &rst
  ixpk= 1209, nxpk= 0, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1820,1821,
 &end
#
# 116 LYS  QB    120 GLY  HN      3.55             (#peak  1618)
 &rst
  ixpk= 1618, nxpk= 0, iat=  -1,1879, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1=1820,1821,
 &end
#
# 116 LYS  QB    120 GLY  QA      3.85             (#peak  1639)
 &rst
  ixpk= 1639, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1=1820,1821,
 igr2=1881,1882,
 &end
#
# 116 LYS  QB    121 ALA  HN      4.81             (#peak   356)
 &rst
  ixpk= 356, nxpk= 0, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1820,1821,
 &end
#
# 116 LYS  QB    122 VAL  HA      4.56             (#peak  1667)
 &rst
  ixpk= 1667, nxpk= 0, iat=  -1,1898, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=1820,1821,
 &end
#
# 116 LYS  QG    117 ASN  HN      3.86             (#peak  1104)
 &rst
  ixpk= 1104, nxpk= 0, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr1=1823,1824,
 &end
#
# 116 LYS  QG    121 ALA  HN      4.82             (#peak   358)
 &rst
  ixpk= 358, nxpk= 0, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1=1823,1824,
 &end
#
# 116 LYS  QG    122 VAL  HN      5.00             (#peak   570)
 &rst
  ixpk= 570, nxpk= 0, iat=  -1,1896, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1=1823,1824,
 &end
#
# 116 LYS  QG    122 VAL  HA      4.69             (#peak  1713)
 &rst
  ixpk= 1713, nxpk= 0, iat=  -1,1898, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=1823,1824,
 &end
#
# 117 ASN  HN    117 ASN  HB3     3.88             (#peak  1100)
 &rst
  ixpk= 1100, nxpk= 0, iat=1838,1843, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
# 117 ASN  HN    117 ASN  QD2     4.62             (#peak  1095)
 &rst
  ixpk= 1095, nxpk= 0, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2=1847,1848,
 &end
#
# 117 ASN  HN    118 GLU  HN      4.71             (#peak   950)
 &rst
  ixpk= 950, nxpk= 0, iat=1838,1852, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
# 117 ASN  HN    119 ASP  HN      4.69             (#peak  1197)
 &rst
  ixpk= 1197, nxpk= 0, iat=1838,1867, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 117 ASN  HN    120 GLY  HN      4.64             (#peak  1619)
 &rst
  ixpk= 1619, nxpk= 0, iat=1838,1879, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 117 ASN  HN    121 ALA  HN      3.65             (#peak   349)
 &rst
  ixpk= 349, nxpk= 0, iat=1838,1886, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 117 ASN  HN    121 ALA  QB      4.20             (#peak  1650)
 &rst
  ixpk= 1650, nxpk= 0, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1890,1891,1892,
 &end
#
# 117 ASN  HN    122 VAL  HA      4.03             (#peak  1098)
 &rst
  ixpk= 1098, nxpk= 0, iat=1838,1898, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 117 ASN  HN    123 ILE  QD1     4.22             (#peak  1106)
 &rst
  ixpk= 1106, nxpk= 0, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=1925,1926,1927,
 &end
#
# 117 ASN  HN    123 ILE  QG2     3.47             (#peak  1105)
 &rst
  ixpk= 1105, nxpk= 0, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2=1918,1919,1920,
 &end
#
# 117 ASN  HA    118 GLU  HA      4.49             (#peak   236)
 &rst
  ixpk= 236, nxpk= 0, iat=1840,1854, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 117 ASN  HA    118 GLU  QB      4.88             (#peak  1594)
 &rst
  ixpk= 1594, nxpk= 0, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2=1856,1857,
 &end
#
# 117 ASN  HA    123 ILE  QD1     4.11             (#peak  1726)
 &rst
  ixpk= 1726, nxpk= 0, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=1925,1926,1927,
 &end
#
# 117 ASN  HB2   118 GLU  HN      3.23             (#peak   946)
 &rst
  ixpk= 946, nxpk= 0, iat=1842,1852, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 117 ASN  HB2   118 GLU  HA      5.50             (#peak   237)
 &rst
  ixpk= 237, nxpk= 0, iat=1842,1854, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 117 ASN  HB2   119 ASP  HN      4.59             (#peak  1201)
 &rst
  ixpk= 1201, nxpk= 0, iat=1842,1867, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
# 117 ASN  HB2   123 ILE  QD1     4.31             (#peak  1723)
 &rst
  ixpk= 1723, nxpk= 0, iat=1842,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1925,1926,1927,
 &end
#
# 117 ASN  HB2   123 ILE  QG2     4.10             (#peak  1291)
 &rst
  ixpk= 1291, nxpk= 0, iat=1842,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1918,1919,1920,
 &end
#
# 117 ASN  HB3   117 ASN  HD21    3.86             (#peak  1422)
 &rst
  ixpk= 1422, nxpk= 0, iat=1843,1847, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 117 ASN  HB3   117 ASN  HD22    3.86             (#peak  1442)
 &rst
  ixpk= 1442, nxpk= 0, iat=1843,1848, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 117 ASN  HB3   117 ASN  QD2     3.39             (#peak  1442)
 &rst
  ixpk= 1442, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1847,1848,
 &end
#
# 117 ASN  HB3   118 GLU  HN      4.20             (#peak  1603)
 &rst
  ixpk= 1603, nxpk= 0, iat=1843,1852, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 117 ASN  HB3   123 ILE  QD1     3.55             (#peak  1722)
 &rst
  ixpk= 1722, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2=1925,1926,1927,
 &end
#
# 117 ASN  HB3   123 ILE  QG2     3.67             (#peak  1293)
 &rst
  ixpk= 1293, nxpk= 0, iat=1843,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1918,1919,1920,
 &end
#
# 117 ASN  HD21  121 ALA  HN      4.32             (#peak   351)
 &rst
  ixpk= 351, nxpk= 0, iat=1847,1886, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 117 ASN  HD21  121 ALA  QB      3.52             (#peak  1426)
 &rst
  ixpk= 1426, nxpk= 0, iat=1847,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2=1890,1891,1892,
 &end
#
# 117 ASN  HD21  123 ILE  QG2     3.73             (#peak  1283)
 &rst
  ixpk= 1283, nxpk= 0, iat=1847,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=1918,1919,1920,
 &end
#
# 117 ASN  HD22  121 ALA  HN      4.32             (#peak   348)
 &rst
  ixpk= 348, nxpk= 0, iat=1848,1886, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
# 117 ASN  HD22  121 ALA  QB      3.52             (#peak  1654)
 &rst
  ixpk= 1654, nxpk= 0, iat=1848,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2=1890,1891,1892,
 &end
#
# 117 ASN  HD22  123 ILE  QG2     3.73             (#peak  1755)
 &rst
  ixpk= 1755, nxpk= 0, iat=1848,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=1918,1919,1920,
 &end
#
# 117 ASN  QD2   118 GLU  HN      5.05             (#peak   949)
 &rst
  ixpk= 949, nxpk= 0, iat=  -1,1852, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1847,1848,
 &end
#
# 117 ASN  QD2   119 ASP  HN      4.13             (#peak  1194)
 &rst
  ixpk= 1194, nxpk= 0, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1=1847,1848,
 &end
#
# 117 ASN  QD2   121 ALA  HN      3.78             (#peak   348)
 &rst
  ixpk= 348, nxpk= 0, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1847,1848,
 &end
#
# 117 ASN  QD2   121 ALA  QB      3.06             (#peak  1654)
 &rst
  ixpk= 1654, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1=1847,1848,
 igr2=1890,1891,1892,
 &end
#
# 117 ASN  QD2   123 ILE  HN      4.67             (#peak  1764)
 &rst
  ixpk= 1764, nxpk= 0, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1847,1848,
 &end
#
# 117 ASN  QD2   123 ILE  QD1     4.33             (#peak  1728)
 &rst
  ixpk= 1728, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1=1847,1848,
 igr2=1925,1926,1927,
 &end
#
# 118 GLU  HN    118 GLU  HB2     3.73             (#peak   954)
 &rst
  ixpk= 954, nxpk= 0, iat=1852,1856, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 118 GLU  HN    118 GLU  HB3     3.73             (#peak   952)
 &rst
  ixpk= 952, nxpk= 0, iat=1852,1857, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
# 118 GLU  HN    118 GLU  HG2     3.56             (#peak   947)
 &rst
  ixpk= 947, nxpk= 0, iat=1852,1859, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 118 GLU  HN    118 GLU  HG3     3.56             (#peak   951)
 &rst
  ixpk= 951, nxpk= 0, iat=1852,1860, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
# 118 GLU  HN    118 GLU  QB      3.10             (#peak   954)
 &rst
  ixpk= 954, nxpk= 0, iat=1852,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2=1856,1857,
 &end
#
# 118 GLU  HN    118 GLU  QG      3.06             (#peak   951)
 &rst
  ixpk= 951, nxpk= 0, iat=1852,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr2=1859,1860,
 &end
#
# 118 GLU  HN    119 ASP  HN      3.36             (#peak  1195)
 &rst
  ixpk= 1195, nxpk= 0, iat=1852,1867, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
# 118 GLU  HN    120 GLY  HN      4.52             (#peak  1620)
 &rst
  ixpk= 1620, nxpk= 0, iat=1852,1879, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
# 118 GLU  HN    123 ILE  QD1     5.49             (#peak   953)
 &rst
  ixpk= 953, nxpk= 0, iat=1852,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2=1925,1926,1927,
 &end
#
# 118 GLU  HA    118 GLU  HG2     3.94             (#peak  1615)
 &rst
  ixpk= 1615, nxpk= 0, iat=1854,1859, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 118 GLU  HA    118 GLU  HG3     3.94             (#peak  1611)
 &rst
  ixpk= 1611, nxpk= 0, iat=1854,1860, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 118 GLU  HA    120 GLY  HN      4.04             (#peak   408)
 &rst
  ixpk= 408, nxpk= 0, iat=1854,1879, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
# 118 GLU  HB2   119 ASP  HN      4.33             (#peak  1208)
 &rst
  ixpk= 1208, nxpk= 0, iat=1856,1867, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 118 GLU  HB3   119 ASP  HN      4.33             (#peak  1207)
 &rst
  ixpk= 1207, nxpk= 0, iat=1857,1867, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
# 118 GLU  QB    119 ASP  HN      3.77             (#peak  1207)
 &rst
  ixpk= 1207, nxpk= 0, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=1856,1857,
 &end
#
# 118 GLU  QG    119 ASP  HN      3.48             (#peak  1206)
 &rst
  ixpk= 1206, nxpk= 0, iat=  -1,1867, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1=1859,1860,
 &end
#
# 119 ASP  HN    119 ASP  HB2     3.34             (#peak  1203)
 &rst
  ixpk= 1203, nxpk= 0, iat=1867,1871, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 119 ASP  HN    119 ASP  HB3     3.34             (#peak  1205)
 &rst
  ixpk= 1205, nxpk= 0, iat=1867,1872, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
# 119 ASP  HN    119 ASP  QB      2.85             (#peak  1205)
 &rst
  ixpk= 1205, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
 igr2=1871,1872,
 &end
#
# 119 ASP  HN    120 GLY  HN      2.94             (#peak  1192)
 &rst
  ixpk= 1192, nxpk= 0, iat=1867,1879, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
# 119 ASP  HN    120 GLY  HA3     5.50   (#peak 1200 )
 &rst
  ixpk= 1200, nxpk= 0, iat=1867,1882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 119 ASP  HN    120 GLY  QA      5.33             (#peak  1202)
 &rst
  ixpk= 1202, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1881,1882,
 &end
#
# 119 ASP  HN    121 ALA  HN      4.00             (#peak  1193)
 &rst
  ixpk= 1193, nxpk= 0, iat=1867,1886, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 119 ASP  HN    121 ALA  QB      4.96             (#peak  1210)
 &rst
  ixpk= 1210, nxpk= 0, iat=1867,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2=1890,1891,1892,
 &end
#
# 119 ASP  HA    121 ALA  QB      5.50             (#peak  1656)
 &rst
  ixpk= 1656, nxpk= 0, iat=1869,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1890,1891,1892,
 &end
#
# 119 ASP  HB2   120 GLY  HN      4.30             (#peak   410)
 &rst
  ixpk= 410, nxpk= 0, iat=1871,1879, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 119 ASP  HB2   121 ALA  HN      4.37             (#peak   354)
 &rst
  ixpk= 354, nxpk= 0, iat=1871,1886, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 119 ASP  HB2   121 ALA  QB      4.52             (#peak  1657)
 &rst
  ixpk= 1657, nxpk= 0, iat=1871,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2=1890,1891,1892,
 &end
#
# 119 ASP  HB3   120 GLY  HN      4.30             (#peak   411)
 &rst
  ixpk= 411, nxpk= 0, iat=1872,1879, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 119 ASP  HB3   121 ALA  HN      4.37             (#peak   355)
 &rst
  ixpk= 355, nxpk= 0, iat=1872,1886, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
# 119 ASP  HB3   121 ALA  QB      4.52             (#peak  1658)
 &rst
  ixpk= 1658, nxpk= 0, iat=1872,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2=1890,1891,1892,
 &end
#
# 119 ASP  QB    120 GLY  HN      3.77             (#peak   411)
 &rst
  ixpk= 411, nxpk= 0, iat=  -1,1879, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=1871,1872,
 &end
#
# 119 ASP  QB    121 ALA  HN      3.71             (#peak   355)
 &rst
  ixpk= 355, nxpk= 0, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr1=1871,1872,
 &end
#
# 119 ASP  QB    121 ALA  QB      3.87             (#peak  1658)
 &rst
  ixpk= 1658, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1=1871,1872,
 igr2=1890,1891,1892,
 &end
#
# 120 GLY  HN    121 ALA  HN      3.07             (#peak   405)
 &rst
  ixpk= 405, nxpk= 0, iat=1879,1886, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57,  &end
#
# 120 GLY  HN    121 ALA  QB      4.31             (#peak  1651)
 &rst
  ixpk= 1651, nxpk= 0, iat=1879,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1890,1891,1892,
 &end
#
# 121 ALA  HN    121 ALA  QB      2.59             (#peak   357)
 &rst
  ixpk= 357, nxpk= 0, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2=1890,1891,1892,
 &end
#
# 121 ALA  HN    122 VAL  HN      4.76             (#peak   562)
 &rst
  ixpk= 562, nxpk= 0, iat=1886,1896, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 121 ALA  HN    123 ILE  QG2     4.81             (#peak   359)
 &rst
  ixpk= 359, nxpk= 0, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2=1918,1919,1920,
 &end
#
# 121 ALA  HA    122 VAL  HN      2.69             (#peak   563)
 &rst
  ixpk= 563, nxpk= 0, iat=1888,1896, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,  &end
#
# 121 ALA  HA    122 VAL  HB      5.11             (#peak  1642)
 &rst
  ixpk= 1642, nxpk= 0, iat=1888,1900, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
# 121 ALA  HA    122 VAL  QQG     3.77             (#peak  1645)
 &rst
  ixpk= 1645, nxpk= 0, iat=1888,1899, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
# 121 ALA  HA    123 ILE  HN      5.38             (#peak  1648)
 &rst
  ixpk= 1648, nxpk= 0, iat=1888,1912, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
# 121 ALA  QB    122 VAL  HN      3.25             (#peak  1649)
 &rst
  ixpk= 1649, nxpk= 0, iat=  -1,1896, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr1=1890,1891,1892,
 &end
#
# 121 ALA  QB    122 VAL  HB      5.50             (#peak 1659 )
 &rst
  ixpk= 1659, nxpk= 0, iat=  -1,1900, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1890,1891,1892,
 &end
#
# 121 ALA  QB    123 ILE  QG2     3.14             (#peak  1660)
 &rst
  ixpk= 1660, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1890,1891,1892,
 igr2=1918,1919,1920,
 &end
#
# 122 VAL  HN    122 VAL  HB      2.86             (#peak   565)
 &rst
  ixpk= 565, nxpk= 0, iat=1896,1900, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
# 122 VAL  HN    122 VAL  QG1     3.78             (#peak   571)
 &rst
  ixpk= 571, nxpk= 0, iat=1896,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1902,1903,1904,
 &end
#
# 122 VAL  HN    122 VAL  QG2     3.78             (#peak  1687)
 &rst
  ixpk= 1687, nxpk= 0, iat=1896,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1906,1907,1908,
 &end
#
# 122 VAL  HN    122 VAL  QQG     2.75             (#peak   571)
 &rst
  ixpk= 571, nxpk= 0, iat=1896,1899, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
# 122 VAL  HN    123 ILE  HA      5.33             (#peak  1699)
 &rst
  ixpk= 1699, nxpk= 0, iat=1896,1914, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
# 122 VAL  HA    122 VAL  QG1     3.43             (#peak  1674)
 &rst
  ixpk= 1674, nxpk= 0, iat=1898,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2=1902,1903,1904,
 &end
#
# 122 VAL  HA    122 VAL  QG2     3.43             (#peak  1675)
 &rst
  ixpk= 1675, nxpk= 0, iat=1898,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2=1906,1907,1908,
 &end
#
# 122 VAL  HA    124 MET  HN      3.79             (#peak   744)
 &rst
  ixpk= 744, nxpk= 0, iat=1898,1931, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 122 VAL  HB    124 MET  HN      5.21             (#peak   746)
 &rst
  ixpk= 746, nxpk= 0, iat=1900,1931, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
# 122 VAL  QG2   127 LEU  HG      6.00             (#peak 1693 )
 &rst
  ixpk= 1693, nxpk= 0, iat=  -1,1994, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1906,1907,1908,
 &end
#
# 122 VAL  QQG   123 ILE  HA      4.62             (#peak  1678)
 &rst
  ixpk= 1678, nxpk= 0, iat=1899,1914, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,  &end
#
# 122 VAL  QQG   124 MET  HN      3.34             (#peak   760)
 &rst
  ixpk= 760, nxpk= 0, iat=1899,1931, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,  &end
#
# 122 VAL  QQG   125 PHE  HN      4.78             (#peak  1299)
 &rst
  ixpk= 1299, nxpk= 0, iat=1899,1948, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,  &end
#
# 122 VAL  QQG   125 PHE  HA      4.39             (#peak  1680)
 &rst
  ixpk= 1680, nxpk= 0, iat=1899,1950, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,  &end
#
# 122 VAL  QQG   125 PHE  HD      6.59             (#peak  1683)
 &rst
  ixpk= 1683, nxpk= 0, iat=1899,  -1, r1= 1.30, r2= 1.80, r3= 9.60, r4=10.10,
 igr2=1956,1964,
 &end
#
# 123 ILE  HN    124 MET  HN      3.51             (#peak   984)
 &rst
  ixpk= 984, nxpk= 0, iat=1912,1931, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
# 123 ILE  HN    124 MET  HA      5.26             (#peak   980)
 &rst
  ixpk= 980, nxpk= 0, iat=1912,1933, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 123 ILE  HN    124 MET  QE      5.50             (#peak   977)
 &rst
  ixpk= 977, nxpk= 0, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1942,1943,1944,
 &end
#
# 123 ILE  HA    123 ILE  QD1     3.77             (#peak  1725)
 &rst
  ixpk= 1725, nxpk= 0, iat=1914,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2=1925,1926,1927,
 &end
#
# 123 ILE  HA    123 ILE  QG2     3.41             (#peak  1288)
 &rst
  ixpk= 1288, nxpk= 0, iat=1914,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2=1918,1919,1920,
 &end
#
# 123 ILE  HB    123 ILE  QD1     3.31             (#peak  1716)
 &rst
  ixpk= 1716, nxpk= 0, iat=1916,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1925,1926,1927,
 &end
#
# 123 ILE  HB    124 MET  HN      4.47             (#peak  1707)
 &rst
  ixpk= 1707, nxpk= 0, iat=1916,1931, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 123 ILE  HG12  124 MET  HN      3.66             (#peak   751)
 &rst
  ixpk= 751, nxpk= 0, iat=1922,1931, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
# 123 ILE  HG12  124 MET  QB      4.10             (#peak  1711)
 &rst
  ixpk= 1711, nxpk= 0, iat=1922,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1935,1936,
 &end
#
# 123 ILE  HG12  124 MET  QG      4.03             (#peak  2204)
 &rst
  ixpk= 2204, nxpk= 0, iat=1922,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2=1938,1939,
 &end
#
# 123 ILE  HG13  124 MET  HN      4.48             (#peak  1578)
 &rst
  ixpk= 1578, nxpk= 0, iat=1923,1931, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
# 123 ILE  QD1   124 MET  HN      4.16             (#peak  1731)
 &rst
  ixpk= 1731, nxpk= 0, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=1925,1926,1927,
 &end
#
# 123 ILE  QD1   124 MET  QB      3.90             (#peak  1739)
 &rst
  ixpk= 1739, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=1925,1926,1927,
 igr2=1935,1936,
 &end
#
# 123 ILE  QD1   124 MET  QE      5.00             (#peak 1721 )
 &rst
  ixpk= 1721, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1925,1926,1927,
 igr2=1942,1943,1944,
 &end
#
# 123 ILE  QD1   124 MET  QG      4.88             (#peak  1740)
 &rst
  ixpk= 1740, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1=1925,1926,1927,
 igr2=1938,1939,
 &end
#
# 123 ILE  QD1   125 PHE  HN      5.50             (#peak  1730)
 &rst
  ixpk= 1730, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1925,1926,1927,
 &end
#
# 123 ILE  QD1   126 ILE  QD1     5.00             (#peak 1841 )
 &rst
  ixpk= 1841, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1925,1926,1927,
 igr2=1981,1982,1983,
 &end
#
# 123 ILE  QG2   123 ILE  HG12    3.89             (#peak  1297)
 &rst
  ixpk= 1297, nxpk= 0, iat=  -1,1922, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1=1918,1919,1920,
 &end
#
# 123 ILE  QG2   123 ILE  QD1     2.83             (#peak  1718)
 &rst
  ixpk= 1718, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr1=1918,1919,1920,
 igr2=1925,1926,1927,
 &end
#
# 123 ILE  QG2   124 MET  HN      3.93             (#peak   755)
 &rst
  ixpk= 755, nxpk= 0, iat=  -1,1931, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1918,1919,1920,
 &end
#
# 123 ILE  QG2   124 MET  QE      4.72             (#peak  1294)
 &rst
  ixpk= 1294, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1918,1919,1920,
 igr2=1942,1943,1944,
 &end
#
# 124 MET  HN    124 MET  QE      4.51             (#peak  2970)
 &rst
  ixpk= 2970, nxpk= 0, iat=1931,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2=1942,1943,1944,
 &end
#
# 124 MET  HN    125 PHE  HN      5.50             (#peak 736  )
 &rst
  ixpk= 736, nxpk= 0, iat=1931,1948, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 124 MET  HA    124 MET  QE      4.10             (#peak  2969)
 &rst
  ixpk= 2969, nxpk= 0, iat=1933,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1942,1943,1944,
 &end
#
# 124 MET  HA    124 MET  QG      3.73             (#peak  1746)
 &rst
  ixpk= 1746, nxpk= 0, iat=1933,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2=1938,1939,
 &end
#
# 124 MET  HA    125 PHE  HN      3.40             (#peak  1290)
 &rst
  ixpk= 1290, nxpk= 0, iat=1933,1948, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 124 MET  HB2   125 PHE  HN      4.31             (#peak  1293)
 &rst
  ixpk= 1293, nxpk= 0, iat=1935,1948, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 124 MET  HB2   126 ILE  HB      5.50             (#peak 1800 )
 &rst
  ixpk= 1800, nxpk= 0, iat=1935,1972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 124 MET  HB3   125 PHE  HN      4.31             (#peak  1294)
 &rst
  ixpk= 1294, nxpk= 0, iat=1936,1948, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
# 124 MET  HG2   124 MET  QE      3.51             (#peak  2965)
 &rst
  ixpk= 2965, nxpk= 0, iat=1938,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1942,1943,1944,
 &end
#
# 124 MET  HG3   124 MET  QE      3.51             (#peak  2966)
 &rst
  ixpk= 2966, nxpk= 0, iat=1939,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1942,1943,1944,
 &end
#
# 124 MET  QB    125 PHE  HN      3.69             (#peak  1293)
 &rst
  ixpk= 1293, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1=1935,1936,
 &end
#
# 124 MET  QB    125 PHE  HA      4.96             (#peak  1781)
 &rst
  ixpk= 1781, nxpk= 0, iat=  -1,1950, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1=1935,1936,
 &end
#
# 124 MET  QB    126 ILE  HN      4.19             (#peak   546)
 &rst
  ixpk= 546, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=1935,1936,
 &end
#
# 124 MET  QB    126 ILE  QD1     3.89             (#peak  1835)
 &rst
  ixpk= 1835, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1935,1936,
 igr2=1981,1982,1983,
 &end
#
# 124 MET  QE    125 PHE  HN      4.88             (#peak  2972)
 &rst
  ixpk= 2972, nxpk= 0, iat=  -1,1948, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1942,1943,1944,
 &end
#
# 124 MET  QG    124 MET  QE      3.06             (#peak  2966)
 &rst
  ixpk= 2966, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr1=1938,1939,
 igr2=1942,1943,1944,
 &end
#
# 125 PHE  HN    125 PHE  HB2     3.72             (#peak  1292)
 &rst
  ixpk= 1292, nxpk= 0, iat=1948,1952, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 125 PHE  HN    125 PHE  HB3     3.91             (#peak  1291)
 &rst
  ixpk= 1291, nxpk= 0, iat=1948,1953, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
# 125 PHE  HN    125 PHE  HD      6.05             (#peak  1289)
 &rst
  ixpk= 1289, nxpk= 0, iat=1948,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2=1956,1964,
 &end
#
# 125 PHE  HN    126 ILE  HN      4.15             (#peak   557)
 &rst
  ixpk= 557, nxpk= 0, iat=1948,1968, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
# 125 PHE  HA    125 PHE  HD      6.29             (#peak  1786)
 &rst
  ixpk= 1786, nxpk= 0, iat=1950,  -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
 igr2=1956,1964,
 &end
#
# 125 PHE  HA    126 ILE  HN      3.19             (#peak   537)
 &rst
  ixpk= 537, nxpk= 0, iat=1950,1968, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 125 PHE  HA    126 ILE  HB      5.50             (#peak  1798)
 &rst
  ixpk= 1798, nxpk= 0, iat=1950,1972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 125 PHE  HA    127 LEU  QQD     4.80             (#peak  1782)
 &rst
  ixpk= 1782, nxpk= 0, iat=1950,1993, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
# 125 PHE  HB2   126 ILE  HN      4.85             (#peak   545)
 &rst
  ixpk= 545, nxpk= 0, iat=1952,1968, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 125 PHE  HB2   127 LEU  QQD     4.58             (#peak  1794)
 &rst
  ixpk= 1794, nxpk= 0, iat=1952,1993, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,  &end
#
# 125 PHE  HB3   127 LEU  HN      5.00             (#peak   156)
 &rst
  ixpk= 156, nxpk= 0, iat=1953,1987, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 125 PHE  HB3   127 LEU  QQD     3.59             (#peak  1875)
 &rst
  ixpk= 1875, nxpk= 0, iat=1953,1993, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,  &end
#
# 125 PHE  HD    126 ILE  HN      6.09             (#peak   553)
 &rst
  ixpk= 553, nxpk= 0, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr1=1956,1964,
 &end
#
# 125 PHE  HD    127 LEU  QQD     6.26             (#peak  1870)
 &rst
  ixpk= 1870, nxpk= 0, iat=  -1,1993, r1= 1.30, r2= 1.80, r3= 9.23, r4= 9.73,
 igr1=1956,1964,
 &end
#
# 126 ILE  HN    126 ILE  HB      3.35             (#peak   547)
 &rst
  ixpk= 547, nxpk= 0, iat=1968,1972, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
# 126 ILE  HN    126 ILE  QD1     3.93             (#peak   552)
 &rst
  ixpk= 552, nxpk= 0, iat=1968,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1981,1982,1983,
 &end
#
# 126 ILE  HN    126 ILE  QG2     3.93             (#peak  1827)
 &rst
  ixpk= 1827, nxpk= 0, iat=1968,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1974,1975,1976,
 &end
#
# 126 ILE  HN    127 LEU  HN      4.56             (#peak   130)
 &rst
  ixpk= 130, nxpk= 0, iat=1968,1987, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,  &end
#
# 126 ILE  HA    126 ILE  QD1     4.16             (#peak  1832)
 &rst
  ixpk= 1832, nxpk= 0, iat=1970,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2=1981,1982,1983,
 &end
#
# 126 ILE  HA    126 ILE  QG2     3.61             (#peak  1816)
 &rst
  ixpk= 1816, nxpk= 0, iat=1970,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2=1974,1975,1976,
 &end
#
# 126 ILE  HB    126 ILE  QD1     3.74             (#peak  1837)
 &rst
  ixpk= 1837, nxpk= 0, iat=1972,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1981,1982,1983,
 &end
#
# 126 ILE  QD1   128 ASN  HN      6.00             (#peak 688  )
 &rst
  ixpk= 688, nxpk= 0, iat=  -1,2006, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1981,1982,1983,
 &end
#
# 126 ILE  QG2   127 LEU  HN      3.87             (#peak  1826)
 &rst
  ixpk= 1826, nxpk= 0, iat=  -1,1987, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   127 LEU  HA      4.54             (#peak  1818)
 &rst
  ixpk= 1818, nxpk= 0, iat=  -1,1989, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HN      4.97             (#peak  1825)
 &rst
  ixpk= 1825, nxpk= 0, iat=  -1,2006, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HA      4.53             (#peak  1819)
 &rst
  ixpk= 1819, nxpk= 0, iat=  -1,2008, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HB2     5.50             (#peak  1807)
 &rst
  ixpk= 1807, nxpk= 0, iat=  -1,2010, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HB3     5.50             (#peak  1808)
 &rst
  ixpk= 1808, nxpk= 0, iat=  -1,2011, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HD21    4.30             (#peak  1823)
 &rst
  ixpk= 1823, nxpk= 0, iat=  -1,2015, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1974,1975,1976,
 &end
#
# 126 ILE  QG2   128 ASN  HD22    4.30             (#peak  1450)
 &rst
  ixpk= 1450, nxpk= 0, iat=  -1,2016, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1974,1975,1976,
 &end
#
# 127 LEU  HN    127 LEU  HG      3.90             (#peak   121)
 &rst
  ixpk= 121, nxpk= 0, iat=1987,1994, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
# 127 LEU  HN    127 LEU  QD1     4.91             (#peak  1849)
 &rst
  ixpk= 1849, nxpk= 0, iat=1987,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2=1996,1997,1998,
 &end
#
# 127 LEU  HN    127 LEU  QD2     4.91             (#peak   152)
 &rst
  ixpk= 152, nxpk= 0, iat=1987,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2=2000,2001,2002,
 &end
#
# 127 LEU  HN    127 LEU  QQD     3.37             (#peak   152)
 &rst
  ixpk= 152, nxpk= 0, iat=1987,1993, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
# 127 LEU  HN    128 ASN  HN      4.77             (#peak   129)
 &rst
  ixpk= 129, nxpk= 0, iat=1987,2006, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
# 127 LEU  HN    129 PHE  HD      6.56             (#peak   127)
 &rst
  ixpk= 127, nxpk= 0, iat=1987,  -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
 igr2=2028,2036,
 &end
#
# 127 LEU  HA    127 LEU  HG      4.03             (#peak  1843)
 &rst
  ixpk= 1843, nxpk= 0, iat=1989,1994, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 127 LEU  HA    127 LEU  QD1     3.98             (#peak  1845)
 &rst
  ixpk= 1845, nxpk= 0, iat=1989,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2=1996,1997,1998,
 &end
#
# 127 LEU  HA    127 LEU  QD2     3.98             (#peak  1871)
 &rst
  ixpk= 1871, nxpk= 0, iat=1989,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2=2000,2001,2002,
 &end
#
# 127 LEU  HA    127 LEU  QQD     3.48             (#peak  1845)
 &rst
  ixpk= 1845, nxpk= 0, iat=1989,1993, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
# 127 LEU  HA    128 ASN  HN      3.03             (#peak   670)
 &rst
  ixpk= 670, nxpk= 0, iat=1989,2006, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 127 LEU  HG    128 ASN  HN      5.50             (#peak  1863)
 &rst
  ixpk= 1863, nxpk= 0, iat=1994,2006, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 127 LEU  QQD   128 ASN  HN      3.77             (#peak   684)
 &rst
  ixpk= 684, nxpk= 0, iat=1993,2006, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
# 128 ASN  HN    128 ASN  HB2     3.48             (#peak   680)
 &rst
  ixpk= 680, nxpk= 0, iat=2006,2010, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 128 ASN  HN    128 ASN  HB3     3.71             (#peak   681)
 &rst
  ixpk= 681, nxpk= 0, iat=2006,2011, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
# 128 ASN  HN    128 ASN  HD21    4.50             (#peak   672)
 &rst
  ixpk= 672, nxpk= 0, iat=2006,2015, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 128 ASN  HN    128 ASN  HD22    4.50             (#peak  1446)
 &rst
  ixpk= 1446, nxpk= 0, iat=2006,2016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 128 ASN  HN    128 ASN  QD2     3.95             (#peak   672)
 &rst
  ixpk= 672, nxpk= 0, iat=2006,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2=2015,2016,
 &end
#
# 128 ASN  HN    129 PHE  HN      4.44             (#peak   675)
 &rst
  ixpk= 675, nxpk= 0, iat=2006,2020, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 128 ASN  HA    129 PHE  HN      3.16             (#peak   536)
 &rst
  ixpk= 536, nxpk= 0, iat=2008,2020, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
# 128 ASN  HA    129 PHE  HB2     4.85             (#peak  2696)
 &rst
  ixpk= 2696, nxpk= 0, iat=2008,2024, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 128 ASN  HA    129 PHE  HD      6.50             (#peak  2697)
 &rst
  ixpk= 2697, nxpk= 0, iat=2008,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=2028,2036,
 &end
#
# 128 ASN  HB2   128 ASN  HD21    3.76             (#peak  1441)
 &rst
  ixpk= 1441, nxpk= 0, iat=2010,2015, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 128 ASN  HB2   128 ASN  HD22    3.76             (#peak  1447)
 &rst
  ixpk= 1447, nxpk= 0, iat=2010,2016, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
# 128 ASN  HB2   129 PHE  HN      4.58             (#peak  2249)
 &rst
  ixpk= 2249, nxpk= 0, iat=2010,2020, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
# 128 ASN  HB3   128 ASN  QD2     3.51             (#peak  1448)
 &rst
  ixpk= 1448, nxpk= 0, iat=2011,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2=2015,2016,
 &end
#
# 128 ASN  HB3   129 PHE  HN      4.03             (#peak   544)
 &rst
  ixpk= 544, nxpk= 0, iat=2011,2020, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 129 PHE  HN    129 PHE  HB2     3.81             (#peak   541)
 &rst
  ixpk= 541, nxpk= 0, iat=2020,2024, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
# 129 PHE  HN    129 PHE  HB3     3.72             (#peak   543)
 &rst
  ixpk= 543, nxpk= 0, iat=2020,2025, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 129 PHE  HN    129 PHE  HD      5.29             (#peak   556)
 &rst
  ixpk= 556, nxpk= 0, iat=2020,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2=2028,2036,
 &end
#
# 129 PHE  HN    130 GLU  HN      4.61             (#peak   443)
 &rst
  ixpk= 443, nxpk= 0, iat=2020,2040, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
# 129 PHE  HA    129 PHE  HD      6.29             (#peak  1883)
 &rst
  ixpk= 1883, nxpk= 0, iat=2022,  -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
 igr2=2028,2036,
 &end
#
# 129 PHE  HA    130 GLU  HN      3.11             (#peak   435)
 &rst
  ixpk= 435, nxpk= 0, iat=2022,2040, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 129 PHE  HA    130 GLU  HB3     5.24             (#peak  1882)
 &rst
  ixpk= 1882, nxpk= 0, iat=2022,2045, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
# 129 PHE  HB2   130 GLU  HN      4.66             (#peak   444)
 &rst
  ixpk= 444, nxpk= 0, iat=2024,2040, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 129 PHE  HB3   130 GLU  HN      4.49             (#peak  1670)
 &rst
  ixpk= 1670, nxpk= 0, iat=2025,2040, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 129 PHE  HD    130 GLU  HN      6.81             (#peak   438)
 &rst
  ixpk= 438, nxpk= 0, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2028,2036,
 &end
#
# 130 GLU  HN    130 GLU  HB3     3.26             (#peak   448)
 &rst
  ixpk= 448, nxpk= 0, iat=2040,2045, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
# 130 GLU  HN    130 GLU  HG2     4.10             (#peak   447)
 &rst
  ixpk= 447, nxpk= 0, iat=2040,2047, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 130 GLU  HN    130 GLU  HG3     4.30             (#peak  1911)
 &rst
  ixpk= 1911, nxpk= 0, iat=2040,2048, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 130 GLU  HN    131 VAL  HN      5.18             (#peak   207)
 &rst
  ixpk= 207, nxpk= 0, iat=2040,2055, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
# 130 GLU  HA    130 GLU  HG2     3.82             (#peak  1908)
 &rst
  ixpk= 1908, nxpk= 0, iat=2042,2047, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 130 GLU  HA    130 GLU  HG3     3.87             (#peak  1907)
 &rst
  ixpk= 1907, nxpk= 0, iat=2042,2048, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 130 GLU  HA    131 VAL  HN      3.41             (#peak  1894)
 &rst
  ixpk= 1894, nxpk= 0, iat=2042,2055, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 130 GLU  HA    131 VAL  HB      5.50             (#peak 1925 )
 &rst
  ixpk= 1925, nxpk= 0, iat=2042,2059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 130 GLU  HA    131 VAL  QQG     3.74             (#peak  1931)
 &rst
  ixpk= 1931, nxpk= 0, iat=2042,2058, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
# 130 GLU  HB2   130 GLU  HG3     2.76             (#peak  1919)
 &rst
  ixpk= 1919, nxpk= 0, iat=2044,2048, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26,  &end
#
# 130 GLU  HB2   131 VAL  HN      4.00             (#peak   202)
 &rst
  ixpk= 202, nxpk= 0, iat=2044,2055, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
# 130 GLU  HB3   130 GLU  HG2     2.62             (#peak  1920)
 &rst
  ixpk= 1920, nxpk= 0, iat=2045,2047, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
# 130 GLU  HG2   131 VAL  HN      5.17             (#peak  1910)
 &rst
  ixpk= 1910, nxpk= 0, iat=2047,2055, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
# 130 GLU  HG3   131 VAL  HN      4.50             (#peak   203)
 &rst
  ixpk= 203, nxpk= 0, iat=2048,2055, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 130 GLU  HG3   132 VAL  QQG     4.08             (#peak  1913)
 &rst
  ixpk= 1913, nxpk= 0, iat=2048,2074, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,  &end
#
# 130 GLU  QB    131 VAL  QG1     5.50             (#peak 1902 )
 &rst
  ixpk= 1902, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2044,2045,
 igr2=2061,2062,2063,
 &end
#
# 130 GLU  QB    132 VAL  HA      5.50             (#peak 1898 )
 &rst
  ixpk= 1898, nxpk= 0, iat=  -1,2073, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2044,2045,
 &end
#
# 130 GLU  QB    132 VAL  QQG     5.50             (#peak 1963 )
 &rst
  ixpk= 1963, nxpk= 0, iat=  -1,2074, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
 igr1=2044,2045,
 &end
#
# 131 VAL  HN    131 VAL  HB      2.92             (#peak   201)
 &rst
  ixpk= 201, nxpk= 0, iat=2055,2059, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
# 131 VAL  HN    131 VAL  QG1     3.86             (#peak   199)
 &rst
  ixpk= 199, nxpk= 0, iat=2055,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=2061,2062,2063,
 &end
#
# 131 VAL  HN    131 VAL  QG2     3.86             (#peak  1955)
 &rst
  ixpk= 1955, nxpk= 0, iat=2055,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=2065,2066,2067,
 &end
#
# 131 VAL  HN    131 VAL  QQG     2.89             (#peak   199)
 &rst
  ixpk= 199, nxpk= 0, iat=2055,2058, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
# 131 VAL  HN    132 VAL  HN      5.50             (#peak   207)
 &rst
  ixpk= 207, nxpk= 0, iat=2055,2071, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 131 VAL  HN    132 VAL  QQG     4.76             (#peak   198)
 &rst
  ixpk= 198, nxpk= 0, iat=2055,2074, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,  &end
#
# 131 VAL  HA    131 VAL  QG1     3.36             (#peak  1932)
 &rst
  ixpk= 1932, nxpk= 0, iat=2057,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=2061,2062,2063,
 &end
#
# 131 VAL  HA    131 VAL  QG2     3.36             (#peak  1947)
 &rst
  ixpk= 1947, nxpk= 0, iat=2057,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=2065,2066,2067,
 &end
#
# 131 VAL  HA    132 VAL  HN      2.96             (#peak    53)
 &rst
  ixpk= 53, nxpk= 0, iat=2057,2071, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
# 131 VAL  HA    132 VAL  QQG     3.75             (#peak  2680)
 &rst
  ixpk= 2680, nxpk= 0, iat=2057,2074, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,  &end
#
# 131 VAL  HB    132 VAL  HN      4.65             (#peak    59)
 &rst
  ixpk= 59, nxpk= 0, iat=2059,2071, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
# 131 VAL  HB    132 VAL  HA      5.00             (#peak  1928)
 &rst
  ixpk= 1928, nxpk= 0, iat=2059,2073, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 131 VAL  QG1   132 VAL  HN      4.41             (#peak  1938)
 &rst
  ixpk= 1938, nxpk= 0, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2061,2062,2063,
 &end
#
# 131 VAL  QG2   132 VAL  HN      4.41             (#peak  1953)
 &rst
  ixpk= 1953, nxpk= 0, iat=  -1,2071, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2065,2066,2067,
 &end
#
# 131 VAL  QQG   132 VAL  HN      3.33             (#peak  1953)
 &rst
  ixpk= 1953, nxpk= 0, iat=2058,2071, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
# 131 VAL  QQG   132 VAL  HA      4.48             (#peak  1948)
 &rst
  ixpk= 1948, nxpk= 0, iat=2058,2073, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,  &end
#
# 131 VAL  QQG   133 MET  HN      4.31             (#peak   461)
 &rst
  ixpk= 461, nxpk= 0, iat=2058,2087, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,  &end
#
# 132 VAL  HN    132 VAL  QQG     3.09             (#peak    64)
 &rst
  ixpk= 64, nxpk= 0, iat=2071,2074, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 132 VAL  HN    133 MET  HN      4.45             (#peak    56)
 &rst
  ixpk= 56, nxpk= 0, iat=2071,2087, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 132 VAL  HA    132 VAL  QG1     3.64             (#peak    28)
 &rst
  ixpk= 28, nxpk= 0, iat=2073,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2=2077,2078,2079,
 &end
#
# 132 VAL  HA    132 VAL  QG2     3.64             (#peak    28)
 &rst
  ixpk= 28, nxpk= 0, iat=2073,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2=2081,2082,2083,
 &end
#
# 132 VAL  HA    133 MET  HN      2.70             (#peak   452)
 &rst
  ixpk= 452, nxpk= 0, iat=2073,2087, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
# 132 VAL  HB    133 MET  HN      4.27             (#peak   426)
 &rst
  ixpk= 426, nxpk= 0, iat=2075,2087, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 132 VAL  QG2   134 GLU  HN      5.50             (#peak 472  )
 &rst
  ixpk= 472, nxpk= 0, iat=  -1,2104, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2081,2082,2083,
 &end
#
# 132 VAL  QQG   133 MET  HN      3.30             (#peak   462)
 &rst
  ixpk= 462, nxpk= 0, iat=2074,2087, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
# 132 VAL  QQG   133 MET  HA      3.96             (#peak  1958)
 &rst
  ixpk= 1958, nxpk= 0, iat=2074,2089, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,  &end
#
# 133 MET  HN    133 MET  HG2     4.17             (#peak  2827)
 &rst
  ixpk= 2827, nxpk= 0, iat=2087,2094, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 133 MET  HN    133 MET  HG3     4.17             (#peak   457)
 &rst
  ixpk= 457, nxpk= 0, iat=2087,2095, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 133 MET  HN    133 MET  QG      3.52             (#peak   457)
 &rst
  ixpk= 457, nxpk= 0, iat=2087,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=2094,2095,
 &end
#
# 133 MET  HN    134 GLU  HN      4.38             (#peak   455)
 &rst
  ixpk= 455, nxpk= 0, iat=2087,2104, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
# 133 MET  HA    133 MET  HG2     3.97             (#peak  2822)
 &rst
  ixpk= 2822, nxpk= 0, iat=2089,2094, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 133 MET  HA    133 MET  HG3     3.97             (#peak  2823)
 &rst
  ixpk= 2823, nxpk= 0, iat=2089,2095, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 133 MET  HA    133 MET  QE      4.58             (#peak  2974)
 &rst
  ixpk= 2974, nxpk= 0, iat=2089,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=2098,2099,2100,
 &end
#
# 133 MET  HA    134 GLU  HN      2.80             (#peak   465)
 &rst
  ixpk= 465, nxpk= 0, iat=2089,2104, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
# 133 MET  QB    134 GLU  HN      2.79             (#peak   468)
 &rst
  ixpk= 468, nxpk= 0, iat=  -1,2104, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr1=2091,2092,
 &end
#
# 133 MET  QG    134 GLU  HN      4.53             (#peak   470)
 &rst
  ixpk= 470, nxpk= 0, iat=  -1,2104, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=2094,2095,
 &end
#
# 134 GLU  HN    134 GLU  HB2     3.97             (#peak  1981)
 &rst
  ixpk= 1981, nxpk= 0, iat=2104,2108, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 134 GLU  HN    134 GLU  HB3     3.97             (#peak   469)
 &rst
  ixpk= 469, nxpk= 0, iat=2104,2109, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
# 134 GLU  HN    134 GLU  HG2     3.42             (#peak  1773)
 &rst
  ixpk= 1773, nxpk= 0, iat=2104,2111, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 134 GLU  HN    134 GLU  HG3     3.42             (#peak  1772)
 &rst
  ixpk= 1772, nxpk= 0, iat=2104,2112, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
# 134 GLU  HN    134 GLU  QB      3.21             (#peak   469)
 &rst
  ixpk= 469, nxpk= 0, iat=2104,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=2108,2109,
 &end
#
# 134 GLU  HN    134 GLU  QG      2.99             (#peak  1772)
 &rst
  ixpk= 1772, nxpk= 0, iat=2104,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=2111,2112,
 &end
#
# 134 GLU  HN    135 LYS  HN      5.00             (#peak 464  )
 &rst
  ixpk= 464, nxpk= 0, iat=2104,2119, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 134 GLU  HA    134 GLU  HG2     3.86             (#peak  2795)
 &rst
  ixpk= 2795, nxpk= 0, iat=2106,2111, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 134 GLU  HA    134 GLU  HG3     3.86             (#peak  2796)
 &rst
  ixpk= 2796, nxpk= 0, iat=2106,2112, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 134 GLU  HA    135 LYS  HN      2.58             (#peak   576)
 &rst
  ixpk= 576, nxpk= 0, iat=2106,2119, r1= 1.30, r2= 1.80, r3= 2.58, r4= 3.08,  &end
#
# 134 GLU  QB    135 LYS  HN      3.08             (#peak   578)
 &rst
  ixpk= 578, nxpk= 0, iat=  -1,2119, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1=2108,2109,
 &end
#
# 134 GLU  QG    135 LYS  HN      4.37             (#peak   577)
 &rst
  ixpk= 577, nxpk= 0, iat=  -1,2119, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1=2111,2112,
 &end
#
# 135 LYS  HN    135 LYS  HB2     3.63             (#peak   581)
 &rst
  ixpk= 581, nxpk= 0, iat=2119,2123, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 135 LYS  HN    135 LYS  HB3     3.63             (#peak   580)
 &rst
  ixpk= 580, nxpk= 0, iat=2119,2124, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
# 135 LYS  HN    135 LYS  QB      2.98             (#peak   581)
 &rst
  ixpk= 581, nxpk= 0, iat=2119,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2=2123,2124,
 &end
#
#  10 PRO  O      14 PHE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 161, 208, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  10 PRO  O      14 PHE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 161, 207, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  11 GLN  O      15 LEU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 178, 228, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  11 GLN  O      15 LEU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 178, 227, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  12 ASN  O      16 ASP  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 192, 247, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  12 ASN  O      16 ASP  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 192, 246, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  13 THR  O      17 THR  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 206, 259, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  13 THR  O      17 THR  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 206, 258, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  15 LEU  O      19 ILE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 245, 292, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  15 LEU  O      19 ILE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 245, 291, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  16 ASP  O      20 ARG  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 257, 311, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  16 ASP  O      20 ARG  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 257, 310, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  17 THR  O      21 LYS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 271, 335, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  17 THR  O      21 LYS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 271, 334, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  18 ILE  O      22 PHE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 290, 357, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  18 ILE  O      22 PHE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 290, 356, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  31 ILE  HN     43 TYR  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 512, 709, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  31 ILE  N      43 TYR  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 511, 709, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  32 ALA  HN    125 PHE  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 531,1966, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  32 ALA  N     125 PHE  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 530,1966, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  33 ASN  HN     40 ALA  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 541, 653, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  33 ASN  N      40 ALA  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 540, 653, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  36 VAL  O      39 CYS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 603, 634, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  36 VAL  O      39 CYS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 603, 633, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  41 VAL  HN     62 ARG  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 655, 991, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  41 VAL  N      62 ARG  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 654, 991, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  31 ILE  O      43 TYR  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 529, 690, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  31 ILE  O      43 TYR  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 529, 689, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  29 PHE  O      45 ASN  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 491, 722, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  29 PHE  O      45 ASN  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 491, 721, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  46 ASP  O      50 GLU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 746, 786, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  46 ASP  O      50 GLU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 746, 785, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  47 GLY  O      51 LEU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 753, 801, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  47 GLY  O      51 LEU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 753, 800, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  48 PHE  O      52 CYS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 773, 820, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  48 PHE  O      52 CYS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 773, 819, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  49 CYS  O      53 GLY  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 784, 831, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  49 CYS  O      53 GLY  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 784, 830, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  55 SER  O      58 GLU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 868, 904, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  55 SER  O      58 GLU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 868, 903, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  56 ARG  O      59 VAL  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 892, 919, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  56 ARG  O      59 VAL  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 892, 918, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  41 VAL  O      61 GLN  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 669, 952, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  41 VAL  O      61 GLN  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 669, 951, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  59 VAL  O      62 ARG  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 933, 969, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  59 VAL  O      62 ARG  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 933, 968, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  39 CYS  O      64 CYS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 643,1007, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  39 CYS  O      64 CYS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 643,1006, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  65 THR  O      68 PHE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1030,1055, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  65 THR  O      68 PHE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1030,1054, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  66 CYS  O      69 LEU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1041,1075, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  66 CYS  O      69 LEU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1041,1074, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  67 ASP  O      70 HIS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1053,1094, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  67 ASP  O      70 HIS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1053,1093, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  71 GLY  O      74 THR  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1116,1156, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  71 GLY  O      74 THR  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1116,1155, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  75 GLN  O      79 ALA  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1185,1245, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  75 GLN  O      79 ALA  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1185,1244, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  76 ARG  O      80 ALA  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1209,1255, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  76 ARG  O      80 ALA  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1209,1254, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  77 ARG  O      81 GLN  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1233,1265, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  77 ARG  O      81 GLN  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1233,1264, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  78 ALA  O      82 ILE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1243,1282, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  78 ALA  O      82 ILE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1243,1281, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  79 ALA  O      83 ALA  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1253,1301, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  79 ALA  O      83 ALA  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1253,1300, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  80 ALA  O      84 GLN  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1263,1311, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  80 ALA  O      84 GLN  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1263,1310, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  80 ALA  O      84 GLN  HE21    2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1263,1323, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  80 ALA  O      84 GLN  NE2     3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr2=1323,1324,
 &end
#
#  81 GLN  O      85 ALA  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1280,1328, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  81 GLN  O      85 ALA  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1280,1327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  82 ILE  O      86 LEU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1299,1338, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  82 ILE  O      86 LEU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1299,1337, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  83 ALA  O      87 LEU  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1309,1357, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  83 ALA  O      87 LEU  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1309,1356, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  84 GLN  O      88 GLY  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1326,1376, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  84 GLN  O      88 GLY  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1326,1375, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  84 GLN  O      89 ALA  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1326,1383, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  84 GLN  O      89 ALA  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1326,1382, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  98 PHE  HN    106 PHE  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1529,1675, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  98 PHE  N     106 PHE  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1528,1675, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100 ARG  HN    104 SER  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1570,1644, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 100 ARG  N     104 SER  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1569,1644, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  52 CYS  O     101 LYS  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 829,1594, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  52 CYS  O     101 LYS  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 829,1593, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 100 ARG  O     103 GLY  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1592,1628, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 100 ARG  O     103 GLY  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1592,1627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  98 PHE  O     106 PHE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1547,1657, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  98 PHE  O     106 PHE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1547,1656, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 115 VAL  HN    124 MET  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1800,1946, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 115 VAL  N     124 MET  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1799,1946, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 ASN  HN    121 ALA  O       2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1838,1894, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 117 ASN  N     121 ALA  O       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1837,1894, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 117 ASN  O     120 GLY  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1850,1879, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 117 ASN  O     120 GLY  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1850,1878, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 115 VAL  O     124 MET  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1814,1931, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 115 VAL  O     124 MET  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat=1814,1930, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  32 ALA  O     125 PHE  HN      2.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 539,1948, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  32 ALA  O     125 PHE  N       3.00 
 &rst
  ixpk= 581, nxpk= 0, iat= 539,1947, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
# 2140 atoms read from pdb file ../INP/pasam_001.pdb.
# 1 MET CHI1:  (1 MET N)-(1 MET CA)-(1 MET CB)-(1 MET CG) -170.0  60.0
 &rst     iat =     1,     5,     7,    10,
   r1 = -171.0, r2 = -170.0, r3 =  60.0, r4 =  61.0,
   rk2 =1000.0, rk3 =1000.0,    &end

# 1 MET CHI2:  (1 MET CA)-(1 MET CB)-(1 MET CG)-(1 MET SD)  60.0 280.0
 &rst     iat =     5,     7,    10,    13,
   r1 =  59.0, r2 =  60.0, r3 = 280.0, r4 = 281.0,
 &end

# 1 MET CHI3:  (1 MET CB)-(1 MET CG)-(1 MET SD)-(1 MET CE)  60.0 300.0
 &rst     iat =     7,    10,    13,    14,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 1 MET PSI:  (1 MET N)-(1 MET CA)-(1 MET C)-(2 PRO N)  60.0 300.0
 &rst     iat =     1,     5,    18,    20,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 2 PRO PSI:  (2 PRO N)-(2 PRO CA)-(2 PRO C)-(3 VAL N) -50.0 190.0
 &rst     iat =    20,    30,    32,    34,
   r1 = -51.0, r2 = -50.0, r3 = 190.0, r4 = 191.0,
 &end

# 3 VAL PHI:  (2 PRO C)-(3 VAL N)-(3 VAL CA)-(3 VAL C) -180.0  70.0
 &rst     iat =    32,    34,    36,    48,
   r1 = -181.0, r2 = -180.0, r3 =  70.0, r4 =  71.0,
 &end

# 3 VAL CHI1:  (3 VAL N)-(3 VAL CA)-(3 VAL CB)-(3 VAL CG1)  50.0 310.0
 &rst     iat =    34,    36,    38,    40,
   r1 =  49.0, r2 =  50.0, r3 = 310.0, r4 = 311.0,
 &end

# 3 VAL PSI:  (3 VAL N)-(3 VAL CA)-(3 VAL C)-(4 ARG N)  20.0 190.0
 &rst     iat =    34,    36,    48,    50,
   r1 =  19.0, r2 =  20.0, r3 = 190.0, r4 = 191.0,
 &end

# 4 ARG PHI:  (3 VAL C)-(4 ARG N)-(4 ARG CA)-(4 ARG C) -180.0  70.0
 &rst     iat =    48,    50,    52,    72,
   r1 = -181.0, r2 = -180.0, r3 =  70.0, r4 =  71.0,
 &end

# 4 ARG CHI1:  (4 ARG N)-(4 ARG CA)-(4 ARG CB)-(4 ARG CG) -160.0  70.0
 &rst     iat =    50,    52,    54,    57,
   r1 = -161.0, r2 = -160.0, r3 =  70.0, r4 =  71.0,
 &end

# 4 ARG CHI2:  (4 ARG CA)-(4 ARG CB)-(4 ARG CG)-(4 ARG CD) -280.0 -60.0
 &rst     iat =    52,    54,    57,    60,
   r1 = -281.0, r2 = -280.0, r3 = -60.0, r4 = -59.0,
 &end

# 4 ARG CHI3:  (4 ARG CB)-(4 ARG CG)-(4 ARG CD)-(4 ARG NE) -300.0 -50.0
 &rst     iat =    54,    57,    60,    63,
   r1 = -301.0, r2 = -300.0, r3 = -50.0, r4 = -49.0,
 &end

# 4 ARG CHI4:  (4 ARG CG)-(4 ARG CD)-(4 ARG NE)-(4 ARG CZ) -290.0 -70.0
 &rst     iat =    57,    60,    63,    65,
   r1 = -291.0, r2 = -290.0, r3 = -70.0, r4 = -69.0,
 &end

# 4 ARG PSI:  (4 ARG N)-(4 ARG CA)-(4 ARG C)-(5 ARG N)  20.0 190.0
 &rst     iat =    50,    52,    72,    74,
   r1 =  19.0, r2 =  20.0, r3 = 190.0, r4 = 191.0,
 &end

# 5 ARG PHI:  (4 ARG C)-(5 ARG N)-(5 ARG CA)-(5 ARG C) -154.7 -50.0
 &rst     iat =    72,    74,    76,    96,
   r1 = -155.7, r2 = -154.7, r3 = -50.0, r4 = -49.0,
 &end

# 5 ARG CHI1:  (5 ARG N)-(5 ARG CA)-(5 ARG CB)-(5 ARG CG) -160.0  80.0
 &rst     iat =    74,    76,    78,    81,
   r1 = -161.0, r2 = -160.0, r3 =  80.0, r4 =  81.0,
 &end

# 5 ARG CHI2:  (5 ARG CA)-(5 ARG CB)-(5 ARG CG)-(5 ARG CD)  60.0 290.0
 &rst     iat =    76,    78,    81,    84,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &end

# 5 ARG CHI3:  (5 ARG CB)-(5 ARG CG)-(5 ARG CD)-(5 ARG NE)  50.0 300.0
 &rst     iat =    78,    81,    84,    87,
   r1 =  49.0, r2 =  50.0, r3 = 300.0, r4 = 301.0,
 &end

# 5 ARG CHI4:  (5 ARG CG)-(5 ARG CD)-(5 ARG NE)-(5 ARG CZ) -290.0 -60.0
 &rst     iat =    81,    84,    87,    89,
   r1 = -291.0, r2 = -290.0, r3 = -60.0, r4 = -59.0,
 &end

# 5 ARG PSI:  (5 ARG N)-(5 ARG CA)-(5 ARG C)-(6 GLY N)  61.1 190.0
 &rst     iat =    74,    76,    96,    98,
   r1 =  60.1, r2 =  61.1, r3 = 190.0, r4 = 191.0,
 &end

# 6 GLY PHI:  (5 ARG C)-(6 GLY N)-(6 GLY CA)-(6 GLY C)  50.0 310.0
 &rst     iat =    96,    98,   100,   103,
   r1 =  49.0, r2 =  50.0, r3 = 310.0, r4 = 311.0,
 &end

# 7 HIS PHI:  (6 GLY C)-(7 HIE N)-(7 HIE CA)-(7 HIE C) -143.8 -50.0
 &rst     iat =   103,   105,   107,   120,
   r1 = -144.8, r2 = -143.8, r3 = -50.0, r4 = -49.0,
 &end

# 7 HIS CHI1:  (7 HIE N)-(7 HIE CA)-(7 HIE CB)-(7 HIE CG)  40.0 210.0
 &rst     iat =   105,   107,   109,   112,
   r1 =  39.0, r2 =  40.0, r3 = 210.0, r4 = 211.0,
 &end

# 7 HIS CHI2:  (7 HIE CA)-(7 HIE CB)-(7 HIE CG)-(7 HIE ND1)  80.0 280.0
 &rst     iat =   107,   109,   112,   113,
   r1 =  79.0, r2 =  80.0, r3 = 280.0, r4 = 281.0,
 &end

# 7 HIS PSI:  (7 HIE N)-(7 HIE CA)-(7 HIE C)-(8 VAL N)  90.2 182.7
 &rst     iat =   105,   107,   120,   122,
   r1 =  89.2, r2 =  90.2, r3 = 182.7, r4 = 183.7,
 &end

# 8 VAL PHI:  (7 HIE C)-(8 VAL N)-(8 VAL CA)-(8 VAL C) -130.0 -50.0
 &rst     iat =   120,   122,   124,   136,
   r1 = -131.0, r2 = -130.0, r3 = -50.0, r4 = -49.0,
 &end

# 8 VAL CHI1:  (8 VAL N)-(8 VAL CA)-(8 VAL CB)-(8 VAL CG1) -60.0 190.0
 &rst     iat =   122,   124,   126,   128,
   r1 = -61.0, r2 = -60.0, r3 = 190.0, r4 = 191.0,
 &end

# 8 VAL PSI:  (8 VAL N)-(8 VAL CA)-(8 VAL C)-(9 ALA N) 110.0 160.0
 &rst     iat =   122,   124,   136,   138,
   r1 = 109.0, r2 = 110.0, r3 = 160.0, r4 = 161.0,
 &end

# 9 ALA PHI:  (8 VAL C)-(9 ALA N)-(9 ALA CA)-(9 ALA C) -70.0 -54.8
 &rst     iat =   136,   138,   140,   146,
   r1 = -71.0, r2 = -70.0, r3 = -54.8, r4 = -53.8,
 &end

# 9 ALA PSI:  (9 ALA N)-(9 ALA CA)-(9 ALA C)-(10 PRO N) 160.0 170.0
 &rst     iat =   138,   140,   146,   148,
   r1 = 159.0, r2 = 160.0, r3 = 170.0, r4 = 171.0,
 &end

# 10 PRO PSI:  (10 PRO N)-(10 PRO CA)-(10 PRO C)-(11 GLN N) 100.0 110.0
 &rst     iat =   148,   158,   160,   162,
   r1 =  99.0, r2 = 100.0, r3 = 110.0, r4 = 111.0,
 &end

# 11 GLN PHI:  (10 PRO C)-(11 GLN N)-(11 GLN CA)-(11 GLN C) -80.0 -60.0
 &rst     iat =   160,   162,   164,   177,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 11 GLN CHI1:  (11 GLN N)-(11 GLN CA)-(11 GLN CB)-(11 GLN CG)  70.0  80.0
 &rst     iat =   162,   164,   166,   169,
   r1 =  69.0, r2 =  70.0, r3 =  80.0, r4 =  81.0,
 &end

# 11 GLN CHI2:  (11 GLN CA)-(11 GLN CB)-(11 GLN CG)-(11 GLN CD) -70.0 -60.0
 &rst     iat =   164,   166,   169,   172,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 11 GLN CHI3:  (11 GLN CB)-(11 GLN CG)-(11 GLN CD)-(11 GLN OE1) -40.0 -30.0
 &rst     iat =   166,   169,   172,   173,
   r1 = -41.0, r2 = -40.0, r3 = -30.0, r4 = -29.0,
 &end

# 11 GLN PSI:  (11 GLN N)-(11 GLN CA)-(11 GLN C)-(12 ASN N) -40.0 -20.0
 &rst     iat =   162,   164,   177,   179,
   r1 = -41.0, r2 = -40.0, r3 = -20.0, r4 = -19.0,
 &end

# 12 ASN PHI:  (11 GLN C)-(12 ASN N)-(12 ASN CA)-(12 ASN C) -70.0 -50.0
 &rst     iat =   177,   179,   181,   191,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 12 ASN CHI1:  (12 ASN N)-(12 ASN CA)-(12 ASN CB)-(12 ASN CG) -100.0 -80.0
 &rst     iat =   179,   181,   183,   186,
   r1 = -101.0, r2 = -100.0, r3 = -80.0, r4 = -79.0,
 &end

# 12 ASN CHI2:  (12 ASN CA)-(12 ASN CB)-(12 ASN CG)-(12 ASN OD1) -20.0  10.0
 &rst     iat =   181,   183,   186,   187,
   r1 = -21.0, r2 = -20.0, r3 =  10.0, r4 =  11.0,
 &end

# 12 ASN PSI:  (12 ASN N)-(12 ASN CA)-(12 ASN C)-(13 THR N) -60.0 -50.0
 &rst     iat =   179,   181,   191,   193,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 13 THR PHI:  (12 ASN C)-(13 THR N)-(13 THR CA)-(13 THR C) -80.0 -60.0
 &rst     iat =   191,   193,   195,   205,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 13 THR CHI1:  (13 THR N)-(13 THR CA)-(13 THR CB)-(13 THR OG1) -160.0 -150.0
 &rst     iat =   193,   195,   197,   203,
   r1 = -161.0, r2 = -160.0, r3 = -150.0, r4 = -149.0,
 &end

# 13 THR PSI:  (13 THR N)-(13 THR CA)-(13 THR C)-(14 PHE N) -40.0 -30.0
 &rst     iat =   193,   195,   205,   207,
   r1 = -41.0, r2 = -40.0, r3 = -30.0, r4 = -29.0,
 &end

# 14 PHE PHI:  (13 THR C)-(14 PHE N)-(14 PHE CA)-(14 PHE C) -60.0 -50.0
 &rst     iat =   205,   207,   209,   225,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 14 PHE CHI1:  (14 PHE N)-(14 PHE CA)-(14 PHE CB)-(14 PHE CG) -180.0 -140.0
 &rst     iat =   207,   209,   211,   214,
   r1 = -181.0, r2 = -180.0, r3 = -140.0, r4 = -139.0,
 &end

# 14 PHE CHI2:  (14 PHE CA)-(14 PHE CB)-(14 PHE CG)-(14 PHE CD1) -140.0 130.0
 &rst     iat =   209,   211,   214,   215,
   r1 = -141.0, r2 = -140.0, r3 = 130.0, r4 = 131.0,
 &end

# 14 PHE PSI:  (14 PHE N)-(14 PHE CA)-(14 PHE C)-(15 LEU N) -50.0 -40.0
 &rst     iat =   207,   209,   225,   227,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 15 LEU PHI:  (14 PHE C)-(15 LEU N)-(15 LEU CA)-(15 LEU C) -80.0 -70.0
 &rst     iat =   225,   227,   229,   244,
   r1 = -81.0, r2 = -80.0, r3 = -70.0, r4 = -69.0,
 &end

# 15 LEU CHI1:  (15 LEU N)-(15 LEU CA)-(15 LEU CB)-(15 LEU CG) 170.0 180.0
 &rst     iat =   227,   229,   231,   234,
   r1 = 169.0, r2 = 170.0, r3 = 180.0, r4 = 181.0,
 &end

# 15 LEU CHI2:  (15 LEU CA)-(15 LEU CB)-(15 LEU CG)-(15 LEU CD1)  50.0  60.0
 &rst     iat =   229,   231,   234,   236,
   r1 =  49.0, r2 =  50.0, r3 =  60.0, r4 =  61.0,
 &end

# 15 LEU PSI:  (15 LEU N)-(15 LEU CA)-(15 LEU C)-(16 ASP N) -50.0 -40.0
 &rst     iat =   227,   229,   244,   246,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 16 ASP PHI:  (15 LEU C)-(16 ASP N)-(16 ASP CA)-(16 ASP C) -50.0 -42.1
 &rst     iat =   244,   246,   248,   256,
   r1 = -51.0, r2 = -50.0, r3 = -42.1, r4 = -41.1,
 &end

# 16 ASP CHI1:  (16 ASP N)-(16 ASP CA)-(16 ASP CB)-(16 ASP CG) -180.0 -130.0
 &rst     iat =   246,   248,   250,   253,
   r1 = -181.0, r2 = -180.0, r3 = -130.0, r4 = -129.0,
 &end

# 16 ASP PSI:  (16 ASP N)-(16 ASP CA)-(16 ASP C)-(17 THR N) -50.0 -40.0
 &rst     iat =   246,   248,   256,   258,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 17 THR PHI:  (16 ASP C)-(17 THR N)-(17 THR CA)-(17 THR C) -60.0 -50.0
 &rst     iat =   256,   258,   260,   270,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 17 THR CHI1:  (17 THR N)-(17 THR CA)-(17 THR CB)-(17 THR OG1) -70.0 -50.0
 &rst     iat =   258,   260,   262,   268,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 17 THR PSI:  (17 THR N)-(17 THR CA)-(17 THR C)-(18 ILE N) -50.0 -40.0
 &rst     iat =   258,   260,   270,   272,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 18 ILE PHI:  (17 THR C)-(18 ILE N)-(18 ILE CA)-(18 ILE C) -70.0 -60.0
 &rst     iat =   270,   272,   274,   289,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 18 ILE CHI1:  (18 ILE N)-(18 ILE CA)-(18 ILE CB)-(18 ILE CG1) -60.0 -50.0
 &rst     iat =   272,   274,   276,   282,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 18 ILE PSI:  (18 ILE N)-(18 ILE CA)-(18 ILE C)-(19 ILE N) -50.0 -30.0
 &rst     iat =   272,   274,   289,   291,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 19 ILE PHI:  (18 ILE C)-(19 ILE N)-(19 ILE CA)-(19 ILE C) -60.0 -50.0
 &rst     iat =   289,   291,   293,   308,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 19 ILE CHI1:  (19 ILE N)-(19 ILE CA)-(19 ILE CB)-(19 ILE CG1) -60.0 -50.0
 &rst     iat =   291,   293,   295,   301,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 19 ILE CHI21:  (19 ILE CA)-(19 ILE CB)-(19 ILE CG1)-(19 ILE CD1) -60.0 -40.0
 &rst     iat =   293,   295,   301,   304,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 19 ILE PSI:  (19 ILE N)-(19 ILE CA)-(19 ILE C)-(20 ARG N) -60.0 -40.0
 &rst     iat =   291,   293,   308,   310,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 20 ARG PHI:  (19 ILE C)-(20 ARG N)-(20 ARG CA)-(20 ARG C) -70.0 -60.0
 &rst     iat =   308,   310,   312,   332,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 20 ARG CHI1:  (20 ARG N)-(20 ARG CA)-(20 ARG CB)-(20 ARG CG) -100.0 -40.0
 &rst     iat =   310,   312,   314,   317,
   r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
 &end

# 20 ARG CHI2:  (20 ARG CA)-(20 ARG CB)-(20 ARG CG)-(20 ARG CD) -270.0 -80.0
 &rst     iat =   312,   314,   317,   320,
   r1 = -271.0, r2 = -270.0, r3 = -80.0, r4 = -79.0,
 &end

# 20 ARG CHI3:  (20 ARG CB)-(20 ARG CG)-(20 ARG CD)-(20 ARG NE) -110.0 110.0
 &rst     iat =   314,   317,   320,   323,
   r1 = -111.0, r2 = -110.0, r3 = 110.0, r4 = 111.0,
 &end

# 20 ARG CHI4:  (20 ARG CG)-(20 ARG CD)-(20 ARG NE)-(20 ARG CZ)  70.0 290.0
 &rst     iat =   317,   320,   323,   325,
   r1 =  69.0, r2 =  70.0, r3 = 290.0, r4 = 291.0,
 &end

# 20 ARG PSI:  (20 ARG N)-(20 ARG CA)-(20 ARG C)-(21 LYS N) -30.0 -20.0
 &rst     iat =   310,   312,   332,   334,
   r1 = -31.0, r2 = -30.0, r3 = -20.0, r4 = -19.0,
 &end

# 21 LYS PHI:  (20 ARG C)-(21 LYS N)-(21 LYS CA)-(21 LYS C) -70.0 -50.0
 &rst     iat =   332,   334,   336,   354,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 21 LYS CHI1:  (21 LYS N)-(21 LYS CA)-(21 LYS CB)-(21 LYS CG) -180.0 -110.0
 &rst     iat =   334,   336,   338,   341,
   r1 = -181.0, r2 = -180.0, r3 = -110.0, r4 = -109.0,
 &end

# 21 LYS CHI2:  (21 LYS CA)-(21 LYS CB)-(21 LYS CG)-(21 LYS CD)  60.0 270.0
 &rst     iat =   336,   338,   341,   344,
   r1 =  59.0, r2 =  60.0, r3 = 270.0, r4 = 271.0,
 &end

# 21 LYS CHI3:  (21 LYS CB)-(21 LYS CG)-(21 LYS CD)-(21 LYS CE) -260.0 -70.0
 &rst     iat =   338,   341,   344,   347,
   r1 = -261.0, r2 = -260.0, r3 = -70.0, r4 = -69.0,
 &end

# 21 LYS CHI4:  (21 LYS CG)-(21 LYS CD)-(21 LYS CE)-(21 LYS NZ)  60.0 260.0
 &rst     iat =   341,   344,   347,   350,
   r1 =  59.0, r2 =  60.0, r3 = 260.0, r4 = 261.0,
 &end

# 21 LYS PSI:  (21 LYS N)-(21 LYS CA)-(21 LYS C)-(22 PHE N) -60.0 -40.0
 &rst     iat =   334,   336,   354,   356,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 22 PHE PHI:  (21 LYS C)-(22 PHE N)-(22 PHE CA)-(22 PHE C) -120.0 -90.0
 &rst     iat =   354,   356,   358,   374,
   r1 = -121.0, r2 = -120.0, r3 = -90.0, r4 = -89.0,
 &end

# 22 PHE CHI1:  (22 PHE N)-(22 PHE CA)-(22 PHE CB)-(22 PHE CG)  70.0  90.0
 &rst     iat =   356,   358,   360,   363,
   r1 =  69.0, r2 =  70.0, r3 =  90.0, r4 =  91.0,
 &end

# 22 PHE CHI2:  (22 PHE CA)-(22 PHE CB)-(22 PHE CG)-(22 PHE CD1)  80.0 280.0
 &rst     iat =   358,   360,   363,   364,
   r1 =  79.0, r2 =  80.0, r3 = 280.0, r4 = 281.0,
 &end

# 22 PHE PSI:  (22 PHE N)-(22 PHE CA)-(22 PHE C)-(23 GLU N)   0.0  22.0
 &rst     iat =   356,   358,   374,   376,
   r1 =  -1.0, r2 =   0.0, r3 =  22.0, r4 =  23.0,
 &end

# 23 GLU PHI:  (22 PHE C)-(23 GLU N)-(23 GLU CA)-(23 GLU C) -60.0 -50.0
 &rst     iat =   374,   376,   378,   389,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 23 GLU CHI1:  (23 GLU N)-(23 GLU CA)-(23 GLU CB)-(23 GLU CG) 150.0 180.0
 &rst     iat =   376,   378,   380,   383,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 23 GLU CHI2:  (23 GLU CA)-(23 GLU CB)-(23 GLU CG)-(23 GLU CD)  60.0 280.0
 &rst     iat =   378,   380,   383,   386,
   r1 =  59.0, r2 =  60.0, r3 = 280.0, r4 = 281.0,
 &end

# 23 GLU PSI:  (23 GLU N)-(23 GLU CA)-(23 GLU C)-(24 GLY N) -29.0 -20.0
 &rst     iat =   376,   378,   389,   391,
   r1 = -30.0, r2 = -29.0, r3 = -20.0, r4 = -19.0,
 &end

# 24 GLY PHI:  (23 GLU C)-(24 GLY N)-(24 GLY CA)-(24 GLY C)  50.0 101.1
 &rst     iat =   389,   391,   393,   396,
   r1 =  49.0, r2 =  50.0, r3 = 101.1, r4 = 102.1,
 &end

# 24 GLY PSI:  (24 GLY N)-(24 GLY CA)-(24 GLY C)-(25 GLN N)  -1.6  55.4
 &rst     iat =   391,   393,   396,   398,
   r1 =  -2.6, r2 =  -1.6, r3 =  55.4, r4 =  56.4,
 &end

# 25 GLN PHI:  (24 GLY C)-(25 GLN N)-(25 GLN CA)-(25 GLN C) -133.6 -50.0
 &rst     iat =   396,   398,   400,   413,
   r1 = -134.6, r2 = -133.6, r3 = -50.0, r4 = -49.0,
 &end

# 25 GLN CHI1:  (25 GLN N)-(25 GLN CA)-(25 GLN CB)-(25 GLN CG)  40.0 310.0
 &rst     iat =   398,   400,   402,   405,
   r1 =  39.0, r2 =  40.0, r3 = 310.0, r4 = 311.0,
 &end

# 25 GLN CHI2:  (25 GLN CA)-(25 GLN CB)-(25 GLN CG)-(25 GLN CD) -260.0 -80.0
 &rst     iat =   400,   402,   405,   408,
   r1 = -261.0, r2 = -260.0, r3 = -80.0, r4 = -79.0,
 &end

# 25 GLN CHI3:  (25 GLN CB)-(25 GLN CG)-(25 GLN CD)-(25 GLN OE1) -130.0 130.0
 &rst     iat =   402,   405,   408,   409,
   r1 = -131.0, r2 = -130.0, r3 = 130.0, r4 = 131.0,
 &end

# 25 GLN PSI:  (25 GLN N)-(25 GLN CA)-(25 GLN C)-(26 SER N) -67.2  30.0
 &rst     iat =   398,   400,   413,   415,
   r1 = -68.2, r2 = -67.2, r3 =  30.0, r4 =  31.0,
 &end

# 26 SER PHI:  (25 GLN C)-(26 SER N)-(26 SER CA)-(26 SER C) -113.9 -50.0
 &rst     iat =   413,   415,   417,   424,
   r1 = -114.9, r2 = -113.9, r3 = -50.0, r4 = -49.0,
 &end

# 26 SER CHI1:  (26 SER N)-(26 SER CA)-(26 SER CB)-(26 SER OG) -170.0 100.0
 &rst     iat =   415,   417,   419,   422,
   r1 = -171.0, r2 = -170.0, r3 = 100.0, r4 = 101.0,
 &end

# 26 SER PSI:  (26 SER N)-(26 SER CA)-(26 SER C)-(27 ARG N) -30.0  34.3
 &rst     iat =   415,   417,   424,   426,
   r1 = -31.0, r2 = -30.0, r3 =  34.3, r4 =  35.3,
 &end

# 27 ARG PHI:  (26 SER C)-(27 ARG N)-(27 ARG CA)-(27 ARG C) -120.0 -52.0
 &rst     iat =   424,   426,   428,   448,
   r1 = -121.0, r2 = -120.0, r3 = -52.0, r4 = -51.0,
 &end

# 27 ARG CHI1:  (27 ARG N)-(27 ARG CA)-(27 ARG CB)-(27 ARG CG) -130.0  50.0
 &rst     iat =   426,   428,   430,   433,
   r1 = -131.0, r2 = -130.0, r3 =  50.0, r4 =  51.0,
 &end

# 27 ARG CHI2:  (27 ARG CA)-(27 ARG CB)-(27 ARG CG)-(27 ARG CD) -150.0  80.0
 &rst     iat =   428,   430,   433,   436,
   r1 = -151.0, r2 = -150.0, r3 =  80.0, r4 =  81.0,
 &end

# 27 ARG CHI3:  (27 ARG CB)-(27 ARG CG)-(27 ARG CD)-(27 ARG NE) -220.0 -120.0
 &rst     iat =   430,   433,   436,   439,
   r1 = -221.0, r2 = -220.0, r3 = -120.0, r4 = -119.0,
 &end

# 27 ARG CHI4:  (27 ARG CG)-(27 ARG CD)-(27 ARG NE)-(27 ARG CZ)  60.0 300.0
 &rst     iat =   433,   436,   439,   441,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 27 ARG PSI:  (27 ARG N)-(27 ARG CA)-(27 ARG C)-(28 LYS N) 150.0 189.0
 &rst     iat =   426,   428,   448,   450,
   r1 = 149.0, r2 = 150.0, r3 = 189.0, r4 = 190.0,
 &end

# 28 LYS PHI:  (27 ARG C)-(28 LYS N)-(28 LYS CA)-(28 LYS C) -139.9 -51.2
 &rst     iat =   448,   450,   452,   470,
   r1 = -140.9, r2 = -139.9, r3 = -51.2, r4 = -50.2,
 &end

# 28 LYS CHI1:  (28 LYS N)-(28 LYS CA)-(28 LYS CB)-(28 LYS CG) -60.0  60.0
 &rst     iat =   450,   452,   454,   457,
   r1 = -61.0, r2 = -60.0, r3 =  60.0, r4 =  61.0,
 &end

# 28 LYS CHI2:  (28 LYS CA)-(28 LYS CB)-(28 LYS CG)-(28 LYS CD) -270.0 -80.0
 &rst     iat =   452,   454,   457,   460,
   r1 = -271.0, r2 = -270.0, r3 = -80.0, r4 = -79.0,
 &end

# 28 LYS CHI3:  (28 LYS CB)-(28 LYS CG)-(28 LYS CD)-(28 LYS CE)  60.0 300.0
 &rst     iat =   454,   457,   460,   463,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 28 LYS CHI4:  (28 LYS CG)-(28 LYS CD)-(28 LYS CE)-(28 LYS NZ)  50.0 290.0
 &rst     iat =   457,   460,   463,   466,
   r1 =  49.0, r2 =  50.0, r3 = 290.0, r4 = 291.0,
 &end

# 28 LYS PSI:  (28 LYS N)-(28 LYS CA)-(28 LYS C)-(29 PHE N) 120.0 160.0
 &rst     iat =   450,   452,   470,   472,
   r1 = 119.0, r2 = 120.0, r3 = 160.0, r4 = 161.0,
 &end

# 29 PHE PHI:  (28 LYS C)-(29 PHE N)-(29 PHE CA)-(29 PHE C) -174.4 -170.0
 &rst     iat =   470,   472,   474,   490,
   r1 = -175.4, r2 = -174.4, r3 = -170.0, r4 = -169.0,
 &end

# 29 PHE CHI1:  (29 PHE N)-(29 PHE CA)-(29 PHE CB)-(29 PHE CG)  40.0  80.0
 &rst     iat =   472,   474,   476,   479,
   r1 =  39.0, r2 =  40.0, r3 =  80.0, r4 =  81.0,
 &end

# 29 PHE CHI2:  (29 PHE CA)-(29 PHE CB)-(29 PHE CG)-(29 PHE CD1) -290.0 -60.0
 &rst     iat =   474,   476,   479,   480,
   r1 = -291.0, r2 = -290.0, r3 = -60.0, r4 = -59.0,
 &end

# 29 PHE PSI:  (29 PHE N)-(29 PHE CA)-(29 PHE C)-(30 ILE N) 150.0 180.0
 &rst     iat =   472,   474,   490,   492,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 30 ILE PHI:  (29 PHE C)-(30 ILE N)-(30 ILE CA)-(30 ILE C) -150.0 -120.0
 &rst     iat =   490,   492,   494,   509,
   r1 = -151.0, r2 = -150.0, r3 = -120.0, r4 = -119.0,
 &end

# 30 ILE CHI1:  (30 ILE N)-(30 ILE CA)-(30 ILE CB)-(30 ILE CG1)  30.0  60.0
 &rst     iat =   492,   494,   496,   502,
   r1 =  29.0, r2 =  30.0, r3 =  60.0, r4 =  61.0,
 &end

# 30 ILE CHI21:  (30 ILE CA)-(30 ILE CB)-(30 ILE CG1)-(30 ILE CD1)  50.0  90.0
 &rst     iat =   494,   496,   502,   505,
   r1 =  49.0, r2 =  50.0, r3 =  90.0, r4 =  91.0,
 &end

# 30 ILE PSI:  (30 ILE N)-(30 ILE CA)-(30 ILE C)-(31 ILE N) 150.0 180.0
 &rst     iat =   492,   494,   509,   511,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 31 ILE PHI:  (30 ILE C)-(31 ILE N)-(31 ILE CA)-(31 ILE C) -140.0 -110.0
 &rst     iat =   509,   511,   513,   528,
   r1 = -141.0, r2 = -140.0, r3 = -110.0, r4 = -109.0,
 &end

# 31 ILE CHI1:  (31 ILE N)-(31 ILE CA)-(31 ILE CB)-(31 ILE CG1) -50.0 -30.0
 &rst     iat =   511,   513,   515,   521,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 ILE CHI21:  (31 ILE CA)-(31 ILE CB)-(31 ILE CG1)-(31 ILE CD1) -70.0 -50.0
 &rst     iat =   513,   515,   521,   524,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 31 ILE PSI:  (31 ILE N)-(31 ILE CA)-(31 ILE C)-(32 ALA N) 103.6 130.0
 &rst     iat =   511,   513,   528,   530,
   r1 = 102.6, r2 = 103.6, r3 = 130.0, r4 = 131.0,
 &end

# 32 ALA PHI:  (31 ILE C)-(32 ALA N)-(32 ALA CA)-(32 ALA C) -140.0 -110.0
 &rst     iat =   528,   530,   532,   538,
   r1 = -141.0, r2 = -140.0, r3 = -110.0, r4 = -109.0,
 &end

# 32 ALA PSI:  (32 ALA N)-(32 ALA CA)-(32 ALA C)-(33 ASN N) 140.0 166.6
 &rst     iat =   530,   532,   538,   540,
   r1 = 139.0, r2 = 140.0, r3 = 166.6, r4 = 167.6,
 &end

# 33 ASN PHI:  (32 ALA C)-(33 ASN N)-(33 ASN CA)-(33 ASN C) -90.0 -70.0
 &rst     iat =   538,   540,   542,   552,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 33 ASN CHI1:  (33 ASN N)-(33 ASN CA)-(33 ASN CB)-(33 ASN CG) -180.0  50.0
 &rst     iat =   540,   542,   544,   547,
   r1 = -181.0, r2 = -180.0, r3 =  50.0, r4 =  51.0,
 &end

# 33 ASN CHI2:  (33 ASN CA)-(33 ASN CB)-(33 ASN CG)-(33 ASN OD1) -30.0  30.0
 &rst     iat =   542,   544,   547,   548,
   r1 = -31.0, r2 = -30.0, r3 =  30.0, r4 =  31.0,
 &end

# 33 ASN PSI:  (33 ASN N)-(33 ASN CA)-(33 ASN C)-(34 ALA N) 106.7 130.0
 &rst     iat =   540,   542,   552,   554,
   r1 = 105.7, r2 = 106.7, r3 = 130.0, r4 = 131.0,
 &end

# 34 ALA PHI:  (33 ASN C)-(34 ALA N)-(34 ALA CA)-(34 ALA C) -100.0 -70.0
 &rst     iat =   552,   554,   556,   562,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 34 ALA PSI:  (34 ALA N)-(34 ALA CA)-(34 ALA C)-(35 ARG N) -20.0  10.0
 &rst     iat =   554,   556,   562,   564,
   r1 = -21.0, r2 = -20.0, r3 =  10.0, r4 =  11.0,
 &end

# 35 ARG PHI:  (34 ALA C)-(35 ARG N)-(35 ARG CA)-(35 ARG C) -100.0 -70.0
 &rst     iat =   562,   564,   566,   586,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 35 ARG CHI1:  (35 ARG N)-(35 ARG CA)-(35 ARG CB)-(35 ARG CG) -90.0 -40.0
 &rst     iat =   564,   566,   568,   571,
   r1 = -91.0, r2 = -90.0, r3 = -40.0, r4 = -39.0,
 &end

# 35 ARG CHI2:  (35 ARG CA)-(35 ARG CB)-(35 ARG CG)-(35 ARG CD) -90.0  80.0
 &rst     iat =   566,   568,   571,   574,
   r1 = -91.0, r2 = -90.0, r3 =  80.0, r4 =  81.0,
 &end

# 35 ARG CHI3:  (35 ARG CB)-(35 ARG CG)-(35 ARG CD)-(35 ARG NE) -290.0 -50.0
 &rst     iat =   568,   571,   574,   577,
   r1 = -291.0, r2 = -290.0, r3 = -50.0, r4 = -49.0,
 &end

# 35 ARG CHI4:  (35 ARG CG)-(35 ARG CD)-(35 ARG NE)-(35 ARG CZ)  70.0 290.0
 &rst     iat =   571,   574,   577,   579,
   r1 =  69.0, r2 =  70.0, r3 = 290.0, r4 = 291.0,
 &end

# 35 ARG PSI:  (35 ARG N)-(35 ARG CA)-(35 ARG C)-(36 VAL N) -46.0   6.0
 &rst     iat =   564,   566,   586,   588,
   r1 = -47.0, r2 = -46.0, r3 =   6.0, r4 =   7.0,
 &end

# 36 VAL PHI:  (35 ARG C)-(36 VAL N)-(36 VAL CA)-(36 VAL C) -130.0 -72.4
 &rst     iat =   586,   588,   590,   602,
   r1 = -131.0, r2 = -130.0, r3 = -72.4, r4 = -71.4,
 &end

# 36 VAL CHI1:  (36 VAL N)-(36 VAL CA)-(36 VAL CB)-(36 VAL CG1) -80.0  90.0
 &rst     iat =   588,   590,   592,   594,
   r1 = -81.0, r2 = -80.0, r3 =  90.0, r4 =  91.0,
 &end

# 36 VAL PSI:  (36 VAL N)-(36 VAL CA)-(36 VAL C)-(37 GLU N) 120.0 140.0
 &rst     iat =   588,   590,   602,   604,
   r1 = 119.0, r2 = 120.0, r3 = 140.0, r4 = 141.0,
 &end

# 37 GLU PHI:  (36 VAL C)-(37 GLU N)-(37 GLU CA)-(37 GLU C) -70.0 -50.0
 &rst     iat =   602,   604,   606,   617,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 37 GLU CHI1:  (37 GLU N)-(37 GLU CA)-(37 GLU CB)-(37 GLU CG)  40.0 210.0
 &rst     iat =   604,   606,   608,   611,
   r1 =  39.0, r2 =  40.0, r3 = 210.0, r4 = 211.0,
 &end

# 37 GLU CHI2:  (37 GLU CA)-(37 GLU CB)-(37 GLU CG)-(37 GLU CD)  50.0 250.0
 &rst     iat =   606,   608,   611,   614,
   r1 =  49.0, r2 =  50.0, r3 = 250.0, r4 = 251.0,
 &end

# 37 GLU PSI:  (37 GLU N)-(37 GLU CA)-(37 GLU C)-(38 ASN N) -40.0 -10.0
 &rst     iat =   604,   606,   617,   619,
   r1 = -41.0, r2 = -40.0, r3 = -10.0, r4 =  -9.0,
 &end

# 38 ASN PHI:  (37 GLU C)-(38 ASN N)-(38 ASN CA)-(38 ASN C) -100.0 -60.0
 &rst     iat =   617,   619,   621,   631,
   r1 = -101.0, r2 = -100.0, r3 = -60.0, r4 = -59.0,
 &end

# 38 ASN CHI1:  (38 ASN N)-(38 ASN CA)-(38 ASN CB)-(38 ASN CG) -180.0 -70.0
 &rst     iat =   619,   621,   623,   626,
   r1 = -181.0, r2 = -180.0, r3 = -70.0, r4 = -69.0,
 &end

# 38 ASN CHI2:  (38 ASN CA)-(38 ASN CB)-(38 ASN CG)-(38 ASN OD1) -130.0 130.0
 &rst     iat =   621,   623,   626,   627,
   r1 = -131.0, r2 = -130.0, r3 = 130.0, r4 = 131.0,
 &end

# 38 ASN PSI:  (38 ASN N)-(38 ASN CA)-(38 ASN C)-(39 CYS N) -30.0  10.0
 &rst     iat =   619,   621,   631,   633,
   r1 = -31.0, r2 = -30.0, r3 =  10.0, r4 =  11.0,
 &end

# 39 CYS PHI:  (38 ASN C)-(39 CYS N)-(39 CYS CA)-(39 CYS C)  30.0  60.0
 &rst     iat =   631,   633,   635,   642,
   r1 =  29.0, r2 =  30.0, r3 =  60.0, r4 =  61.0,
 &end

# 39 CYS CHI1:  (39 CYS N)-(39 CYS CA)-(39 CYS CB)-(39 CYS SG) -70.0  70.0
 &rst     iat =   633,   635,   637,   640,
   r1 = -71.0, r2 = -70.0, r3 =  70.0, r4 =  71.0,
 &end

# 39 CYS PSI:  (39 CYS N)-(39 CYS CA)-(39 CYS C)-(40 ALA N)  30.0  70.0
 &rst     iat =   633,   635,   642,   644,
   r1 =  29.0, r2 =  30.0, r3 =  70.0, r4 =  71.0,
 &end

# 40 ALA PHI:  (39 CYS C)-(40 ALA N)-(40 ALA CA)-(40 ALA C) -100.0 -70.0
 &rst     iat =   642,   644,   646,   652,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 40 ALA PSI:  (40 ALA N)-(40 ALA CA)-(40 ALA C)-(41 VAL N) 150.0 170.0
 &rst     iat =   644,   646,   652,   654,
   r1 = 149.0, r2 = 150.0, r3 = 170.0, r4 = 171.0,
 &end

# 41 VAL PHI:  (40 ALA C)-(41 VAL N)-(41 VAL CA)-(41 VAL C) -95.7 -80.0
 &rst     iat =   652,   654,   656,   668,
   r1 = -96.7, r2 = -95.7, r3 = -80.0, r4 = -79.0,
 &end

# 41 VAL CHI1:  (41 VAL N)-(41 VAL CA)-(41 VAL CB)-(41 VAL CG1) 170.0 180.0
 &rst     iat =   654,   656,   658,   660,
   r1 = 169.0, r2 = 170.0, r3 = 180.0, r4 = 181.0,
 &end

# 41 VAL PSI:  (41 VAL N)-(41 VAL CA)-(41 VAL C)-(42 ILE N)  90.0 130.0
 &rst     iat =   654,   656,   668,   670,
   r1 =  89.0, r2 =  90.0, r3 = 130.0, r4 = 131.0,
 &end

# 42 ILE PHI:  (41 VAL C)-(42 ILE N)-(42 ILE CA)-(42 ILE C) -100.0 -70.0
 &rst     iat =   668,   670,   672,   687,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 42 ILE CHI1:  (42 ILE N)-(42 ILE CA)-(42 ILE CB)-(42 ILE CG1)  50.0  70.0
 &rst     iat =   670,   672,   674,   680,
   r1 =  49.0, r2 =  50.0, r3 =  70.0, r4 =  71.0,
 &end

# 42 ILE CHI21:  (42 ILE CA)-(42 ILE CB)-(42 ILE CG1)-(42 ILE CD1) 160.0 190.0
 &rst     iat =   672,   674,   680,   683,
   r1 = 159.0, r2 = 160.0, r3 = 190.0, r4 = 191.0,
 &end

# 42 ILE PSI:  (42 ILE N)-(42 ILE CA)-(42 ILE C)-(43 TYR N) -30.0 -10.0
 &rst     iat =   670,   672,   687,   689,
   r1 = -31.0, r2 = -30.0, r3 = -10.0, r4 =  -9.0,
 &end

# 43 TYR PHI:  (42 ILE C)-(43 TYR N)-(43 TYR CA)-(43 TYR C) -170.0 -150.0
 &rst     iat =   687,   689,   691,   708,
   r1 = -171.0, r2 = -170.0, r3 = -150.0, r4 = -149.0,
 &end

# 43 TYR CHI1:  (43 TYR N)-(43 TYR CA)-(43 TYR CB)-(43 TYR CG) -170.0 -140.0
 &rst     iat =   689,   691,   693,   696,
   r1 = -171.0, r2 = -170.0, r3 = -140.0, r4 = -139.0,
 &end

# 43 TYR CHI2:  (43 TYR CA)-(43 TYR CB)-(43 TYR CG)-(43 TYR CD1)  80.0 280.0
 &rst     iat =   691,   693,   696,   697,
   r1 =  79.0, r2 =  80.0, r3 = 280.0, r4 = 281.0,
 &end

# 43 TYR PSI:  (43 TYR N)-(43 TYR CA)-(43 TYR C)-(44 CYS N) 150.0 159.6
 &rst     iat =   689,   691,   708,   710,
   r1 = 149.0, r2 = 150.0, r3 = 159.6, r4 = 160.6,
 &end

# 44 CYS PHI:  (43 TYR C)-(44 CYS N)-(44 CYS CA)-(44 CYS C) -160.0 -140.0
 &rst     iat =   708,   710,   712,   719,
   r1 = -161.0, r2 = -160.0, r3 = -140.0, r4 = -139.0,
 &end

# 44 CYS CHI1:  (44 CYS N)-(44 CYS CA)-(44 CYS CB)-(44 CYS SG) -90.0  60.0
 &rst     iat =   710,   712,   714,   717,
   r1 = -91.0, r2 = -90.0, r3 =  60.0, r4 =  61.0,
 &end

# 44 CYS PSI:  (44 CYS N)-(44 CYS CA)-(44 CYS C)-(45 ASN N) 140.0 160.0
 &rst     iat =   710,   712,   719,   721,
   r1 = 139.0, r2 = 140.0, r3 = 160.0, r4 = 161.0,
 &end

# 45 ASN PHI:  (44 CYS C)-(45 ASN N)-(45 ASN CA)-(45 ASN C) -100.0 -80.0
 &rst     iat =   719,   721,   723,   733,
   r1 = -101.0, r2 = -100.0, r3 = -80.0, r4 = -79.0,
 &end

# 45 ASN CHI1:  (45 ASN N)-(45 ASN CA)-(45 ASN CB)-(45 ASN CG) -160.0 -110.0
 &rst     iat =   721,   723,   725,   728,
   r1 = -161.0, r2 = -160.0, r3 = -110.0, r4 = -109.0,
 &end

# 45 ASN CHI2:  (45 ASN CA)-(45 ASN CB)-(45 ASN CG)-(45 ASN OD1)  50.0 260.0
 &rst     iat =   723,   725,   728,   729,
   r1 =  49.0, r2 =  50.0, r3 = 260.0, r4 = 261.0,
 &end

# 45 ASN PSI:  (45 ASN N)-(45 ASN CA)-(45 ASN C)-(46 ASP N) 150.0 190.0
 &rst     iat =   721,   723,   733,   735,
   r1 = 149.0, r2 = 150.0, r3 = 190.0, r4 = 191.0,
 &end

# 46 ASP PHI:  (45 ASN C)-(46 ASP N)-(46 ASP CA)-(46 ASP C) -81.0 -50.0
 &rst     iat =   733,   735,   737,   745,
   r1 = -82.0, r2 = -81.0, r3 = -50.0, r4 = -49.0,
 &end

# 46 ASP CHI1:  (46 ASP N)-(46 ASP CA)-(46 ASP CB)-(46 ASP CG) -190.0  80.0
 &rst     iat =   735,   737,   739,   742,
   r1 = -191.0, r2 = -190.0, r3 =  80.0, r4 =  81.0,
 &end

# 46 ASP PSI:  (46 ASP N)-(46 ASP CA)-(46 ASP C)-(47 GLY N) -50.0 -20.0
 &rst     iat =   735,   737,   745,   747,
   r1 = -51.0, r2 = -50.0, r3 = -20.0, r4 = -19.0,
 &end

# 47 GLY PHI:  (46 ASP C)-(47 GLY N)-(47 GLY CA)-(47 GLY C) -60.0 -40.0
 &rst     iat =   745,   747,   749,   752,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 47 GLY PSI:  (47 GLY N)-(47 GLY CA)-(47 GLY C)-(48 PHE N) -80.0 -50.0
 &rst     iat =   747,   749,   752,   754,
   r1 = -81.0, r2 = -80.0, r3 = -50.0, r4 = -49.0,
 &end

# 48 PHE PHI:  (47 GLY C)-(48 PHE N)-(48 PHE CA)-(48 PHE C) -70.0 -46.8
 &rst     iat =   752,   754,   756,   772,
   r1 = -71.0, r2 = -70.0, r3 = -46.8, r4 = -45.8,
 &end

# 48 PHE CHI1:  (48 PHE N)-(48 PHE CA)-(48 PHE CB)-(48 PHE CG) 100.0 130.0
 &rst     iat =   754,   756,   758,   761,
   r1 =  99.0, r2 = 100.0, r3 = 130.0, r4 = 131.0,
 &end

# 48 PHE CHI2:  (48 PHE CA)-(48 PHE CB)-(48 PHE CG)-(48 PHE CD1)  80.0 270.0
 &rst     iat =   756,   758,   761,   762,
   r1 =  79.0, r2 =  80.0, r3 = 270.0, r4 = 271.0,
 &end

# 48 PHE PSI:  (48 PHE N)-(48 PHE CA)-(48 PHE C)-(49 CYS N) -50.0 -30.0
 &rst     iat =   754,   756,   772,   774,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 49 CYS PHI:  (48 PHE C)-(49 CYS N)-(49 CYS CA)-(49 CYS C) -60.0 -50.0
 &rst     iat =   772,   774,   776,   783,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 49 CYS CHI1:  (49 CYS N)-(49 CYS CA)-(49 CYS CB)-(49 CYS SG) -170.0 -110.0
 &rst     iat =   774,   776,   778,   781,
   r1 = -171.0, r2 = -170.0, r3 = -110.0, r4 = -109.0,
 &end

# 49 CYS PSI:  (49 CYS N)-(49 CYS CA)-(49 CYS C)-(50 GLU N) -60.0 -40.0
 &rst     iat =   774,   776,   783,   785,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 50 GLU PHI:  (49 CYS C)-(50 GLU N)-(50 GLU CA)-(50 GLU C) -90.0 -70.0
 &rst     iat =   783,   785,   787,   798,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 50 GLU CHI1:  (50 GLU N)-(50 GLU CA)-(50 GLU CB)-(50 GLU CG) -60.0 -40.0
 &rst     iat =   785,   787,   789,   792,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 50 GLU CHI2:  (50 GLU CA)-(50 GLU CB)-(50 GLU CG)-(50 GLU CD) 170.0 190.0
 &rst     iat =   787,   789,   792,   795,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 50 GLU PSI:  (50 GLU N)-(50 GLU CA)-(50 GLU C)-(51 LEU N) -30.0 -10.0
 &rst     iat =   785,   787,   798,   800,
   r1 = -31.0, r2 = -30.0, r3 = -10.0, r4 =  -9.0,
 &end

# 51 LEU PHI:  (50 GLU C)-(51 LEU N)-(51 LEU CA)-(51 LEU C) -70.0 -50.0
 &rst     iat =   798,   800,   802,   817,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 51 LEU CHI1:  (51 LEU N)-(51 LEU CA)-(51 LEU CB)-(51 LEU CG) 170.0 190.0
 &rst     iat =   800,   802,   804,   807,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 51 LEU CHI2:  (51 LEU CA)-(51 LEU CB)-(51 LEU CG)-(51 LEU CD1)  40.0 110.0
 &rst     iat =   802,   804,   807,   809,
   r1 =  39.0, r2 =  40.0, r3 = 110.0, r4 = 111.0,
 &end

# 51 LEU PSI:  (51 LEU N)-(51 LEU CA)-(51 LEU C)-(52 CYS N) -55.7 -40.0
 &rst     iat =   800,   802,   817,   819,
   r1 = -56.7, r2 = -55.7, r3 = -40.0, r4 = -39.0,
 &end

# 52 CYS PHI:  (51 LEU C)-(52 CYS N)-(52 CYS CA)-(52 CYS C) -110.0 -80.0
 &rst     iat =   817,   819,   821,   828,
   r1 = -111.0, r2 = -110.0, r3 = -80.0, r4 = -79.0,
 &end

# 52 CYS CHI1:  (52 CYS N)-(52 CYS CA)-(52 CYS CB)-(52 CYS SG) -180.0  70.0
 &rst     iat =   819,   821,   823,   826,
   r1 = -181.0, r2 = -180.0, r3 =  70.0, r4 =  71.0,
 &end

# 52 CYS PSI:  (52 CYS N)-(52 CYS CA)-(52 CYS C)-(53 GLY N) -40.0 -20.0
 &rst     iat =   819,   821,   828,   830,
   r1 = -41.0, r2 = -40.0, r3 = -20.0, r4 = -19.0,
 &end

# 53 GLY PHI:  (52 CYS C)-(53 GLY N)-(53 GLY CA)-(53 GLY C)  50.0 100.0
 &rst     iat =   828,   830,   832,   835,
   r1 =  49.0, r2 =  50.0, r3 = 100.0, r4 = 101.0,
 &end

# 53 GLY PSI:  (53 GLY N)-(53 GLY CA)-(53 GLY C)-(54 TYR N)  10.0  57.0
 &rst     iat =   830,   832,   835,   837,
   r1 =   9.0, r2 =  10.0, r3 =  57.0, r4 =  58.0,
 &end

# 54 TYR PHI:  (53 GLY C)-(54 TYR N)-(54 TYR CA)-(54 TYR C) -140.0 -80.0
 &rst     iat =   835,   837,   839,   856,
   r1 = -141.0, r2 = -140.0, r3 = -80.0, r4 = -79.0,
 &end

# 54 TYR CHI1:  (54 TYR N)-(54 TYR CA)-(54 TYR CB)-(54 TYR CG) -110.0 -40.0
 &rst     iat =   837,   839,   841,   844,
   r1 = -111.0, r2 = -110.0, r3 = -40.0, r4 = -39.0,
 &end

# 54 TYR PSI:  (54 TYR N)-(54 TYR CA)-(54 TYR C)-(55 SER N) -130.0 -80.0
 &rst     iat =   837,   839,   856,   858,
   r1 = -131.0, r2 = -130.0, r3 = -80.0, r4 = -79.0,
 &end

# 55 SER PHI:  (54 TYR C)-(55 SER N)-(55 SER CA)-(55 SER C) 160.0 200.0
 &rst     iat =   856,   858,   860,   867,
   r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
 &end

# 55 SER CHI1:  (55 SER N)-(55 SER CA)-(55 SER CB)-(55 SER OG) -220.0  30.0
 &rst     iat =   858,   860,   862,   865,
   r1 = -221.0, r2 = -220.0, r3 =  30.0, r4 =  31.0,
 &end

# 55 SER PSI:  (55 SER N)-(55 SER CA)-(55 SER C)-(56 ARG N) 120.0 150.0
 &rst     iat =   858,   860,   867,   869,
   r1 = 119.0, r2 = 120.0, r3 = 150.0, r4 = 151.0,
 &end

# 56 ARG PHI:  (55 SER C)-(56 ARG N)-(56 ARG CA)-(56 ARG C) -70.0 -50.0
 &rst     iat =   867,   869,   871,   891,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 56 ARG CHI1:  (56 ARG N)-(56 ARG CA)-(56 ARG CB)-(56 ARG CG) -70.0 170.0
 &rst     iat =   869,   871,   873,   876,
   r1 = -71.0, r2 = -70.0, r3 = 170.0, r4 = 171.0,
 &end

# 56 ARG CHI2:  (56 ARG CA)-(56 ARG CB)-(56 ARG CG)-(56 ARG CD)  90.0 260.0
 &rst     iat =   871,   873,   876,   879,
   r1 =  89.0, r2 =  90.0, r3 = 260.0, r4 = 261.0,
 &end

# 56 ARG CHI3:  (56 ARG CB)-(56 ARG CG)-(56 ARG CD)-(56 ARG NE) -300.0 -50.0
 &rst     iat =   873,   876,   879,   882,
   r1 = -301.0, r2 = -300.0, r3 = -50.0, r4 = -49.0,
 &end

# 56 ARG CHI4:  (56 ARG CG)-(56 ARG CD)-(56 ARG NE)-(56 ARG CZ)  70.0 290.0
 &rst     iat =   876,   879,   882,   884,
   r1 =  69.0, r2 =  70.0, r3 = 290.0, r4 = 291.0,
 &end

# 56 ARG PSI:  (56 ARG N)-(56 ARG CA)-(56 ARG C)-(57 ALA N) -50.0 -30.0
 &rst     iat =   869,   871,   891,   893,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 57 ALA PHI:  (56 ARG C)-(57 ALA N)-(57 ALA CA)-(57 ALA C) -70.0 -50.0
 &rst     iat =   891,   893,   895,   901,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 57 ALA PSI:  (57 ALA N)-(57 ALA CA)-(57 ALA C)-(58 GLU N) -30.0 -16.7
 &rst     iat =   893,   895,   901,   903,
   r1 = -31.0, r2 = -30.0, r3 = -16.7, r4 = -15.7,
 &end

# 58 GLU PHI:  (57 ALA C)-(58 GLU N)-(58 GLU CA)-(58 GLU C) -100.0 -70.0
 &rst     iat =   901,   903,   905,   916,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 58 GLU CHI1:  (58 GLU N)-(58 GLU CA)-(58 GLU CB)-(58 GLU CG) -70.0  70.0
 &rst     iat =   903,   905,   907,   910,
   r1 = -71.0, r2 = -70.0, r3 =  70.0, r4 =  71.0,
 &end

# 58 GLU CHI2:  (58 GLU CA)-(58 GLU CB)-(58 GLU CG)-(58 GLU CD) -240.0 -70.0
 &rst     iat =   905,   907,   910,   913,
   r1 = -241.0, r2 = -240.0, r3 = -70.0, r4 = -69.0,
 &end

# 58 GLU PSI:  (58 GLU N)-(58 GLU CA)-(58 GLU C)-(59 VAL N) -30.0 -20.9
 &rst     iat =   903,   905,   916,   918,
   r1 = -31.0, r2 = -30.0, r3 = -20.9, r4 = -19.9,
 &end

# 59 VAL PHI:  (58 GLU C)-(59 VAL N)-(59 VAL CA)-(59 VAL C) -105.3 -90.0
 &rst     iat =   916,   918,   920,   932,
   r1 = -106.3, r2 = -105.3, r3 = -90.0, r4 = -89.0,
 &end

# 59 VAL CHI1:  (59 VAL N)-(59 VAL CA)-(59 VAL CB)-(59 VAL CG1) -70.0 -40.0
 &rst     iat =   918,   920,   922,   924,
   r1 = -71.0, r2 = -70.0, r3 = -40.0, r4 = -39.0,
 &end

# 59 VAL PSI:  (59 VAL N)-(59 VAL CA)-(59 VAL C)-(60 MET N) -20.0  20.0
 &rst     iat =   918,   920,   932,   934,
   r1 = -21.0, r2 = -20.0, r3 =  20.0, r4 =  21.0,
 &end

# 60 MET PHI:  (59 VAL C)-(60 MET N)-(60 MET CA)-(60 MET C) -70.0 -50.0
 &rst     iat =   932,   934,   936,   949,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 60 MET CHI1:  (60 MET N)-(60 MET CA)-(60 MET CB)-(60 MET CG) -100.0 -70.0
 &rst     iat =   934,   936,   938,   941,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 60 MET CHI2:  (60 MET CA)-(60 MET CB)-(60 MET CG)-(60 MET SD) -70.0 -60.0
 &rst     iat =   936,   938,   941,   944,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 60 MET CHI3:  (60 MET CB)-(60 MET CG)-(60 MET SD)-(60 MET CE)  90.0 110.0
 &rst     iat =   938,   941,   944,   945,
   r1 =  89.0, r2 =  90.0, r3 = 110.0, r4 = 111.0,
 &end

# 60 MET PSI:  (60 MET N)-(60 MET CA)-(60 MET C)-(61 GLN N) 100.0 120.0
 &rst     iat =   934,   936,   949,   951,
   r1 =  99.0, r2 = 100.0, r3 = 120.0, r4 = 121.0,
 &end

# 61 GLN PHI:  (60 MET C)-(61 GLN N)-(61 GLN CA)-(61 GLN C)  60.0  80.0
 &rst     iat =   949,   951,   953,   966,
   r1 =  59.0, r2 =  60.0, r3 =  80.0, r4 =  81.0,
 &end

# 61 GLN CHI1:  (61 GLN N)-(61 GLN CA)-(61 GLN CB)-(61 GLN CG) -50.0 -40.0
 &rst     iat =   951,   953,   955,   958,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 61 GLN CHI2:  (61 GLN CA)-(61 GLN CB)-(61 GLN CG)-(61 GLN CD) 140.0 150.0
 &rst     iat =   953,   955,   958,   961,
   r1 = 139.0, r2 = 140.0, r3 = 150.0, r4 = 151.0,
 &end

# 61 GLN CHI3:  (61 GLN CB)-(61 GLN CG)-(61 GLN CD)-(61 GLN OE1)  40.0 110.0
 &rst     iat =   955,   958,   961,   962,
   r1 =  39.0, r2 =  40.0, r3 = 110.0, r4 = 111.0,
 &end

# 61 GLN PSI:  (61 GLN N)-(61 GLN CA)-(61 GLN C)-(62 ARG N)  12.0  40.0
 &rst     iat =   951,   953,   966,   968,
   r1 =  11.0, r2 =  12.0, r3 =  40.0, r4 =  41.0,
 &end

# 62 ARG PHI:  (61 GLN C)-(62 ARG N)-(62 ARG CA)-(62 ARG C) -120.0 -70.0
 &rst     iat =   966,   968,   970,   990,
   r1 = -121.0, r2 = -120.0, r3 = -70.0, r4 = -69.0,
 &end

# 62 ARG CHI1:  (62 ARG N)-(62 ARG CA)-(62 ARG CB)-(62 ARG CG) -100.0 -60.0
 &rst     iat =   968,   970,   972,   975,
   r1 = -101.0, r2 = -100.0, r3 = -60.0, r4 = -59.0,
 &end

# 62 ARG CHI2:  (62 ARG CA)-(62 ARG CB)-(62 ARG CG)-(62 ARG CD)  50.0 240.0
 &rst     iat =   970,   972,   975,   978,
   r1 =  49.0, r2 =  50.0, r3 = 240.0, r4 = 241.0,
 &end

# 62 ARG CHI3:  (62 ARG CB)-(62 ARG CG)-(62 ARG CD)-(62 ARG NE) -100.0  70.0
 &rst     iat =   972,   975,   978,   981,
   r1 = -101.0, r2 = -100.0, r3 =  70.0, r4 =  71.0,
 &end

# 62 ARG CHI4:  (62 ARG CG)-(62 ARG CD)-(62 ARG NE)-(62 ARG CZ) -190.0 -70.0
 &rst     iat =   975,   978,   981,   983,
   r1 = -191.0, r2 = -190.0, r3 = -70.0, r4 = -69.0,
 &end

# 62 ARG PSI:  (62 ARG N)-(62 ARG CA)-(62 ARG C)-(63 PRO N) 150.0 170.0
 &rst     iat =   968,   970,   990,   992,
   r1 = 149.0, r2 = 150.0, r3 = 170.0, r4 = 171.0,
 &end

# 63 PRO PSI:  (63 PRO N)-(63 PRO CA)-(63 PRO C)-(64 CYS N) 110.0 140.0
 &rst     iat =   992,  1002,  1004,  1006,
   r1 = 109.0, r2 = 110.0, r3 = 140.0, r4 = 141.0,
 &end

# 64 CYS PHI:  (63 PRO C)-(64 CYS N)-(64 CYS CA)-(64 CYS C) -70.0 -47.8
 &rst     iat =  1004,  1006,  1008,  1015,
   r1 = -71.0, r2 = -70.0, r3 = -47.8, r4 = -46.8,
 &end

# 64 CYS CHI1:  (64 CYS N)-(64 CYS CA)-(64 CYS CB)-(64 CYS SG) -180.0  50.0
 &rst     iat =  1006,  1008,  1010,  1013,
   r1 = -181.0, r2 = -180.0, r3 =  50.0, r4 =  51.0,
 &end

# 64 CYS PSI:  (64 CYS N)-(64 CYS CA)-(64 CYS C)-(65 THR N) -30.0 -10.0
 &rst     iat =  1006,  1008,  1015,  1017,
   r1 = -31.0, r2 = -30.0, r3 = -10.0, r4 =  -9.0,
 &end

# 65 THR PHI:  (64 CYS C)-(65 THR N)-(65 THR CA)-(65 THR C) -70.0 -40.0
 &rst     iat =  1015,  1017,  1019,  1029,
   r1 = -71.0, r2 = -70.0, r3 = -40.0, r4 = -39.0,
 &end

# 65 THR CHI1:  (65 THR N)-(65 THR CA)-(65 THR CB)-(65 THR OG1) -40.0  20.0
 &rst     iat =  1017,  1019,  1021,  1027,
   r1 = -41.0, r2 = -40.0, r3 =  20.0, r4 =  21.0,
 &end

# 65 THR PSI:  (65 THR N)-(65 THR CA)-(65 THR C)-(66 CYS N)  80.0 100.0
 &rst     iat =  1017,  1019,  1029,  1031,
   r1 =  79.0, r2 =  80.0, r3 = 100.0, r4 = 101.0,
 &end

# 66 CYS PHI:  (65 THR C)-(66 CYS N)-(66 CYS CA)-(66 CYS C) -70.0 -50.0
 &rst     iat =  1029,  1031,  1033,  1040,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 66 CYS CHI1:  (66 CYS N)-(66 CYS CA)-(66 CYS CB)-(66 CYS SG) -140.0  80.0
 &rst     iat =  1031,  1033,  1035,  1038,
   r1 = -141.0, r2 = -140.0, r3 =  80.0, r4 =  81.0,
 &end

# 66 CYS PSI:  (66 CYS N)-(66 CYS CA)-(66 CYS C)-(67 ASP N) -30.0 -13.2
 &rst     iat =  1031,  1033,  1040,  1042,
   r1 = -31.0, r2 = -30.0, r3 = -13.2, r4 = -12.2,
 &end

# 67 ASP PHI:  (66 CYS C)-(67 ASP N)-(67 ASP CA)-(67 ASP C) -60.0 -46.5
 &rst     iat =  1040,  1042,  1044,  1052,
   r1 = -61.0, r2 = -60.0, r3 = -46.5, r4 = -45.5,
 &end

# 67 ASP CHI1:  (67 ASP N)-(67 ASP CA)-(67 ASP CB)-(67 ASP CG) -60.0 190.0
 &rst     iat =  1042,  1044,  1046,  1049,
   r1 = -61.0, r2 = -60.0, r3 = 190.0, r4 = 191.0,
 &end

# 67 ASP PSI:  (67 ASP N)-(67 ASP CA)-(67 ASP C)-(68 PHE N) -50.0 -10.0
 &rst     iat =  1042,  1044,  1052,  1054,
   r1 = -51.0, r2 = -50.0, r3 = -10.0, r4 =  -9.0,
 &end

# 68 PHE PHI:  (67 ASP C)-(68 PHE N)-(68 PHE CA)-(68 PHE C) -70.0 -50.0
 &rst     iat =  1052,  1054,  1056,  1072,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 68 PHE CHI1:  (68 PHE N)-(68 PHE CA)-(68 PHE CB)-(68 PHE CG) -280.0 -70.0
 &rst     iat =  1054,  1056,  1058,  1061,
   r1 = -281.0, r2 = -280.0, r3 = -70.0, r4 = -69.0,
 &end

# 68 PHE CHI2:  (68 PHE CA)-(68 PHE CB)-(68 PHE CG)-(68 PHE CD1) -130.0 120.0
 &rst     iat =  1056,  1058,  1061,  1062,
   r1 = -131.0, r2 = -130.0, r3 = 120.0, r4 = 121.0,
 &end

# 68 PHE PSI:  (68 PHE N)-(68 PHE CA)-(68 PHE C)-(69 LEU N) -24.8 -10.0
 &rst     iat =  1054,  1056,  1072,  1074,
   r1 = -25.8, r2 = -24.8, r3 = -10.0, r4 =  -9.0,
 &end

# 69 LEU PHI:  (68 PHE C)-(69 LEU N)-(69 LEU CA)-(69 LEU C) -123.0 -90.0
 &rst     iat =  1072,  1074,  1076,  1091,
   r1 = -124.0, r2 = -123.0, r3 = -90.0, r4 = -89.0,
 &end

# 69 LEU CHI1:  (69 LEU N)-(69 LEU CA)-(69 LEU CB)-(69 LEU CG)  40.0 230.0
 &rst     iat =  1074,  1076,  1078,  1081,
   r1 =  39.0, r2 =  40.0, r3 = 230.0, r4 = 231.0,
 &end

# 69 LEU CHI2:  (69 LEU CA)-(69 LEU CB)-(69 LEU CG)-(69 LEU CD1) -80.0 120.0
 &rst     iat =  1076,  1078,  1081,  1083,
   r1 = -81.0, r2 = -80.0, r3 = 120.0, r4 = 121.0,
 &end

# 69 LEU PSI:  (69 LEU N)-(69 LEU CA)-(69 LEU C)-(70 HIE N)  20.0  40.0
 &rst     iat =  1074,  1076,  1091,  1093,
   r1 =  19.0, r2 =  20.0, r3 =  40.0, r4 =  41.0,
 &end

# 70 HIS PHI:  (69 LEU C)-(70 HIE N)-(70 HIE CA)-(70 HIE C) -100.0 -50.0
 &rst     iat =  1091,  1093,  1095,  1108,
   r1 = -101.0, r2 = -100.0, r3 = -50.0, r4 = -49.0,
 &end

# 70 HIS CHI1:  (70 HIE N)-(70 HIE CA)-(70 HIE CB)-(70 HIE CG) -100.0  90.0
 &rst     iat =  1093,  1095,  1097,  1100,
   r1 = -101.0, r2 = -100.0, r3 =  90.0, r4 =  91.0,
 &end

# 70 HIS CHI2:  (70 HIE CA)-(70 HIE CB)-(70 HIE CG)-(70 HIE ND1) -240.0  10.0
 &rst     iat =  1095,  1097,  1100,  1101,
   r1 = -241.0, r2 = -240.0, r3 =  10.0, r4 =  11.0,
 &end

# 70 HIS PSI:  (70 HIE N)-(70 HIE CA)-(70 HIE C)-(71 GLY N) 130.0 180.0
 &rst     iat =  1093,  1095,  1108,  1110,
   r1 = 129.0, r2 = 130.0, r3 = 180.0, r4 = 181.0,
 &end

# 71 GLY PHI:  (70 HIE C)-(71 GLY N)-(71 GLY CA)-(71 GLY C) -135.7 -80.0
 &rst     iat =  1108,  1110,  1112,  1115,
   r1 = -136.7, r2 = -135.7, r3 = -80.0, r4 = -79.0,
 &end

# 71 GLY PSI:  (71 GLY N)-(71 GLY CA)-(71 GLY C)-(72 PRO N) -190.0 -160.0
 &rst     iat =  1110,  1112,  1115,  1117,
   r1 = -191.0, r2 = -190.0, r3 = -160.0, r4 = -159.0,
 &end

# 72 PRO PSI:  (72 PRO N)-(72 PRO CA)-(72 PRO C)-(73 ARG N) -10.0  -4.5
 &rst     iat =  1117,  1127,  1129,  1131,
   r1 = -11.0, r2 = -10.0, r3 =  -4.5, r4 =  -3.5,
 &end

# 73 ARG PHI:  (72 PRO C)-(73 ARG N)-(73 ARG CA)-(73 ARG C) -110.0 -90.0
 &rst     iat =  1129,  1131,  1133,  1153,
   r1 = -111.0, r2 = -110.0, r3 = -90.0, r4 = -89.0,
 &end

# 73 ARG CHI1:  (73 ARG N)-(73 ARG CA)-(73 ARG CB)-(73 ARG CG) -180.0 -70.0
 &rst     iat =  1131,  1133,  1135,  1138,
   r1 = -181.0, r2 = -180.0, r3 = -70.0, r4 = -69.0,
 &end

# 73 ARG CHI2:  (73 ARG CA)-(73 ARG CB)-(73 ARG CG)-(73 ARG CD)  50.0 300.0
 &rst     iat =  1133,  1135,  1138,  1141,
   r1 =  49.0, r2 =  50.0, r3 = 300.0, r4 = 301.0,
 &end

# 73 ARG CHI3:  (73 ARG CB)-(73 ARG CG)-(73 ARG CD)-(73 ARG NE) -280.0 -60.0
 &rst     iat =  1135,  1138,  1141,  1144,
   r1 = -281.0, r2 = -280.0, r3 = -60.0, r4 = -59.0,
 &end

# 73 ARG CHI4:  (73 ARG CG)-(73 ARG CD)-(73 ARG NE)-(73 ARG CZ)  60.0 300.0
 &rst     iat =  1138,  1141,  1144,  1146,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 73 ARG PSI:  (73 ARG N)-(73 ARG CA)-(73 ARG C)-(74 THR N) -10.0   0.0
 &rst     iat =  1131,  1133,  1153,  1155,
   r1 = -11.0, r2 = -10.0, r3 =   0.0, r4 =   1.0,
 &end

# 74 THR PHI:  (73 ARG C)-(74 THR N)-(74 THR CA)-(74 THR C) -100.0 -60.0
 &rst     iat =  1153,  1155,  1157,  1167,
   r1 = -101.0, r2 = -100.0, r3 = -60.0, r4 = -59.0,
 &end

# 74 THR CHI1:  (74 THR N)-(74 THR CA)-(74 THR CB)-(74 THR OG1) -50.0 -20.0
 &rst     iat =  1155,  1157,  1159,  1165,
   r1 = -51.0, r2 = -50.0, r3 = -20.0, r4 = -19.0,
 &end

# 74 THR PSI:  (74 THR N)-(74 THR CA)-(74 THR C)-(75 GLN N) 130.0 170.0
 &rst     iat =  1155,  1157,  1167,  1169,
   r1 = 129.0, r2 = 130.0, r3 = 170.0, r4 = 171.0,
 &end

# 75 GLN PHI:  (74 THR C)-(75 GLN N)-(75 GLN CA)-(75 GLN C) -120.0 -80.0
 &rst     iat =  1167,  1169,  1171,  1184,
   r1 = -121.0, r2 = -120.0, r3 = -80.0, r4 = -79.0,
 &end

# 75 GLN CHI1:  (75 GLN N)-(75 GLN CA)-(75 GLN CB)-(75 GLN CG) -70.0 -40.0
 &rst     iat =  1169,  1171,  1173,  1176,
   r1 = -71.0, r2 = -70.0, r3 = -40.0, r4 = -39.0,
 &end

# 75 GLN CHI2:  (75 GLN CA)-(75 GLN CB)-(75 GLN CG)-(75 GLN CD) -230.0 -40.0
 &rst     iat =  1171,  1173,  1176,  1179,
   r1 = -231.0, r2 = -230.0, r3 = -40.0, r4 = -39.0,
 &end

# 75 GLN CHI3:  (75 GLN CB)-(75 GLN CG)-(75 GLN CD)-(75 GLN OE1) -100.0 140.0
 &rst     iat =  1173,  1176,  1179,  1180,
   r1 = -101.0, r2 = -100.0, r3 = 140.0, r4 = 141.0,
 &end

# 75 GLN PSI:  (75 GLN N)-(75 GLN CA)-(75 GLN C)-(76 ARG N) 130.0 150.0
 &rst     iat =  1169,  1171,  1184,  1186,
   r1 = 129.0, r2 = 130.0, r3 = 150.0, r4 = 151.0,
 &end

# 76 ARG PHI:  (75 GLN C)-(76 ARG N)-(76 ARG CA)-(76 ARG C) -70.0 -50.0
 &rst     iat =  1184,  1186,  1188,  1208,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 76 ARG CHI1:  (76 ARG N)-(76 ARG CA)-(76 ARG CB)-(76 ARG CG) -50.0 -40.0
 &rst     iat =  1186,  1188,  1190,  1193,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 76 ARG CHI2:  (76 ARG CA)-(76 ARG CB)-(76 ARG CG)-(76 ARG CD) -60.0 110.0
 &rst     iat =  1188,  1190,  1193,  1196,
   r1 = -61.0, r2 = -60.0, r3 = 110.0, r4 = 111.0,
 &end

# 76 ARG CHI3:  (76 ARG CB)-(76 ARG CG)-(76 ARG CD)-(76 ARG NE) -260.0 -50.0
 &rst     iat =  1190,  1193,  1196,  1199,
   r1 = -261.0, r2 = -260.0, r3 = -50.0, r4 = -49.0,
 &end

# 76 ARG CHI4:  (76 ARG CG)-(76 ARG CD)-(76 ARG NE)-(76 ARG CZ) -290.0 -70.0
 &rst     iat =  1193,  1196,  1199,  1201,
   r1 = -291.0, r2 = -290.0, r3 = -70.0, r4 = -69.0,
 &end

# 76 ARG PSI:  (76 ARG N)-(76 ARG CA)-(76 ARG C)-(77 ARG N) -60.0 -40.0
 &rst     iat =  1186,  1188,  1208,  1210,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 77 ARG PHI:  (76 ARG C)-(77 ARG N)-(77 ARG CA)-(77 ARG C) -60.0 -41.0
 &rst     iat =  1208,  1210,  1212,  1232,
   r1 = -61.0, r2 = -60.0, r3 = -41.0, r4 = -40.0,
 &end

# 77 ARG CHI1:  (77 ARG N)-(77 ARG CA)-(77 ARG CB)-(77 ARG CG)  50.0  70.0
 &rst     iat =  1210,  1212,  1214,  1217,
   r1 =  49.0, r2 =  50.0, r3 =  70.0, r4 =  71.0,
 &end

# 77 ARG CHI2:  (77 ARG CA)-(77 ARG CB)-(77 ARG CG)-(77 ARG CD) 100.0 220.0
 &rst     iat =  1212,  1214,  1217,  1220,
   r1 =  99.0, r2 = 100.0, r3 = 220.0, r4 = 221.0,
 &end

# 77 ARG CHI3:  (77 ARG CB)-(77 ARG CG)-(77 ARG CD)-(77 ARG NE)  50.0 280.0
 &rst     iat =  1214,  1217,  1220,  1223,
   r1 =  49.0, r2 =  50.0, r3 = 280.0, r4 = 281.0,
 &end

# 77 ARG CHI4:  (77 ARG CG)-(77 ARG CD)-(77 ARG NE)-(77 ARG CZ)  70.0 290.0
 &rst     iat =  1217,  1220,  1223,  1225,
   r1 =  69.0, r2 =  70.0, r3 = 290.0, r4 = 291.0,
 &end

# 77 ARG PSI:  (77 ARG N)-(77 ARG CA)-(77 ARG C)-(78 ALA N) -50.0 -30.0
 &rst     iat =  1210,  1212,  1232,  1234,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 78 ALA PHI:  (77 ARG C)-(78 ALA N)-(78 ALA CA)-(78 ALA C) -70.0 -60.0
 &rst     iat =  1232,  1234,  1236,  1242,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 78 ALA PSI:  (78 ALA N)-(78 ALA CA)-(78 ALA C)-(79 ALA N) -60.0 -50.0
 &rst     iat =  1234,  1236,  1242,  1244,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 79 ALA PHI:  (78 ALA C)-(79 ALA N)-(79 ALA CA)-(79 ALA C) -70.0 -50.0
 &rst     iat =  1242,  1244,  1246,  1252,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 79 ALA PSI:  (79 ALA N)-(79 ALA CA)-(79 ALA C)-(80 ALA N) -50.0 -30.0
 &rst     iat =  1244,  1246,  1252,  1254,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 80 ALA PHI:  (79 ALA C)-(80 ALA N)-(80 ALA CA)-(80 ALA C) -70.0 -60.0
 &rst     iat =  1252,  1254,  1256,  1262,
   r1 = -71.0, r2 = -70.0, r3 = -60.0, r4 = -59.0,
 &end

# 80 ALA PSI:  (80 ALA N)-(80 ALA CA)-(80 ALA C)-(81 GLN N) -59.0 -50.0
 &rst     iat =  1254,  1256,  1262,  1264,
   r1 = -60.0, r2 = -59.0, r3 = -50.0, r4 = -49.0,
 &end

# 81 GLN PHI:  (80 ALA C)-(81 GLN N)-(81 GLN CA)-(81 GLN C) -50.0 -45.4
 &rst     iat =  1262,  1264,  1266,  1279,
   r1 = -51.0, r2 = -50.0, r3 = -45.4, r4 = -44.4,
 &end

# 81 GLN CHI1:  (81 GLN N)-(81 GLN CA)-(81 GLN CB)-(81 GLN CG) -170.0 -60.0
 &rst     iat =  1264,  1266,  1268,  1271,
   r1 = -171.0, r2 = -170.0, r3 = -60.0, r4 = -59.0,
 &end

# 81 GLN CHI2:  (81 GLN CA)-(81 GLN CB)-(81 GLN CG)-(81 GLN CD)  60.0 290.0
 &rst     iat =  1266,  1268,  1271,  1274,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &end

# 81 GLN CHI3:  (81 GLN CB)-(81 GLN CG)-(81 GLN CD)-(81 GLN OE1) -130.0 130.0
 &rst     iat =  1268,  1271,  1274,  1275,
   r1 = -131.0, r2 = -130.0, r3 = 130.0, r4 = 131.0,
 &end

# 81 GLN PSI:  (81 GLN N)-(81 GLN CA)-(81 GLN C)-(82 ILE N) -50.0 -40.0
 &rst     iat =  1264,  1266,  1279,  1281,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 82 ILE PHI:  (81 GLN C)-(82 ILE N)-(82 ILE CA)-(82 ILE C) -70.0 -50.0
 &rst     iat =  1279,  1281,  1283,  1298,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 82 ILE CHI1:  (82 ILE N)-(82 ILE CA)-(82 ILE CB)-(82 ILE CG1) -90.0 -70.0
 &rst     iat =  1281,  1283,  1285,  1291,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 82 ILE CHI21:  (82 ILE CA)-(82 ILE CB)-(82 ILE CG1)-(82 ILE CD1) 150.0 180.0
 &rst     iat =  1283,  1285,  1291,  1294,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 82 ILE PSI:  (82 ILE N)-(82 ILE CA)-(82 ILE C)-(83 ALA N) -60.0 -40.0
 &rst     iat =  1281,  1283,  1298,  1300,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 83 ALA PHI:  (82 ILE C)-(83 ALA N)-(83 ALA CA)-(83 ALA C) -60.0 -40.8
 &rst     iat =  1298,  1300,  1302,  1308,
   r1 = -61.0, r2 = -60.0, r3 = -40.8, r4 = -39.8,
 &end

# 83 ALA PSI:  (83 ALA N)-(83 ALA CA)-(83 ALA C)-(84 GLN N) -50.0 -40.0
 &rst     iat =  1300,  1302,  1308,  1310,
   r1 = -51.0, r2 = -50.0, r3 = -40.0, r4 = -39.0,
 &end

# 84 GLN PHI:  (83 ALA C)-(84 GLN N)-(84 GLN CA)-(84 GLN C) -80.0 -60.0
 &rst     iat =  1308,  1310,  1312,  1325,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 84 GLN CHI1:  (84 GLN N)-(84 GLN CA)-(84 GLN CB)-(84 GLN CG) -50.0 -30.0
 &rst     iat =  1310,  1312,  1314,  1317,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 84 GLN CHI2:  (84 GLN CA)-(84 GLN CB)-(84 GLN CG)-(84 GLN CD) -50.0 -30.0
 &rst     iat =  1312,  1314,  1317,  1320,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 84 GLN CHI3:  (84 GLN CB)-(84 GLN CG)-(84 GLN CD)-(84 GLN OE1) -80.0 -60.0
 &rst     iat =  1314,  1317,  1320,  1321,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 84 GLN PSI:  (84 GLN N)-(84 GLN CA)-(84 GLN C)-(85 ALA N) -50.0 -30.0
 &rst     iat =  1310,  1312,  1325,  1327,
   r1 = -51.0, r2 = -50.0, r3 = -30.0, r4 = -29.0,
 &end

# 85 ALA PHI:  (84 GLN C)-(85 ALA N)-(85 ALA CA)-(85 ALA C) -70.0 -50.0
 &rst     iat =  1325,  1327,  1329,  1335,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 85 ALA PSI:  (85 ALA N)-(85 ALA CA)-(85 ALA C)-(86 LEU N) -50.0 -12.0
 &rst     iat =  1327,  1329,  1335,  1337,
   r1 = -51.0, r2 = -50.0, r3 = -12.0, r4 = -11.0,
 &end

# 86 LEU PHI:  (85 ALA C)-(86 LEU N)-(86 LEU CA)-(86 LEU C) -90.0 -80.0
 &rst     iat =  1335,  1337,  1339,  1354,
   r1 = -91.0, r2 = -90.0, r3 = -80.0, r4 = -79.0,
 &end

# 86 LEU CHI1:  (86 LEU N)-(86 LEU CA)-(86 LEU CB)-(86 LEU CG) -70.0 -30.0
 &rst     iat =  1337,  1339,  1341,  1344,
   r1 = -71.0, r2 = -70.0, r3 = -30.0, r4 = -29.0,
 &end

# 86 LEU CHI2:  (86 LEU CA)-(86 LEU CB)-(86 LEU CG)-(86 LEU CD1) -180.0 -140.0
 &rst     iat =  1339,  1341,  1344,  1346,
   r1 = -181.0, r2 = -180.0, r3 = -140.0, r4 = -139.0,
 &end

# 86 LEU PSI:  (86 LEU N)-(86 LEU CA)-(86 LEU C)-(87 LEU N) -50.0 -10.0
 &rst     iat =  1337,  1339,  1354,  1356,
   r1 = -51.0, r2 = -50.0, r3 = -10.0, r4 =  -9.0,
 &end

# 87 LEU PHI:  (86 LEU C)-(87 LEU N)-(87 LEU CA)-(87 LEU C) -80.0 -50.0
 &rst     iat =  1354,  1356,  1358,  1373,
   r1 = -81.0, r2 = -80.0, r3 = -50.0, r4 = -49.0,
 &end

# 87 LEU CHI1:  (87 LEU N)-(87 LEU CA)-(87 LEU CB)-(87 LEU CG)  40.0 150.0
 &rst     iat =  1356,  1358,  1360,  1363,
   r1 =  39.0, r2 =  40.0, r3 = 150.0, r4 = 151.0,
 &end

# 87 LEU CHI2:  (87 LEU CA)-(87 LEU CB)-(87 LEU CG)-(87 LEU CD1) 100.0 160.0
 &rst     iat =  1358,  1360,  1363,  1365,
   r1 =  99.0, r2 = 100.0, r3 = 160.0, r4 = 161.0,
 &end

# 87 LEU PSI:  (87 LEU N)-(87 LEU CA)-(87 LEU C)-(88 GLY N) -40.0 -20.0
 &rst     iat =  1356,  1358,  1373,  1375,
   r1 = -41.0, r2 = -40.0, r3 = -20.0, r4 = -19.0,
 &end

# 88 GLY PHI:  (87 LEU C)-(88 GLY N)-(88 GLY CA)-(88 GLY C) 110.0 150.0
 &rst     iat =  1373,  1375,  1377,  1380,
   r1 = 109.0, r2 = 110.0, r3 = 150.0, r4 = 151.0,
 &end

# 88 GLY PSI:  (88 GLY N)-(88 GLY CA)-(88 GLY C)-(89 ALA N) -17.4  30.0
 &rst     iat =  1375,  1377,  1380,  1382,
   r1 = -18.4, r2 = -17.4, r3 =  30.0, r4 =  31.0,
 &end

# 89 ALA PHI:  (88 GLY C)-(89 ALA N)-(89 ALA CA)-(89 ALA C) -90.0 -40.0
 &rst     iat =  1380,  1382,  1384,  1390,
   r1 = -91.0, r2 = -90.0, r3 = -40.0, r4 = -39.0,
 &end

# 89 ALA PSI:  (89 ALA N)-(89 ALA CA)-(89 ALA C)-(90 GLU N) -80.0 -50.0
 &rst     iat =  1382,  1384,  1390,  1392,
   r1 = -81.0, r2 = -80.0, r3 = -50.0, r4 = -49.0,
 &end

# 90 GLU PHI:  (89 ALA C)-(90 GLU N)-(90 GLU CA)-(90 GLU C) -190.0 -140.0
 &rst     iat =  1390,  1392,  1394,  1405,
   r1 = -191.0, r2 = -190.0, r3 = -140.0, r4 = -139.0,
 &end

# 90 GLU CHI1:  (90 GLU N)-(90 GLU CA)-(90 GLU CB)-(90 GLU CG) -60.0  70.0
 &rst     iat =  1392,  1394,  1396,  1399,
   r1 = -61.0, r2 = -60.0, r3 =  70.0, r4 =  71.0,
 &end

# 90 GLU CHI2:  (90 GLU CA)-(90 GLU CB)-(90 GLU CG)-(90 GLU CD) -230.0 -70.0
 &rst     iat =  1394,  1396,  1399,  1402,
   r1 = -231.0, r2 = -230.0, r3 = -70.0, r4 = -69.0,
 &end

# 90 GLU PSI:  (90 GLU N)-(90 GLU CA)-(90 GLU C)-(91 GLU N) 130.0 200.0
 &rst     iat =  1392,  1394,  1405,  1407,
   r1 = 129.0, r2 = 130.0, r3 = 200.0, r4 = 201.0,
 &end

# 91 GLU PHI:  (90 GLU C)-(91 GLU N)-(91 GLU CA)-(91 GLU C) -150.0 -50.0
 &rst     iat =  1405,  1407,  1409,  1420,
   r1 = -151.0, r2 = -150.0, r3 = -50.0, r4 = -49.0,
 &end

# 91 GLU CHI1:  (91 GLU N)-(91 GLU CA)-(91 GLU CB)-(91 GLU CG) -200.0 -80.0
 &rst     iat =  1407,  1409,  1411,  1414,
   r1 = -201.0, r2 = -200.0, r3 = -80.0, r4 = -79.0,
 &end

# 91 GLU CHI2:  (91 GLU CA)-(91 GLU CB)-(91 GLU CG)-(91 GLU CD) -110.0 100.0
 &rst     iat =  1409,  1411,  1414,  1417,
   r1 = -111.0, r2 = -110.0, r3 = 100.0, r4 = 101.0,
 &end

# 91 GLU PSI:  (91 GLU N)-(91 GLU CA)-(91 GLU C)-(92 ARG N)  99.5 130.0
 &rst     iat =  1407,  1409,  1420,  1422,
   r1 =  98.5, r2 =  99.5, r3 = 130.0, r4 = 131.0,
 &end

# 92 ARG PHI:  (91 GLU C)-(92 ARG N)-(92 ARG CA)-(92 ARG C) -160.0 -130.0
 &rst     iat =  1420,  1422,  1424,  1444,
   r1 = -161.0, r2 = -160.0, r3 = -130.0, r4 = -129.0,
 &end

# 92 ARG CHI1:  (92 ARG N)-(92 ARG CA)-(92 ARG CB)-(92 ARG CG) -190.0 -120.0
 &rst     iat =  1422,  1424,  1426,  1429,
   r1 = -191.0, r2 = -190.0, r3 = -120.0, r4 = -119.0,
 &end

# 92 ARG CHI2:  (92 ARG CA)-(92 ARG CB)-(92 ARG CG)-(92 ARG CD)  60.0 270.0
 &rst     iat =  1424,  1426,  1429,  1432,
   r1 =  59.0, r2 =  60.0, r3 = 270.0, r4 = 271.0,
 &end

# 92 ARG CHI3:  (92 ARG CB)-(92 ARG CG)-(92 ARG CD)-(92 ARG NE)  60.0 270.0
 &rst     iat =  1426,  1429,  1432,  1435,
   r1 =  59.0, r2 =  60.0, r3 = 270.0, r4 = 271.0,
 &end

# 92 ARG CHI4:  (92 ARG CG)-(92 ARG CD)-(92 ARG NE)-(92 ARG CZ)  60.0 290.0
 &rst     iat =  1429,  1432,  1435,  1437,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &end

# 92 ARG PSI:  (92 ARG N)-(92 ARG CA)-(92 ARG C)-(93 LYS N) 120.0 190.0
 &rst     iat =  1422,  1424,  1444,  1446,
   r1 = 119.0, r2 = 120.0, r3 = 190.0, r4 = 191.0,
 &end

# 93 LYS PHI:  (92 ARG C)-(93 LYS N)-(93 LYS CA)-(93 LYS C) -120.0 -76.8
 &rst     iat =  1444,  1446,  1448,  1466,
   r1 = -121.0, r2 = -120.0, r3 = -76.8, r4 = -75.8,
 &end

# 93 LYS CHI1:  (93 LYS N)-(93 LYS CA)-(93 LYS CB)-(93 LYS CG) 160.0 200.0
 &rst     iat =  1446,  1448,  1450,  1453,
   r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
 &end

# 93 LYS CHI2:  (93 LYS CA)-(93 LYS CB)-(93 LYS CG)-(93 LYS CD) -180.0 -90.0
 &rst     iat =  1448,  1450,  1453,  1456,
   r1 = -181.0, r2 = -180.0, r3 = -90.0, r4 = -89.0,
 &end

# 93 LYS CHI3:  (93 LYS CB)-(93 LYS CG)-(93 LYS CD)-(93 LYS CE) -80.0  70.0
 &rst     iat =  1450,  1453,  1456,  1459,
   r1 = -81.0, r2 = -80.0, r3 =  70.0, r4 =  71.0,
 &end

# 93 LYS CHI4:  (93 LYS CG)-(93 LYS CD)-(93 LYS CE)-(93 LYS NZ) 140.0 200.0
 &rst     iat =  1453,  1456,  1459,  1462,
   r1 = 139.0, r2 = 140.0, r3 = 200.0, r4 = 201.0,
 &end

# 93 LYS PSI:  (93 LYS N)-(93 LYS CA)-(93 LYS C)-(94 VAL N) 100.0 150.0
 &rst     iat =  1446,  1448,  1466,  1468,
   r1 =  99.0, r2 = 100.0, r3 = 150.0, r4 = 151.0,
 &end

# 94 VAL PHI:  (93 LYS C)-(94 VAL N)-(94 VAL CA)-(94 VAL C) -150.0 -110.0
 &rst     iat =  1466,  1468,  1470,  1482,
   r1 = -151.0, r2 = -150.0, r3 = -110.0, r4 = -109.0,
 &end

# 94 VAL CHI1:  (94 VAL N)-(94 VAL CA)-(94 VAL CB)-(94 VAL CG1) -180.0 -160.0
 &rst     iat =  1468,  1470,  1472,  1474,
   r1 = -181.0, r2 = -180.0, r3 = -160.0, r4 = -159.0,
 &end

# 94 VAL PSI:  (94 VAL N)-(94 VAL CA)-(94 VAL C)-(95 GLU N) 140.0 160.0
 &rst     iat =  1468,  1470,  1482,  1484,
   r1 = 139.0, r2 = 140.0, r3 = 160.0, r4 = 161.0,
 &end

# 95 GLU PHI:  (94 VAL C)-(95 GLU N)-(95 GLU CA)-(95 GLU C) -90.0 -80.0
 &rst     iat =  1482,  1484,  1486,  1497,
   r1 = -91.0, r2 = -90.0, r3 = -80.0, r4 = -79.0,
 &end

# 95 GLU CHI1:  (95 GLU N)-(95 GLU CA)-(95 GLU CB)-(95 GLU CG)  60.0  80.0
 &rst     iat =  1484,  1486,  1488,  1491,
   r1 =  59.0, r2 =  60.0, r3 =  80.0, r4 =  81.0,
 &end

# 95 GLU CHI2:  (95 GLU CA)-(95 GLU CB)-(95 GLU CG)-(95 GLU CD) 160.0 190.0
 &rst     iat =  1486,  1488,  1491,  1494,
   r1 = 159.0, r2 = 160.0, r3 = 190.0, r4 = 191.0,
 &end

# 95 GLU PSI:  (95 GLU N)-(95 GLU CA)-(95 GLU C)-(96 ILE N) 140.0 160.0
 &rst     iat =  1484,  1486,  1497,  1499,
   r1 = 139.0, r2 = 140.0, r3 = 160.0, r4 = 161.0,
 &end

# 96 ILE PHI:  (95 GLU C)-(96 ILE N)-(96 ILE CA)-(96 ILE C) -170.0 -140.0
 &rst     iat =  1497,  1499,  1501,  1516,
   r1 = -171.0, r2 = -170.0, r3 = -140.0, r4 = -139.0,
 &end

# 96 ILE CHI1:  (96 ILE N)-(96 ILE CA)-(96 ILE CB)-(96 ILE CG1)  10.0  30.0
 &rst     iat =  1499,  1501,  1503,  1509,
   r1 =   9.0, r2 =  10.0, r3 =  30.0, r4 =  31.0,
 &end

# 96 ILE CHI21:  (96 ILE CA)-(96 ILE CB)-(96 ILE CG1)-(96 ILE CD1)  50.0  70.0
 &rst     iat =  1501,  1503,  1509,  1512,
   r1 =  49.0, r2 =  50.0, r3 =  70.0, r4 =  71.0,
 &end

# 96 ILE PSI:  (96 ILE N)-(96 ILE CA)-(96 ILE C)-(97 ALA N) 130.0 160.0
 &rst     iat =  1499,  1501,  1516,  1518,
   r1 = 129.0, r2 = 130.0, r3 = 160.0, r4 = 161.0,
 &end

# 97 ALA PHI:  (96 ILE C)-(97 ALA N)-(97 ALA CA)-(97 ALA C) -120.0 -73.5
 &rst     iat =  1516,  1518,  1520,  1526,
   r1 = -121.0, r2 = -120.0, r3 = -73.5, r4 = -72.5,
 &end

# 97 ALA PSI:  (97 ALA N)-(97 ALA CA)-(97 ALA C)-(98 PHE N) 120.0 145.3
 &rst     iat =  1518,  1520,  1526,  1528,
   r1 = 119.0, r2 = 120.0, r3 = 145.3, r4 = 146.3,
 &end

# 98 PHE PHI:  (97 ALA C)-(98 PHE N)-(98 PHE CA)-(98 PHE C) -142.8 -100.0
 &rst     iat =  1526,  1528,  1530,  1546,
   r1 = -143.8, r2 = -142.8, r3 = -100.0, r4 = -99.0,
 &end

# 98 PHE CHI1:  (98 PHE N)-(98 PHE CA)-(98 PHE CB)-(98 PHE CG) -80.0   0.0
 &rst     iat =  1528,  1530,  1532,  1535,
   r1 = -81.0, r2 = -80.0, r3 =   0.0, r4 =   1.0,
 &end

# 98 PHE CHI2:  (98 PHE CA)-(98 PHE CB)-(98 PHE CG)-(98 PHE CD1) -100.0 140.0
 &rst     iat =  1530,  1532,  1535,  1536,
   r1 = -101.0, r2 = -100.0, r3 = 140.0, r4 = 141.0,
 &end

# 98 PHE PSI:  (98 PHE N)-(98 PHE CA)-(98 PHE C)-(99 TYR N) 140.0 188.2
 &rst     iat =  1528,  1530,  1546,  1548,
   r1 = 139.0, r2 = 140.0, r3 = 188.2, r4 = 189.2,
 &end

# 99 TYR PHI:  (98 PHE C)-(99 TYR N)-(99 TYR CA)-(99 TYR C) -160.0 -110.0
 &rst     iat =  1546,  1548,  1550,  1567,
   r1 = -161.0, r2 = -160.0, r3 = -110.0, r4 = -109.0,
 &end

# 99 TYR CHI1:  (99 TYR N)-(99 TYR CA)-(99 TYR CB)-(99 TYR CG)  50.0  80.0
 &rst     iat =  1548,  1550,  1552,  1555,
   r1 =  49.0, r2 =  50.0, r3 =  80.0, r4 =  81.0,
 &end

# 99 TYR CHI2:  (99 TYR CA)-(99 TYR CB)-(99 TYR CG)-(99 TYR CD1)  80.0 280.0
 &rst     iat =  1550,  1552,  1555,  1556,
   r1 =  79.0, r2 =  80.0, r3 = 280.0, r4 = 281.0,
 &end

# 99 TYR PSI:  (99 TYR N)-(99 TYR CA)-(99 TYR C)-(100 ARG N) 121.6 140.0
 &rst     iat =  1548,  1550,  1567,  1569,
   r1 = 120.6, r2 = 121.6, r3 = 140.0, r4 = 141.0,
 &end

# 100 ARG PHI:  (99 TYR C)-(100 ARG N)-(100 ARG CA)-(100 ARG C) -100.0 -50.0
 &rst     iat =  1567,  1569,  1571,  1591,
   r1 = -101.0, r2 = -100.0, r3 = -50.0, r4 = -49.0,
 &end

# 100 ARG CHI1:  (100 ARG N)-(100 ARG CA)-(100 ARG CB)-(100 ARG CG) -170.0  60.0
 &rst     iat =  1569,  1571,  1573,  1576,
   r1 = -171.0, r2 = -170.0, r3 =  60.0, r4 =  61.0,
 &end

# 100 ARG CHI2:  (100 ARG CA)-(100 ARG CB)-(100 ARG CG)-(100 ARG CD) -290.0 -60.0
 &rst     iat =  1571,  1573,  1576,  1579,
   r1 = -291.0, r2 = -290.0, r3 = -60.0, r4 = -59.0,
 &end

# 100 ARG CHI3:  (100 ARG CB)-(100 ARG CG)-(100 ARG CD)-(100 ARG NE)  50.0 310.0
 &rst     iat =  1573,  1576,  1579,  1582,
   r1 =  49.0, r2 =  50.0, r3 = 310.0, r4 = 311.0,
 &end

# 100 ARG CHI4:  (100 ARG CG)-(100 ARG CD)-(100 ARG NE)-(100 ARG CZ)  60.0 290.0
 &rst     iat =  1576,  1579,  1582,  1584,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &end

# 100 ARG PSI:  (100 ARG N)-(100 ARG CA)-(100 ARG C)-(101 LYS N) 130.0 166.6
 &rst     iat =  1569,  1571,  1591,  1593,
   r1 = 129.0, r2 = 130.0, r3 = 166.6, r4 = 167.6,
 &end

# 101 LYS PHI:  (100 ARG C)-(101 LYS N)-(101 LYS CA)-(101 LYS C) -70.0 -50.0
 &rst     iat =  1591,  1593,  1595,  1613,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 101 LYS CHI1:  (101 LYS N)-(101 LYS CA)-(101 LYS CB)-(101 LYS CG)  50.0 180.0
 &rst     iat =  1593,  1595,  1597,  1600,
   r1 =  49.0, r2 =  50.0, r3 = 180.0, r4 = 181.0,
 &end

# 101 LYS CHI2:  (101 LYS CA)-(101 LYS CB)-(101 LYS CG)-(101 LYS CD) -100.0 100.0
 &rst     iat =  1595,  1597,  1600,  1603,
   r1 = -101.0, r2 = -100.0, r3 = 100.0, r4 = 101.0,
 &end

# 101 LYS CHI3:  (101 LYS CB)-(101 LYS CG)-(101 LYS CD)-(101 LYS CE) -250.0 -90.0
 &rst     iat =  1597,  1600,  1603,  1606,
   r1 = -251.0, r2 = -250.0, r3 = -90.0, r4 = -89.0,
 &end

# 101 LYS CHI4:  (101 LYS CG)-(101 LYS CD)-(101 LYS CE)-(101 LYS NZ) -220.0 -50.0
 &rst     iat =  1600,  1603,  1606,  1609,
   r1 = -221.0, r2 = -220.0, r3 = -50.0, r4 = -49.0,
 &end

# 101 LYS PSI:  (101 LYS N)-(101 LYS CA)-(101 LYS C)-(102 ASP N) -40.0 -10.0
 &rst     iat =  1593,  1595,  1613,  1615,
   r1 = -41.0, r2 = -40.0, r3 = -10.0, r4 =  -9.0,
 &end

# 102 ASP PHI:  (101 LYS C)-(102 ASP N)-(102 ASP CA)-(102 ASP C) -90.0 -60.0
 &rst     iat =  1613,  1615,  1617,  1625,
   r1 = -91.0, r2 = -90.0, r3 = -60.0, r4 = -59.0,
 &end

# 102 ASP CHI1:  (102 ASP N)-(102 ASP CA)-(102 ASP CB)-(102 ASP CG)  60.0 300.0
 &rst     iat =  1615,  1617,  1619,  1622,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 102 ASP PSI:  (102 ASP N)-(102 ASP CA)-(102 ASP C)-(103 GLY N) -20.0 -10.0
 &rst     iat =  1615,  1617,  1625,  1627,
   r1 = -21.0, r2 = -20.0, r3 = -10.0, r4 =  -9.0,
 &end

# 103 GLY PHI:  (102 ASP C)-(103 GLY N)-(103 GLY CA)-(103 GLY C)  90.0 131.8
 &rst     iat =  1625,  1627,  1629,  1632,
   r1 =  89.0, r2 =  90.0, r3 = 131.8, r4 = 132.8,
 &end

# 103 GLY PSI:  (103 GLY N)-(103 GLY CA)-(103 GLY C)-(104 SER N) -20.0  45.0
 &rst     iat =  1627,  1629,  1632,  1634,
   r1 = -21.0, r2 = -20.0, r3 =  45.0, r4 =  46.0,
 &end

# 104 SER PHI:  (103 GLY C)-(104 SER N)-(104 SER CA)-(104 SER C) -142.0 -50.0
 &rst     iat =  1632,  1634,  1636,  1643,
   r1 = -143.0, r2 = -142.0, r3 = -50.0, r4 = -49.0,
 &end

# 104 SER CHI1:  (104 SER N)-(104 SER CA)-(104 SER CB)-(104 SER OG) -250.0   0.0
 &rst     iat =  1634,  1636,  1638,  1641,
   r1 = -251.0, r2 = -250.0, r3 =   0.0, r4 =   1.0,
 &end

# 104 SER PSI:  (104 SER N)-(104 SER CA)-(104 SER C)-(105 CYS N)  99.0 170.0
 &rst     iat =  1634,  1636,  1643,  1645,
   r1 =  98.0, r2 =  99.0, r3 = 170.0, r4 = 171.0,
 &end

# 105 CYS PHI:  (104 SER C)-(105 CYS N)-(105 CYS CA)-(105 CYS C) -164.6 -77.8
 &rst     iat =  1643,  1645,  1647,  1654,
   r1 = -165.6, r2 = -164.6, r3 = -77.8, r4 = -76.8,
 &end

# 105 CYS CHI1:  (105 CYS N)-(105 CYS CA)-(105 CYS CB)-(105 CYS SG) -180.0  70.0
 &rst     iat =  1645,  1647,  1649,  1652,
   r1 = -181.0, r2 = -180.0, r3 =  70.0, r4 =  71.0,
 &end

# 105 CYS PSI:  (105 CYS N)-(105 CYS CA)-(105 CYS C)-(106 PHE N) 107.4 140.0
 &rst     iat =  1645,  1647,  1654,  1656,
   r1 = 106.4, r2 = 107.4, r3 = 140.0, r4 = 141.0,
 &end

# 106 PHE PHI:  (105 CYS C)-(106 PHE N)-(106 PHE CA)-(106 PHE C) -150.9 -150.0
 &rst     iat =  1654,  1656,  1658,  1674,
   r1 = -151.9, r2 = -150.9, r3 = -150.0, r4 = -149.0,
 &end

# 106 PHE CHI1:  (106 PHE N)-(106 PHE CA)-(106 PHE CB)-(106 PHE CG)  40.0  70.0
 &rst     iat =  1656,  1658,  1660,  1663,
   r1 =  39.0, r2 =  40.0, r3 =  70.0, r4 =  71.0,
 &end

# 106 PHE CHI2:  (106 PHE CA)-(106 PHE CB)-(106 PHE CG)-(106 PHE CD1)  60.0 290.0
 &rst     iat =  1658,  1660,  1663,  1664,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &end

# 106 PHE PSI:  (106 PHE N)-(106 PHE CA)-(106 PHE C)-(107 LEU N) 140.0 165.7
 &rst     iat =  1656,  1658,  1674,  1676,
   r1 = 139.0, r2 = 140.0, r3 = 165.7, r4 = 166.7,
 &end

# 107 LEU PHI:  (106 PHE C)-(107 LEU N)-(107 LEU CA)-(107 LEU C) -128.6 -100.0
 &rst     iat =  1674,  1676,  1678,  1693,
   r1 = -129.6, r2 = -128.6, r3 = -100.0, r4 = -99.0,
 &end

# 107 LEU CHI1:  (107 LEU N)-(107 LEU CA)-(107 LEU CB)-(107 LEU CG) -200.0 -150.0
 &rst     iat =  1676,  1678,  1680,  1683,
   r1 = -201.0, r2 = -200.0, r3 = -150.0, r4 = -149.0,
 &end

# 107 LEU CHI2:  (107 LEU CA)-(107 LEU CB)-(107 LEU CG)-(107 LEU CD1) -80.0  50.0
 &rst     iat =  1678,  1680,  1683,  1685,
   r1 = -81.0, r2 = -80.0, r3 =  50.0, r4 =  51.0,
 &end

# 107 LEU PSI:  (107 LEU N)-(107 LEU CA)-(107 LEU C)-(108 CYS N) 110.0 140.0
 &rst     iat =  1676,  1678,  1693,  1695,
   r1 = 109.0, r2 = 110.0, r3 = 140.0, r4 = 141.0,
 &end

# 108 CYS PHI:  (107 LEU C)-(108 CYS N)-(108 CYS CA)-(108 CYS C) -150.0 -110.0
 &rst     iat =  1693,  1695,  1697,  1704,
   r1 = -151.0, r2 = -150.0, r3 = -110.0, r4 = -109.0,
 &end

# 108 CYS CHI1:  (108 CYS N)-(108 CYS CA)-(108 CYS CB)-(108 CYS SG) -100.0 -50.0
 &rst     iat =  1695,  1697,  1699,  1702,
   r1 = -101.0, r2 = -100.0, r3 = -50.0, r4 = -49.0,
 &end

# 108 CYS PSI:  (108 CYS N)-(108 CYS CA)-(108 CYS C)-(109 LEU N) 150.0 180.0
 &rst     iat =  1695,  1697,  1704,  1706,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 109 LEU PHI:  (108 CYS C)-(109 LEU N)-(109 LEU CA)-(109 LEU C) -80.0 -70.0
 &rst     iat =  1704,  1706,  1708,  1723,
   r1 = -81.0, r2 = -80.0, r3 = -70.0, r4 = -69.0,
 &end

# 109 LEU CHI1:  (109 LEU N)-(109 LEU CA)-(109 LEU CB)-(109 LEU CG) -180.0 -40.0
 &rst     iat =  1706,  1708,  1710,  1713,
   r1 = -181.0, r2 = -180.0, r3 = -40.0, r4 = -39.0,
 &end

# 109 LEU CHI2:  (109 LEU CA)-(109 LEU CB)-(109 LEU CG)-(109 LEU CD1) -70.0 180.0
 &rst     iat =  1708,  1710,  1713,  1715,
   r1 = -71.0, r2 = -70.0, r3 = 180.0, r4 = 181.0,
 &end

# 109 LEU PSI:  (109 LEU N)-(109 LEU CA)-(109 LEU C)-(110 VAL N)  60.0  80.0
 &rst     iat =  1706,  1708,  1723,  1725,
   r1 =  59.0, r2 =  60.0, r3 =  80.0, r4 =  81.0,
 &end

# 110 VAL PHI:  (109 LEU C)-(110 VAL N)-(110 VAL CA)-(110 VAL C) -70.0 -50.0
 &rst     iat =  1723,  1725,  1727,  1739,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 110 VAL CHI1:  (110 VAL N)-(110 VAL CA)-(110 VAL CB)-(110 VAL CG1) -310.0 -40.0
 &rst     iat =  1725,  1727,  1729,  1731,
   r1 = -311.0, r2 = -310.0, r3 = -40.0, r4 = -39.0,
 &end

# 110 VAL PSI:  (110 VAL N)-(110 VAL CA)-(110 VAL C)-(111 ASP N) 140.0 180.0
 &rst     iat =  1725,  1727,  1739,  1741,
   r1 = 139.0, r2 = 140.0, r3 = 180.0, r4 = 181.0,
 &end

# 111 ASP PHI:  (110 VAL C)-(111 ASP N)-(111 ASP CA)-(111 ASP C) -140.0 -100.0
 &rst     iat =  1739,  1741,  1743,  1751,
   r1 = -141.0, r2 = -140.0, r3 = -100.0, r4 = -99.0,
 &end

# 111 ASP CHI1:  (111 ASP N)-(111 ASP CA)-(111 ASP CB)-(111 ASP CG) -180.0 -90.0
 &rst     iat =  1741,  1743,  1745,  1748,
   r1 = -181.0, r2 = -180.0, r3 = -90.0, r4 = -89.0,
 &end

# 111 ASP PSI:  (111 ASP N)-(111 ASP CA)-(111 ASP C)-(112 VAL N)  70.0  90.0
 &rst     iat =  1741,  1743,  1751,  1753,
   r1 =  69.0, r2 =  70.0, r3 =  90.0, r4 =  91.0,
 &end

# 112 VAL PHI:  (111 ASP C)-(112 VAL N)-(112 VAL CA)-(112 VAL C) -90.0 -70.0
 &rst     iat =  1751,  1753,  1755,  1767,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 112 VAL CHI1:  (112 VAL N)-(112 VAL CA)-(112 VAL CB)-(112 VAL CG1) -190.0 -160.0
 &rst     iat =  1753,  1755,  1757,  1759,
   r1 = -191.0, r2 = -190.0, r3 = -160.0, r4 = -159.0,
 &end

# 112 VAL PSI:  (112 VAL N)-(112 VAL CA)-(112 VAL C)-(113 VAL N)  70.0  90.0
 &rst     iat =  1753,  1755,  1767,  1769,
   r1 =  69.0, r2 =  70.0, r3 =  90.0, r4 =  91.0,
 &end

# 113 VAL PHI:  (112 VAL C)-(113 VAL N)-(113 VAL CA)-(113 VAL C) -140.0 -110.0
 &rst     iat =  1767,  1769,  1771,  1783,
   r1 = -141.0, r2 = -140.0, r3 = -110.0, r4 = -109.0,
 &end

# 113 VAL CHI1:  (113 VAL N)-(113 VAL CA)-(113 VAL CB)-(113 VAL CG1)  50.0 290.0
 &rst     iat =  1769,  1771,  1773,  1775,
   r1 =  49.0, r2 =  50.0, r3 = 290.0, r4 = 291.0,
 &end

# 113 VAL PSI:  (113 VAL N)-(113 VAL CA)-(113 VAL C)-(114 PRO N) 110.0 140.0
 &rst     iat =  1769,  1771,  1783,  1785,
   r1 = 109.0, r2 = 110.0, r3 = 140.0, r4 = 141.0,
 &end

# 114 PRO PSI:  (114 PRO N)-(114 PRO CA)-(114 PRO C)-(115 VAL N) -180.0 -160.0
 &rst     iat =  1785,  1795,  1797,  1799,
   r1 = -181.0, r2 = -180.0, r3 = -160.0, r4 = -159.0,
 &end

# 115 VAL PHI:  (114 PRO C)-(115 VAL N)-(115 VAL CA)-(115 VAL C) -130.1 -110.0
 &rst     iat =  1797,  1799,  1801,  1813,
   r1 = -131.1, r2 = -130.1, r3 = -110.0, r4 = -109.0,
 &end

# 115 VAL CHI1:  (115 VAL N)-(115 VAL CA)-(115 VAL CB)-(115 VAL CG1) -150.0 -70.0
 &rst     iat =  1799,  1801,  1803,  1805,
   r1 = -151.0, r2 = -150.0, r3 = -70.0, r4 = -69.0,
 &end

# 115 VAL PSI:  (115 VAL N)-(115 VAL CA)-(115 VAL C)-(116 LYS N) 120.0 140.0
 &rst     iat =  1799,  1801,  1813,  1815,
   r1 = 119.0, r2 = 120.0, r3 = 140.0, r4 = 141.0,
 &end

# 116 LYS PHI:  (115 VAL C)-(116 LYS N)-(116 LYS CA)-(116 LYS C) -130.0 -100.0
 &rst     iat =  1813,  1815,  1817,  1835,
   r1 = -131.0, r2 = -130.0, r3 = -100.0, r4 = -99.0,
 &end

# 116 LYS CHI1:  (116 LYS N)-(116 LYS CA)-(116 LYS CB)-(116 LYS CG) -60.0  60.0
 &rst     iat =  1815,  1817,  1819,  1822,
   r1 = -61.0, r2 = -60.0, r3 =  60.0, r4 =  61.0,
 &end

# 116 LYS CHI2:  (116 LYS CA)-(116 LYS CB)-(116 LYS CG)-(116 LYS CD)  80.0 270.0
 &rst     iat =  1817,  1819,  1822,  1825,
   r1 =  79.0, r2 =  80.0, r3 = 270.0, r4 = 271.0,
 &end

# 116 LYS CHI3:  (116 LYS CB)-(116 LYS CG)-(116 LYS CD)-(116 LYS CE)  60.0 280.0
 &rst     iat =  1819,  1822,  1825,  1828,
   r1 =  59.0, r2 =  60.0, r3 = 280.0, r4 = 281.0,
 &end

# 116 LYS CHI4:  (116 LYS CG)-(116 LYS CD)-(116 LYS CE)-(116 LYS NZ)  50.0 300.0
 &rst     iat =  1822,  1825,  1828,  1831,
   r1 =  49.0, r2 =  50.0, r3 = 300.0, r4 = 301.0,
 &end

# 116 LYS PSI:  (116 LYS N)-(116 LYS CA)-(116 LYS C)-(117 ASN N) 160.0 175.9
 &rst     iat =  1815,  1817,  1835,  1837,
   r1 = 159.0, r2 = 160.0, r3 = 175.9, r4 = 176.9,
 &end

# 117 ASN PHI:  (116 LYS C)-(117 ASN N)-(117 ASN CA)-(117 ASN C) -120.0 -90.0
 &rst     iat =  1835,  1837,  1839,  1849,
   r1 = -121.0, r2 = -120.0, r3 = -90.0, r4 = -89.0,
 &end

# 117 ASN CHI1:  (117 ASN N)-(117 ASN CA)-(117 ASN CB)-(117 ASN CG)  50.0  90.0
 &rst     iat =  1837,  1839,  1841,  1844,
   r1 =  49.0, r2 =  50.0, r3 =  90.0, r4 =  91.0,
 &end

# 117 ASN CHI2:  (117 ASN CA)-(117 ASN CB)-(117 ASN CG)-(117 ASN OD1)  30.0 110.0
 &rst     iat =  1839,  1841,  1844,  1845,
   r1 =  29.0, r2 =  30.0, r3 = 110.0, r4 = 111.0,
 &end

# 117 ASN PSI:  (117 ASN N)-(117 ASN CA)-(117 ASN C)-(118 GLU N) -180.0 -171.3
 &rst     iat =  1837,  1839,  1849,  1851,
   r1 = -181.0, r2 = -180.0, r3 = -171.3, r4 = -170.3,
 &end

# 118 GLU PHI:  (117 ASN C)-(118 GLU N)-(118 GLU CA)-(118 GLU C) -70.0 -50.0
 &rst     iat =  1849,  1851,  1853,  1864,
   r1 = -71.0, r2 = -70.0, r3 = -50.0, r4 = -49.0,
 &end

# 118 GLU CHI1:  (118 GLU N)-(118 GLU CA)-(118 GLU CB)-(118 GLU CG)  40.0  70.0
 &rst     iat =  1851,  1853,  1855,  1858,
   r1 =  39.0, r2 =  40.0, r3 =  70.0, r4 =  71.0,
 &end

# 118 GLU CHI2:  (118 GLU CA)-(118 GLU CB)-(118 GLU CG)-(118 GLU CD) 160.0 200.0
 &rst     iat =  1853,  1855,  1858,  1861,
   r1 = 159.0, r2 = 160.0, r3 = 200.0, r4 = 201.0,
 &end

# 118 GLU PSI:  (118 GLU N)-(118 GLU CA)-(118 GLU C)-(119 ASP N) -46.9 -20.0
 &rst     iat =  1851,  1853,  1864,  1866,
   r1 = -47.9, r2 = -46.9, r3 = -20.0, r4 = -19.0,
 &end

# 119 ASP PHI:  (118 GLU C)-(119 ASP N)-(119 ASP CA)-(119 ASP C) -80.0 -60.2
 &rst     iat =  1864,  1866,  1868,  1876,
   r1 = -81.0, r2 = -80.0, r3 = -60.2, r4 = -59.2,
 &end

# 119 ASP CHI1:  (119 ASP N)-(119 ASP CA)-(119 ASP CB)-(119 ASP CG) -160.0 -110.0
 &rst     iat =  1866,  1868,  1870,  1873,
   r1 = -161.0, r2 = -160.0, r3 = -110.0, r4 = -109.0,
 &end

# 119 ASP PSI:  (119 ASP N)-(119 ASP CA)-(119 ASP C)-(120 GLY N) -23.9 -20.0
 &rst     iat =  1866,  1868,  1876,  1878,
   r1 = -24.9, r2 = -23.9, r3 = -20.0, r4 = -19.0,
 &end

# 120 GLY PHI:  (119 ASP C)-(120 GLY N)-(120 GLY CA)-(120 GLY C)  90.0 110.0
 &rst     iat =  1876,  1878,  1880,  1883,
   r1 =  89.0, r2 =  90.0, r3 = 110.0, r4 = 111.0,
 &end

# 120 GLY PSI:  (120 GLY N)-(120 GLY CA)-(120 GLY C)-(121 ALA N) -18.0  30.0
 &rst     iat =  1878,  1880,  1883,  1885,
   r1 = -19.0, r2 = -18.0, r3 =  30.0, r4 =  31.0,
 &end

# 121 ALA PHI:  (120 GLY C)-(121 ALA N)-(121 ALA CA)-(121 ALA C) -120.0 -70.0
 &rst     iat =  1883,  1885,  1887,  1893,
   r1 = -121.0, r2 = -120.0, r3 = -70.0, r4 = -69.0,
 &end

# 121 ALA PSI:  (121 ALA N)-(121 ALA CA)-(121 ALA C)-(122 VAL N) 120.0 150.0
 &rst     iat =  1885,  1887,  1893,  1895,
   r1 = 119.0, r2 = 120.0, r3 = 150.0, r4 = 151.0,
 &end

# 122 VAL PHI:  (121 ALA C)-(122 VAL N)-(122 VAL CA)-(122 VAL C) -80.0 -60.0
 &rst     iat =  1893,  1895,  1897,  1909,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 122 VAL CHI1:  (122 VAL N)-(122 VAL CA)-(122 VAL CB)-(122 VAL CG1)  40.0  60.0
 &rst     iat =  1895,  1897,  1899,  1901,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 122 VAL PSI:  (122 VAL N)-(122 VAL CA)-(122 VAL C)-(123 ILE N)  83.0 100.0
 &rst     iat =  1895,  1897,  1909,  1911,
   r1 =  82.0, r2 =  83.0, r3 = 100.0, r4 = 101.0,
 &end

# 123 ILE PHI:  (122 VAL C)-(123 ILE N)-(123 ILE CA)-(123 ILE C) -90.0 -70.0
 &rst     iat =  1909,  1911,  1913,  1928,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 123 ILE CHI1:  (123 ILE N)-(123 ILE CA)-(123 ILE CB)-(123 ILE CG1)  70.0  90.0
 &rst     iat =  1911,  1913,  1915,  1921,
   r1 =  69.0, r2 =  70.0, r3 =  90.0, r4 =  91.0,
 &end

# 123 ILE CHI21:  (123 ILE CA)-(123 ILE CB)-(123 ILE CG1)-(123 ILE CD1) -80.0 -60.0
 &rst     iat =  1913,  1915,  1921,  1924,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 123 ILE PSI:  (123 ILE N)-(123 ILE CA)-(123 ILE C)-(124 MET N) -30.0 -10.0
 &rst     iat =  1911,  1913,  1928,  1930,
   r1 = -31.0, r2 = -30.0, r3 = -10.0, r4 =  -9.0,
 &end

# 124 MET PHI:  (123 ILE C)-(124 MET N)-(124 MET CA)-(124 MET C) -150.0 -130.0
 &rst     iat =  1928,  1930,  1932,  1945,
   r1 = -151.0, r2 = -150.0, r3 = -130.0, r4 = -129.0,
 &end

# 124 MET CHI1:  (124 MET N)-(124 MET CA)-(124 MET CB)-(124 MET CG) -120.0 -80.0
 &rst     iat =  1930,  1932,  1934,  1937,
   r1 = -121.0, r2 = -120.0, r3 = -80.0, r4 = -79.0,
 &end

# 124 MET CHI2:  (124 MET CA)-(124 MET CB)-(124 MET CG)-(124 MET SD) -70.0 120.0
 &rst     iat =  1932,  1934,  1937,  1940,
   r1 = -71.0, r2 = -70.0, r3 = 120.0, r4 = 121.0,
 &end

# 124 MET CHI3:  (124 MET CB)-(124 MET CG)-(124 MET SD)-(124 MET CE) 100.0 260.0
 &rst     iat =  1934,  1937,  1940,  1941,
   r1 =  99.0, r2 = 100.0, r3 = 260.0, r4 = 261.0,
 &end

# 124 MET PSI:  (124 MET N)-(124 MET CA)-(124 MET C)-(125 PHE N) 135.3 150.0
 &rst     iat =  1930,  1932,  1945,  1947,
   r1 = 134.3, r2 = 135.3, r3 = 150.0, r4 = 151.0,
 &end

# 125 PHE PHI:  (124 MET C)-(125 PHE N)-(125 PHE CA)-(125 PHE C) -120.0 -90.0
 &rst     iat =  1945,  1947,  1949,  1965,
   r1 = -121.0, r2 = -120.0, r3 = -90.0, r4 = -89.0,
 &end

# 125 PHE CHI1:  (125 PHE N)-(125 PHE CA)-(125 PHE CB)-(125 PHE CG) -120.0 -90.0
 &rst     iat =  1947,  1949,  1951,  1954,
   r1 = -121.0, r2 = -120.0, r3 = -90.0, r4 = -89.0,
 &end

# 125 PHE PSI:  (125 PHE N)-(125 PHE CA)-(125 PHE C)-(126 ILE N)  80.0  90.0
 &rst     iat =  1947,  1949,  1965,  1967,
   r1 =  79.0, r2 =  80.0, r3 =  90.0, r4 =  91.0,
 &end

# 126 ILE PHI:  (125 PHE C)-(126 ILE N)-(126 ILE CA)-(126 ILE C) -120.0 -100.0
 &rst     iat =  1965,  1967,  1969,  1984,
   r1 = -121.0, r2 = -120.0, r3 = -100.0, r4 = -99.0,
 &end

# 126 ILE CHI1:  (126 ILE N)-(126 ILE CA)-(126 ILE CB)-(126 ILE CG1) -60.0 -50.0
 &rst     iat =  1967,  1969,  1971,  1977,
   r1 = -61.0, r2 = -60.0, r3 = -50.0, r4 = -49.0,
 &end

# 126 ILE CHI21:  (126 ILE CA)-(126 ILE CB)-(126 ILE CG1)-(126 ILE CD1) 170.0 190.0
 &rst     iat =  1969,  1971,  1977,  1980,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 126 ILE PSI:  (126 ILE N)-(126 ILE CA)-(126 ILE C)-(127 LEU N)  70.0  80.0
 &rst     iat =  1967,  1969,  1984,  1986,
   r1 =  69.0, r2 =  70.0, r3 =  80.0, r4 =  81.0,
 &end

# 127 LEU PHI:  (126 ILE C)-(127 LEU N)-(127 LEU CA)-(127 LEU C) -90.0 -70.0
 &rst     iat =  1984,  1986,  1988,  2003,
   r1 = -91.0, r2 = -90.0, r3 = -70.0, r4 = -69.0,
 &end

# 127 LEU CHI1:  (127 LEU N)-(127 LEU CA)-(127 LEU CB)-(127 LEU CG) -60.0 -40.0
 &rst     iat =  1986,  1988,  1990,  1993,
   r1 = -61.0, r2 = -60.0, r3 = -40.0, r4 = -39.0,
 &end

# 127 LEU CHI2:  (127 LEU CA)-(127 LEU CB)-(127 LEU CG)-(127 LEU CD1) -170.0 -20.0
 &rst     iat =  1988,  1990,  1993,  1995,
   r1 = -171.0, r2 = -170.0, r3 = -20.0, r4 = -19.0,
 &end

# 127 LEU PSI:  (127 LEU N)-(127 LEU CA)-(127 LEU C)-(128 ASN N)  80.0 100.0
 &rst     iat =  1986,  1988,  2003,  2005,
   r1 =  79.0, r2 =  80.0, r3 = 100.0, r4 = 101.0,
 &end

# 128 ASN PHI:  (127 LEU C)-(128 ASN N)-(128 ASN CA)-(128 ASN C) -80.0 -60.0
 &rst     iat =  2003,  2005,  2007,  2017,
   r1 = -81.0, r2 = -80.0, r3 = -60.0, r4 = -59.0,
 &end

# 128 ASN CHI1:  (128 ASN N)-(128 ASN CA)-(128 ASN CB)-(128 ASN CG) -80.0 -30.0
 &rst     iat =  2005,  2007,  2009,  2012,
   r1 = -81.0, r2 = -80.0, r3 = -30.0, r4 = -29.0,
 &end

# 128 ASN CHI2:  (128 ASN CA)-(128 ASN CB)-(128 ASN CG)-(128 ASN OD1) -140.0  20.0
 &rst     iat =  2007,  2009,  2012,  2013,
   r1 = -141.0, r2 = -140.0, r3 =  20.0, r4 =  21.0,
 &end

# 128 ASN PSI:  (128 ASN N)-(128 ASN CA)-(128 ASN C)-(129 PHE N)  90.0 130.0
 &rst     iat =  2005,  2007,  2017,  2019,
   r1 =  89.0, r2 =  90.0, r3 = 130.0, r4 = 131.0,
 &end

# 129 PHE PHI:  (128 ASN C)-(129 PHE N)-(129 PHE CA)-(129 PHE C) -100.0 -70.0
 &rst     iat =  2017,  2019,  2021,  2037,
   r1 = -101.0, r2 = -100.0, r3 = -70.0, r4 = -69.0,
 &end

# 129 PHE CHI1:  (129 PHE N)-(129 PHE CA)-(129 PHE CB)-(129 PHE CG) -70.0 -40.0
 &rst     iat =  2019,  2021,  2023,  2026,
   r1 = -71.0, r2 = -70.0, r3 = -40.0, r4 = -39.0,
 &end

# 129 PHE CHI2:  (129 PHE CA)-(129 PHE CB)-(129 PHE CG)-(129 PHE CD1) -270.0 -40.0
 &rst     iat =  2021,  2023,  2026,  2027,
   r1 = -271.0, r2 = -270.0, r3 = -40.0, r4 = -39.0,
 &end

# 129 PHE PSI:  (129 PHE N)-(129 PHE CA)-(129 PHE C)-(130 GLU N)  50.0  80.0
 &rst     iat =  2019,  2021,  2037,  2039,
   r1 =  49.0, r2 =  50.0, r3 =  80.0, r4 =  81.0,
 &end

# 130 GLU PHI:  (129 PHE C)-(130 GLU N)-(130 GLU CA)-(130 GLU C) -100.0 -79.9
 &rst     iat =  2037,  2039,  2041,  2052,
   r1 = -101.0, r2 = -100.0, r3 = -79.9, r4 = -78.9,
 &end

# 130 GLU CHI1:  (130 GLU N)-(130 GLU CA)-(130 GLU CB)-(130 GLU CG)  40.0  60.0
 &rst     iat =  2039,  2041,  2043,  2046,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 130 GLU CHI2:  (130 GLU CA)-(130 GLU CB)-(130 GLU CG)-(130 GLU CD) 140.0 170.0
 &rst     iat =  2041,  2043,  2046,  2049,
   r1 = 139.0, r2 = 140.0, r3 = 170.0, r4 = 171.0,
 &end

# 130 GLU PSI:  (130 GLU N)-(130 GLU CA)-(130 GLU C)-(131 VAL N) 107.0 157.0
 &rst     iat =  2039,  2041,  2052,  2054,
   r1 = 106.0, r2 = 107.0, r3 = 157.0, r4 = 158.0,
 &end

# 131 VAL PHI:  (130 GLU C)-(131 VAL N)-(131 VAL CA)-(131 VAL C) -122.9 -51.5
 &rst     iat =  2052,  2054,  2056,  2068,
   r1 = -123.9, r2 = -122.9, r3 = -51.5, r4 = -50.5,
 &end

# 131 VAL CHI1:  (131 VAL N)-(131 VAL CA)-(131 VAL CB)-(131 VAL CG1) 150.0 180.0
 &rst     iat =  2054,  2056,  2058,  2060,
   r1 = 149.0, r2 = 150.0, r3 = 180.0, r4 = 181.0,
 &end

# 131 VAL PSI:  (131 VAL N)-(131 VAL CA)-(131 VAL C)-(132 VAL N)  90.0 140.0
 &rst     iat =  2054,  2056,  2068,  2070,
   r1 =  89.0, r2 =  90.0, r3 = 140.0, r4 = 141.0,
 &end

# 132 VAL PHI:  (131 VAL C)-(132 VAL N)-(132 VAL CA)-(132 VAL C) -140.2 -130.0
 &rst     iat =  2068,  2070,  2072,  2084,
   r1 = -141.2, r2 = -140.2, r3 = -130.0, r4 = -129.0,
 &end

# 132 VAL CHI1:  (132 VAL N)-(132 VAL CA)-(132 VAL CB)-(132 VAL CG1) -60.0  60.0
 &rst     iat =  2070,  2072,  2074,  2076,
   r1 = -61.0, r2 = -60.0, r3 =  60.0, r4 =  61.0,
 &end

# 132 VAL PSI:  (132 VAL N)-(132 VAL CA)-(132 VAL C)-(133 MET N) 110.0 150.0
 &rst     iat =  2070,  2072,  2084,  2086,
   r1 = 109.0, r2 = 110.0, r3 = 150.0, r4 = 151.0,
 &end

# 133 MET PHI:  (132 VAL C)-(133 MET N)-(133 MET CA)-(133 MET C) -142.8 -80.0
 &rst     iat =  2084,  2086,  2088,  2101,
   r1 = -143.8, r2 = -142.8, r3 = -80.0, r4 = -79.0,
 &end

# 133 MET CHI1:  (133 MET N)-(133 MET CA)-(133 MET CB)-(133 MET CG) -110.0  80.0
 &rst     iat =  2086,  2088,  2090,  2093,
   r1 = -111.0, r2 = -110.0, r3 =  80.0, r4 =  81.0,
 &end

# 133 MET CHI2:  (133 MET CA)-(133 MET CB)-(133 MET CG)-(133 MET SD) 110.0 250.0
 &rst     iat =  2088,  2090,  2093,  2096,
   r1 = 109.0, r2 = 110.0, r3 = 250.0, r4 = 251.0,
 &end

# 133 MET CHI3:  (133 MET CB)-(133 MET CG)-(133 MET SD)-(133 MET CE) -120.0 130.0
 &rst     iat =  2090,  2093,  2096,  2097,
   r1 = -121.0, r2 = -120.0, r3 = 130.0, r4 = 131.0,
 &end

# 133 MET PSI:  (133 MET N)-(133 MET CA)-(133 MET C)-(134 GLU N) 140.0 200.0
 &rst     iat =  2086,  2088,  2101,  2103,
   r1 = 139.0, r2 = 140.0, r3 = 200.0, r4 = 201.0,
 &end

# 134 GLU PHI:  (133 MET C)-(134 GLU N)-(134 GLU CA)-(134 GLU C) -159.3 -50.0
 &rst     iat =  2101,  2103,  2105,  2116,
   r1 = -160.3, r2 = -159.3, r3 = -50.0, r4 = -49.0,
 &end

# 134 GLU CHI1:  (134 GLU N)-(134 GLU CA)-(134 GLU CB)-(134 GLU CG) -90.0  70.0
 &rst     iat =  2103,  2105,  2107,  2110,
   r1 = -91.0, r2 = -90.0, r3 =  70.0, r4 =  71.0,
 &end

# 134 GLU CHI2:  (134 GLU CA)-(134 GLU CB)-(134 GLU CG)-(134 GLU CD) -210.0 -100.0
 &rst     iat =  2105,  2107,  2110,  2113,
   r1 = -211.0, r2 = -210.0, r3 = -100.0, r4 = -99.0,
 &end

# 134 GLU PSI:  (134 GLU N)-(134 GLU CA)-(134 GLU C)-(135 LYS N) 130.0 180.0
 &rst     iat =  2103,  2105,  2116,  2118,
   r1 = 129.0, r2 = 130.0, r3 = 180.0, r4 = 181.0,
 &end

# 135 LYS PHI:  (134 GLU C)-(135 LYS N)-(135 LYS CA)-(135 LYS C) -180.0  60.0
 &rst     iat =  2116,  2118,  2120,  2138,
   r1 = -181.0, r2 = -180.0, r3 =  60.0, r4 =  61.0,
 &end

# 135 LYS CHI1:  (135 LYS N)-(135 LYS CA)-(135 LYS CB)-(135 LYS CG)  50.0 310.0
 &rst     iat =  2118,  2120,  2122,  2125,
   r1 =  49.0, r2 =  50.0, r3 = 310.0, r4 = 311.0,
 &end

# 135 LYS CHI2:  (135 LYS CA)-(135 LYS CB)-(135 LYS CG)-(135 LYS CD)  70.0 280.0
 &rst     iat =  2120,  2122,  2125,  2128,
   r1 =  69.0, r2 =  70.0, r3 = 280.0, r4 = 281.0,
 &end

# 135 LYS CHI3:  (135 LYS CB)-(135 LYS CG)-(135 LYS CD)-(135 LYS CE)  60.0 300.0
 &rst     iat =  2122,  2125,  2128,  2131,
   r1 =  59.0, r2 =  60.0, r3 = 300.0, r4 = 301.0,
 &end

# 135 LYS CHI4:  (135 LYS CG)-(135 LYS CD)-(135 LYS CE)-(135 LYS NZ)  60.0 290.0
 &rst     iat =  2125,  2128,  2131,  2134,
   r1 =  59.0, r2 =  60.0, r3 = 290.0, r4 = 291.0,
 &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 = 10., rk3=10.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=30,24,28,29, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=27,21,25,26, &end
#
#  chirality for residue 2 atoms:  CG N HD2 HD3
 &rst iat=24,20,22,23, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,32,31,27, &end
#
#  chirality for residue 3 atoms:  CA CG1 CG2 HB
 &rst iat=36,40,44,39, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=34,48,37,38, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=52,57,55,56, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=54,60,58,59, &end
#
#  chirality for residue 4 atoms:  CG NE HD2 HD3
 &rst iat=57,63,61,62, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=50,72,53,54, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=76,81,79,80, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=78,84,82,83, &end
#
#  chirality for residue 5 atoms:  CG NE HD2 HD3
 &rst iat=81,87,85,86, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=74,96,77,78, &end
#
#  chirality for residue 6 atoms:  N C HA2 HA3
 &rst iat=98,103,101,102, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=107,112,110,111, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=105,120,108,109, &end
#
#  chirality for residue 8 atoms:  CA CG1 CG2 HB
 &rst iat=124,128,132,127, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=122,136,125,126, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=138,146,141,142, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=158,152,156,157, &end
#
#  chirality for residue 10 atoms:  CB CD HG2 HG3
 &rst iat=155,149,153,154, &end
#
#  chirality for residue 10 atoms:  CG N HD2 HD3
 &rst iat=152,148,150,151, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=148,160,159,155, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=164,169,167,168, &end
#
#  chirality for residue 11 atoms:  CB CD HG2 HG3
 &rst iat=166,172,170,171, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=162,177,165,166, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=181,186,184,185, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=179,191,182,183, &end
#
#  chirality for residue 13 atoms:  CA CG2 OG1 HB
 &rst iat=195,199,203,198, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=193,205,196,197, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=209,214,212,213, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=207,225,210,211, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=229,234,232,233, &end
#
#  chirality for residue 15 atoms:  CB CD1 CD2 HG
 &rst iat=231,236,240,235, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=227,244,230,231, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=248,253,251,252, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=246,256,249,250, &end
#
#  chirality for residue 17 atoms:  CA CG2 OG1 HB
 &rst iat=260,264,268,263, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=258,270,261,262, &end
#
#  chirality for residue 18 atoms:  CA CG2 CG1 HB
 &rst iat=274,278,282,277, &end
#
#  chirality for residue 18 atoms:  CB CD1 HG12 HG13
 &rst iat=276,285,283,284, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=272,289,275,276, &end
#
#  chirality for residue 19 atoms:  CA CG2 CG1 HB
 &rst iat=293,297,301,296, &end
#
#  chirality for residue 19 atoms:  CB CD1 HG12 HG13
 &rst iat=295,304,302,303, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=291,308,294,295, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=312,317,315,316, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=314,320,318,319, &end
#
#  chirality for residue 20 atoms:  CG NE HD2 HD3
 &rst iat=317,323,321,322, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=310,332,313,314, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=336,341,339,340, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=338,344,342,343, &end
#
#  chirality for residue 21 atoms:  CD NZ HE2 HE3
 &rst iat=344,350,348,349, &end
#
#  chirality for residue 21 atoms:  CG CE HD2 HD3
 &rst iat=341,347,345,346, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=334,354,337,338, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=358,363,361,362, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=356,374,359,360, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=378,383,381,382, &end
#
#  chirality for residue 23 atoms:  CB CD HG2 HG3
 &rst iat=380,386,384,385, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=376,389,379,380, &end
#
#  chirality for residue 24 atoms:  N C HA2 HA3
 &rst iat=391,396,394,395, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=400,405,403,404, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=402,408,406,407, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=398,413,401,402, &end
#
#  chirality for residue 26 atoms:  CA OG HB2 HB3
 &rst iat=417,422,420,421, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=415,424,418,419, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=428,433,431,432, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=430,436,434,435, &end
#
#  chirality for residue 27 atoms:  CG NE HD2 HD3
 &rst iat=433,439,437,438, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=426,448,429,430, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=452,457,455,456, &end
#
#  chirality for residue 28 atoms:  CB CD HG2 HG3
 &rst iat=454,460,458,459, &end
#
#  chirality for residue 28 atoms:  CD NZ HE2 HE3
 &rst iat=460,466,464,465, &end
#
#  chirality for residue 28 atoms:  CG CE HD2 HD3
 &rst iat=457,463,461,462, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=450,470,453,454, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=474,479,477,478, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=472,490,475,476, &end
#
#  chirality for residue 30 atoms:  CA CG2 CG1 HB
 &rst iat=494,498,502,497, &end
#
#  chirality for residue 30 atoms:  CB CD1 HG12 HG13
 &rst iat=496,505,503,504, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=492,509,495,496, &end
#
#  chirality for residue 31 atoms:  CA CG2 CG1 HB
 &rst iat=513,517,521,516, &end
#
#  chirality for residue 31 atoms:  CB CD1 HG12 HG13
 &rst iat=515,524,522,523, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=511,528,514,515, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=530,538,533,534, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=542,547,545,546, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=540,552,543,544, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=554,562,557,558, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=566,571,569,570, &end
#
#  chirality for residue 35 atoms:  CB CD HG2 HG3
 &rst iat=568,574,572,573, &end
#
#  chirality for residue 35 atoms:  CG NE HD2 HD3
 &rst iat=571,577,575,576, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=564,586,567,568, &end
#
#  chirality for residue 36 atoms:  CA CG1 CG2 HB
 &rst iat=590,594,598,593, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=588,602,591,592, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=606,611,609,610, &end
#
#  chirality for residue 37 atoms:  CB CD HG2 HG3
 &rst iat=608,614,612,613, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=604,617,607,608, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=621,626,624,625, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=619,631,622,623, &end
#
#  chirality for residue 39 atoms:  CA SG HB2 HB3
 &rst iat=635,640,638,639, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=633,642,636,637, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=644,652,647,648, &end
#
#  chirality for residue 41 atoms:  CA CG1 CG2 HB
 &rst iat=656,660,664,659, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=654,668,657,658, &end
#
#  chirality for residue 42 atoms:  CA CG2 CG1 HB
 &rst iat=672,676,680,675, &end
#
#  chirality for residue 42 atoms:  CB CD1 HG12 HG13
 &rst iat=674,683,681,682, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=670,687,673,674, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=691,696,694,695, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=689,708,692,693, &end
#
#  chirality for residue 44 atoms:  CA SG HB2 HB3
 &rst iat=712,717,715,716, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=710,719,713,714, &end
#
#  chirality for residue 45 atoms:  CA CG HB2 HB3
 &rst iat=723,728,726,727, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=721,733,724,725, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=737,742,740,741, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=735,745,738,739, &end
#
#  chirality for residue 47 atoms:  N C HA2 HA3
 &rst iat=747,752,750,751, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=756,761,759,760, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=754,772,757,758, &end
#
#  chirality for residue 49 atoms:  CA SG HB2 HB3
 &rst iat=776,781,779,780, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=774,783,777,778, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=787,792,790,791, &end
#
#  chirality for residue 50 atoms:  CB CD HG2 HG3
 &rst iat=789,795,793,794, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=785,798,788,789, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=802,807,805,806, &end
#
#  chirality for residue 51 atoms:  CB CD1 CD2 HG
 &rst iat=804,809,813,808, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=800,817,803,804, &end
#
#  chirality for residue 52 atoms:  CA SG HB2 HB3
 &rst iat=821,826,824,825, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=819,828,822,823, &end
#
#  chirality for residue 53 atoms:  N C HA2 HA3
 &rst iat=830,835,833,834, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=839,844,842,843, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=837,856,840,841, &end
#
#  chirality for residue 55 atoms:  CA OG HB2 HB3
 &rst iat=860,865,863,864, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=858,867,861,862, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=871,876,874,875, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=873,879,877,878, &end
#
#  chirality for residue 56 atoms:  CG NE HD2 HD3
 &rst iat=876,882,880,881, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=869,891,872,873, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=893,901,896,897, &end
#
#  chirality for residue 58 atoms:  CA CG HB2 HB3
 &rst iat=905,910,908,909, &end
#
#  chirality for residue 58 atoms:  CB CD HG2 HG3
 &rst iat=907,913,911,912, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=903,916,906,907, &end
#
#  chirality for residue 59 atoms:  CA CG1 CG2 HB
 &rst iat=920,924,928,923, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=918,932,921,922, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=936,941,939,940, &end
#
#  chirality for residue 60 atoms:  CB SD HG2 HG3
 &rst iat=938,944,942,943, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=934,949,937,938, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=953,958,956,957, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=955,961,959,960, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=951,966,954,955, &end
#
#  chirality for residue 62 atoms:  CA CG HB2 HB3
 &rst iat=970,975,973,974, &end
#
#  chirality for residue 62 atoms:  CB CD HG2 HG3
 &rst iat=972,978,976,977, &end
#
#  chirality for residue 62 atoms:  CG NE HD2 HD3
 &rst iat=975,981,979,980, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=968,990,971,972, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=1002,996,1000,1001, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=999,993,997,998, &end
#
#  chirality for residue 63 atoms:  CG N HD2 HD3
 &rst iat=996,992,994,995, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=992,1004,1003,999, &end
#
#  chirality for residue 64 atoms:  CA SG HB2 HB3
 &rst iat=1008,1013,1011,1012, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=1006,1015,1009,1010, &end
#
#  chirality for residue 65 atoms:  CA CG2 OG1 HB
 &rst iat=1019,1023,1027,1022, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1017,1029,1020,1021, &end
#
#  chirality for residue 66 atoms:  CA SG HB2 HB3
 &rst iat=1033,1038,1036,1037, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1031,1040,1034,1035, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1044,1049,1047,1048, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1042,1052,1045,1046, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1056,1061,1059,1060, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1054,1072,1057,1058, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1076,1081,1079,1080, &end
#
#  chirality for residue 69 atoms:  CB CD1 CD2 HG
 &rst iat=1078,1083,1087,1082, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1074,1091,1077,1078, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1095,1100,1098,1099, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1093,1108,1096,1097, &end
#
#  chirality for residue 71 atoms:  N C HA2 HA3
 &rst iat=1110,1115,1113,1114, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1127,1121,1125,1126, &end
#
#  chirality for residue 72 atoms:  CB CD HG2 HG3
 &rst iat=1124,1118,1122,1123, &end
#
#  chirality for residue 72 atoms:  CG N HD2 HD3
 &rst iat=1121,1117,1119,1120, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1117,1129,1128,1124, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1133,1138,1136,1137, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1135,1141,1139,1140, &end
#
#  chirality for residue 73 atoms:  CG NE HD2 HD3
 &rst iat=1138,1144,1142,1143, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1131,1153,1134,1135, &end
#
#  chirality for residue 74 atoms:  CA CG2 OG1 HB
 &rst iat=1157,1161,1165,1160, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1155,1167,1158,1159, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1171,1176,1174,1175, &end
#
#  chirality for residue 75 atoms:  CB CD HG2 HG3
 &rst iat=1173,1179,1177,1178, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1169,1184,1172,1173, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1188,1193,1191,1192, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1190,1196,1194,1195, &end
#
#  chirality for residue 76 atoms:  CG NE HD2 HD3
 &rst iat=1193,1199,1197,1198, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1186,1208,1189,1190, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1212,1217,1215,1216, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1214,1220,1218,1219, &end
#
#  chirality for residue 77 atoms:  CG NE HD2 HD3
 &rst iat=1217,1223,1221,1222, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1210,1232,1213,1214, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1234,1242,1237,1238, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1244,1252,1247,1248, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1254,1262,1257,1258, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1266,1271,1269,1270, &end
#
#  chirality for residue 81 atoms:  CB CD HG2 HG3
 &rst iat=1268,1274,1272,1273, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1264,1279,1267,1268, &end
#
#  chirality for residue 82 atoms:  CA CG2 CG1 HB
 &rst iat=1283,1287,1291,1286, &end
#
#  chirality for residue 82 atoms:  CB CD1 HG12 HG13
 &rst iat=1285,1294,1292,1293, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1281,1298,1284,1285, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1300,1308,1303,1304, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1312,1317,1315,1316, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1314,1320,1318,1319, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1310,1325,1313,1314, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1327,1335,1330,1331, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1339,1344,1342,1343, &end
#
#  chirality for residue 86 atoms:  CB CD1 CD2 HG
 &rst iat=1341,1346,1350,1345, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1337,1354,1340,1341, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1358,1363,1361,1362, &end
#
#  chirality for residue 87 atoms:  CB CD1 CD2 HG
 &rst iat=1360,1365,1369,1364, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1356,1373,1359,1360, &end
#
#  chirality for residue 88 atoms:  N C HA2 HA3
 &rst iat=1375,1380,1378,1379, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1382,1390,1385,1386, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1394,1399,1397,1398, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1396,1402,1400,1401, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1392,1405,1395,1396, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1409,1414,1412,1413, &end
#
#  chirality for residue 91 atoms:  CB CD HG2 HG3
 &rst iat=1411,1417,1415,1416, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1407,1420,1410,1411, &end
#
#  chirality for residue 92 atoms:  CA CG HB2 HB3
 &rst iat=1424,1429,1427,1428, &end
#
#  chirality for residue 92 atoms:  CB CD HG2 HG3
 &rst iat=1426,1432,1430,1431, &end
#
#  chirality for residue 92 atoms:  CG NE HD2 HD3
 &rst iat=1429,1435,1433,1434, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1422,1444,1425,1426, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1448,1453,1451,1452, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1450,1456,1454,1455, &end
#
#  chirality for residue 93 atoms:  CD NZ HE2 HE3
 &rst iat=1456,1462,1460,1461, &end
#
#  chirality for residue 93 atoms:  CG CE HD2 HD3
 &rst iat=1453,1459,1457,1458, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1446,1466,1449,1450, &end
#
#  chirality for residue 94 atoms:  CA CG1 CG2 HB
 &rst iat=1470,1474,1478,1473, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1468,1482,1471,1472, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1486,1491,1489,1490, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1488,1494,1492,1493, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1484,1497,1487,1488, &end
#
#  chirality for residue 96 atoms:  CA CG2 CG1 HB
 &rst iat=1501,1505,1509,1504, &end
#
#  chirality for residue 96 atoms:  CB CD1 HG12 HG13
 &rst iat=1503,1512,1510,1511, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1499,1516,1502,1503, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1518,1526,1521,1522, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1530,1535,1533,1534, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1528,1546,1531,1532, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1550,1555,1553,1554, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1548,1567,1551,1552, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1571,1576,1574,1575, &end
#
#  chirality for residue 100 atoms:  CB CD HG2 HG3
 &rst iat=1573,1579,1577,1578, &end
#
#  chirality for residue 100 atoms:  CG NE HD2 HD3
 &rst iat=1576,1582,1580,1581, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1569,1591,1572,1573, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1595,1600,1598,1599, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=1597,1603,1601,1602, &end
#
#  chirality for residue 101 atoms:  CD NZ HE2 HE3
 &rst iat=1603,1609,1607,1608, &end
#
#  chirality for residue 101 atoms:  CG CE HD2 HD3
 &rst iat=1600,1606,1604,1605, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1593,1613,1596,1597, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1617,1622,1620,1621, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1615,1625,1618,1619, &end
#
#  chirality for residue 103 atoms:  N C HA2 HA3
 &rst iat=1627,1632,1630,1631, &end
#
#  chirality for residue 104 atoms:  CA OG HB2 HB3
 &rst iat=1636,1641,1639,1640, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1634,1643,1637,1638, &end
#
#  chirality for residue 105 atoms:  CA SG HB2 HB3
 &rst iat=1647,1652,1650,1651, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1645,1654,1648,1649, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1658,1663,1661,1662, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1656,1674,1659,1660, &end
#
#  chirality for residue 107 atoms:  CA CG HB2 HB3
 &rst iat=1678,1683,1681,1682, &end
#
#  chirality for residue 107 atoms:  CB CD1 CD2 HG
 &rst iat=1680,1685,1689,1684, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1676,1693,1679,1680, &end
#
#  chirality for residue 108 atoms:  CA SG HB2 HB3
 &rst iat=1697,1702,1700,1701, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1695,1704,1698,1699, &end
#
#  chirality for residue 109 atoms:  CA CG HB2 HB3
 &rst iat=1708,1713,1711,1712, &end
#
#  chirality for residue 109 atoms:  CB CD1 CD2 HG
 &rst iat=1710,1715,1719,1714, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1706,1723,1709,1710, &end
#
#  chirality for residue 110 atoms:  CA CG1 CG2 HB
 &rst iat=1727,1731,1735,1730, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1725,1739,1728,1729, &end
#
#  chirality for residue 111 atoms:  CA CG HB2 HB3
 &rst iat=1743,1748,1746,1747, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1741,1751,1744,1745, &end
#
#  chirality for residue 112 atoms:  CA CG1 CG2 HB
 &rst iat=1755,1759,1763,1758, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1753,1767,1756,1757, &end
#
#  chirality for residue 113 atoms:  CA CG1 CG2 HB
 &rst iat=1771,1775,1779,1774, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1769,1783,1772,1773, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1795,1789,1793,1794, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=1792,1786,1790,1791, &end
#
#  chirality for residue 114 atoms:  CG N HD2 HD3
 &rst iat=1789,1785,1787,1788, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1785,1797,1796,1792, &end
#
#  chirality for residue 115 atoms:  CA CG1 CG2 HB
 &rst iat=1801,1805,1809,1804, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1799,1813,1802,1803, &end
#
#  chirality for residue 116 atoms:  CA CG HB2 HB3
 &rst iat=1817,1822,1820,1821, &end
#
#  chirality for residue 116 atoms:  CB CD HG2 HG3
 &rst iat=1819,1825,1823,1824, &end
#
#  chirality for residue 116 atoms:  CD NZ HE2 HE3
 &rst iat=1825,1831,1829,1830, &end
#
#  chirality for residue 116 atoms:  CG CE HD2 HD3
 &rst iat=1822,1828,1826,1827, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1815,1835,1818,1819, &end
#
#  chirality for residue 117 atoms:  CA CG HB2 HB3
 &rst iat=1839,1844,1842,1843, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1837,1849,1840,1841, &end
#
#  chirality for residue 118 atoms:  CA CG HB2 HB3
 &rst iat=1853,1858,1856,1857, &end
#
#  chirality for residue 118 atoms:  CB CD HG2 HG3
 &rst iat=1855,1861,1859,1860, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1851,1864,1854,1855, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1868,1873,1871,1872, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1866,1876,1869,1870, &end
#
#  chirality for residue 120 atoms:  N C HA2 HA3
 &rst iat=1878,1883,1881,1882, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1885,1893,1888,1889, &end
#
#  chirality for residue 122 atoms:  CA CG1 CG2 HB
 &rst iat=1897,1901,1905,1900, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1895,1909,1898,1899, &end
#
#  chirality for residue 123 atoms:  CA CG2 CG1 HB
 &rst iat=1913,1917,1921,1916, &end
#
#  chirality for residue 123 atoms:  CB CD1 HG12 HG13
 &rst iat=1915,1924,1922,1923, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1911,1928,1914,1915, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1932,1937,1935,1936, &end
#
#  chirality for residue 124 atoms:  CB SD HG2 HG3
 &rst iat=1934,1940,1938,1939, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1930,1945,1933,1934, &end
#
#  chirality for residue 125 atoms:  CA CG HB2 HB3
 &rst iat=1949,1954,1952,1953, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=1947,1965,1950,1951, &end
#
#  chirality for residue 126 atoms:  CA CG2 CG1 HB
 &rst iat=1969,1973,1977,1972, &end
#
#  chirality for residue 126 atoms:  CB CD1 HG12 HG13
 &rst iat=1971,1980,1978,1979, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=1967,1984,1970,1971, &end
#
#  chirality for residue 127 atoms:  CA CG HB2 HB3
 &rst iat=1988,1993,1991,1992, &end
#
#  chirality for residue 127 atoms:  CB CD1 CD2 HG
 &rst iat=1990,1995,1999,1994, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=1986,2003,1989,1990, &end
#
#  chirality for residue 128 atoms:  CA CG HB2 HB3
 &rst iat=2007,2012,2010,2011, &end
#
#  chirality for residue 128 atoms:  N C HA CB
 &rst iat=2005,2017,2008,2009, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=2021,2026,2024,2025, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=2019,2037,2022,2023, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=2041,2046,2044,2045, &end
#
#  chirality for residue 130 atoms:  CB CD HG2 HG3
 &rst iat=2043,2049,2047,2048, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=2039,2052,2042,2043, &end
#
#  chirality for residue 131 atoms:  CA CG1 CG2 HB
 &rst iat=2056,2060,2064,2059, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=2054,2068,2057,2058, &end
#
#  chirality for residue 132 atoms:  CA CG1 CG2 HB
 &rst iat=2072,2076,2080,2075, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=2070,2084,2073,2074, &end
#
#  chirality for residue 133 atoms:  CA CG HB2 HB3
 &rst iat=2088,2093,2091,2092, &end
#
#  chirality for residue 133 atoms:  CB SD HG2 HG3
 &rst iat=2090,2096,2094,2095, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=2086,2101,2089,2090, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=2105,2110,2108,2109, &end
#
#  chirality for residue 134 atoms:  CB CD HG2 HG3
 &rst iat=2107,2113,2111,2112, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=2103,2116,2106,2107, &end
#
#  chirality for residue 135 atoms:  CA CG HB2 HB3
 &rst iat=2120,2125,2123,2124, &end
#
#  chirality for residue 135 atoms:  CB CD HG2 HG3
 &rst iat=2122,2128,2126,2127, &end
#
#  chirality for residue 135 atoms:  CD NZ HE2 HE3
 &rst iat=2128,2134,2132,2133, &end
#
#  chirality for residue 135 atoms:  CG CE HD2 HD3
 &rst iat=2125,2131,2129,2130, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=2118,2138,2121,2122, &end
#
#  trans-omega constraint for residue 2
 &rst iat=30,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=36,34,32,30, &end
#
#  trans-omega constraint for residue 4
 &rst iat=52,50,48,36, &end
#
#  trans-omega constraint for residue 5
 &rst iat=76,74,72,52, &end
#
#  trans-omega constraint for residue 6
 &rst iat=100,98,96,76, &end
#
#  trans-omega constraint for residue 7
 &rst iat=107,105,103,100, &end
#
#  trans-omega constraint for residue 8
 &rst iat=124,122,120,107, &end
#
#  trans-omega constraint for residue 9
 &rst iat=140,138,136,124, &end
#
#  trans-omega constraint for residue 10
 &rst iat=158,148,146,140, &end
#
#  trans-omega constraint for residue 11
 &rst iat=164,162,160,158, &end
#
#  trans-omega constraint for residue 12
 &rst iat=181,179,177,164, &end
#
#  trans-omega constraint for residue 13
 &rst iat=195,193,191,181, &end
#
#  trans-omega constraint for residue 14
 &rst iat=209,207,205,195, &end
#
#  trans-omega constraint for residue 15
 &rst iat=229,227,225,209, &end
#
#  trans-omega constraint for residue 16
 &rst iat=248,246,244,229, &end
#
#  trans-omega constraint for residue 17
 &rst iat=260,258,256,248, &end
#
#  trans-omega constraint for residue 18
 &rst iat=274,272,270,260, &end
#
#  trans-omega constraint for residue 19
 &rst iat=293,291,289,274, &end
#
#  trans-omega constraint for residue 20
 &rst iat=312,310,308,293, &end
#
#  trans-omega constraint for residue 21
 &rst iat=336,334,332,312, &end
#
#  trans-omega constraint for residue 22
 &rst iat=358,356,354,336, &end
#
#  trans-omega constraint for residue 23
 &rst iat=378,376,374,358, &end
#
#  trans-omega constraint for residue 24
 &rst iat=393,391,389,378, &end
#
#  trans-omega constraint for residue 25
 &rst iat=400,398,396,393, &end
#
#  trans-omega constraint for residue 26
 &rst iat=417,415,413,400, &end
#
#  trans-omega constraint for residue 27
 &rst iat=428,426,424,417, &end
#
#  trans-omega constraint for residue 28
 &rst iat=452,450,448,428, &end
#
#  trans-omega constraint for residue 29
 &rst iat=474,472,470,452, &end
#
#  trans-omega constraint for residue 30
 &rst iat=494,492,490,474, &end
#
#  trans-omega constraint for residue 31
 &rst iat=513,511,509,494, &end
#
#  trans-omega constraint for residue 32
 &rst iat=532,530,528,513, &end
#
#  trans-omega constraint for residue 33
 &rst iat=542,540,538,532, &end
#
#  trans-omega constraint for residue 34
 &rst iat=556,554,552,542, &end
#
#  trans-omega constraint for residue 35
 &rst iat=566,564,562,556, &end
#
#  trans-omega constraint for residue 36
 &rst iat=590,588,586,566, &end
#
#  trans-omega constraint for residue 37
 &rst iat=606,604,602,590, &end
#
#  trans-omega constraint for residue 38
 &rst iat=621,619,617,606, &end
#
#  trans-omega constraint for residue 39
 &rst iat=635,633,631,621, &end
#
#  trans-omega constraint for residue 40
 &rst iat=646,644,642,635, &end
#
#  trans-omega constraint for residue 41
 &rst iat=656,654,652,646, &end
#
#  trans-omega constraint for residue 42
 &rst iat=672,670,668,656, &end
#
#  trans-omega constraint for residue 43
 &rst iat=691,689,687,672, &end
#
#  trans-omega constraint for residue 44
 &rst iat=712,710,708,691, &end
#
#  trans-omega constraint for residue 45
 &rst iat=723,721,719,712, &end
#
#  trans-omega constraint for residue 46
 &rst iat=737,735,733,723, &end
#
#  trans-omega constraint for residue 47
 &rst iat=749,747,745,737, &end
#
#  trans-omega constraint for residue 48
 &rst iat=756,754,752,749, &end
#
#  trans-omega constraint for residue 49
 &rst iat=776,774,772,756, &end
#
#  trans-omega constraint for residue 50
 &rst iat=787,785,783,776, &end
#
#  trans-omega constraint for residue 51
 &rst iat=802,800,798,787, &end
#
#  trans-omega constraint for residue 52
 &rst iat=821,819,817,802, &end
#
#  trans-omega constraint for residue 53
 &rst iat=832,830,828,821, &end
#
#  trans-omega constraint for residue 54
 &rst iat=839,837,835,832, &end
#
#  trans-omega constraint for residue 55
 &rst iat=860,858,856,839, &end
#
#  trans-omega constraint for residue 56
 &rst iat=871,869,867,860, &end
#
#  trans-omega constraint for residue 57
 &rst iat=895,893,891,871, &end
#
#  trans-omega constraint for residue 58
 &rst iat=905,903,901,895, &end
#
#  trans-omega constraint for residue 59
 &rst iat=920,918,916,905, &end
#
#  trans-omega constraint for residue 60
 &rst iat=936,934,932,920, &end
#
#  trans-omega constraint for residue 61
 &rst iat=953,951,949,936, &end
#
#  trans-omega constraint for residue 62
 &rst iat=970,968,966,953, &end
#
#  trans-omega constraint for residue 63
 &rst iat=1002,992,990,970, &end
#
#  trans-omega constraint for residue 64
 &rst iat=1008,1006,1004,1002, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1019,1017,1015,1008, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1033,1031,1029,1019, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1044,1042,1040,1033, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1056,1054,1052,1044, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1076,1074,1072,1056, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1095,1093,1091,1076, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1112,1110,1108,1095, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1127,1117,1115,1112, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1133,1131,1129,1127, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1157,1155,1153,1133, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1171,1169,1167,1157, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1188,1186,1184,1171, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1212,1210,1208,1188, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1236,1234,1232,1212, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1246,1244,1242,1236, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1256,1254,1252,1246, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1266,1264,1262,1256, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1283,1281,1279,1266, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1302,1300,1298,1283, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1312,1310,1308,1302, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1329,1327,1325,1312, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1339,1337,1335,1329, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1358,1356,1354,1339, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1377,1375,1373,1358, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1384,1382,1380,1377, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1394,1392,1390,1384, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1409,1407,1405,1394, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1424,1422,1420,1409, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1448,1446,1444,1424, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1470,1468,1466,1448, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1486,1484,1482,1470, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1501,1499,1497,1486, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1520,1518,1516,1501, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1530,1528,1526,1520, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1550,1548,1546,1530, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1571,1569,1567,1550, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1595,1593,1591,1571, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1617,1615,1613,1595, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1629,1627,1625,1617, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1636,1634,1632,1629, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1647,1645,1643,1636, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1658,1656,1654,1647, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1678,1676,1674,1658, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1697,1695,1693,1678, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1708,1706,1704,1697, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1727,1725,1723,1708, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1743,1741,1739,1727, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1755,1753,1751,1743, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1771,1769,1767,1755, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1795,1785,1783,1771, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1801,1799,1797,1795, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1817,1815,1813,1801, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1839,1837,1835,1817, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1853,1851,1849,1839, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1868,1866,1864,1853, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1880,1878,1876,1868, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1887,1885,1883,1880, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1897,1895,1893,1887, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1913,1911,1909,1897, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1932,1930,1928,1913, &end
#
#  trans-omega constraint for residue 125
 &rst iat=1949,1947,1945,1932, &end
#
#  trans-omega constraint for residue 126
 &rst iat=1969,1967,1965,1949, &end
#
#  trans-omega constraint for residue 127
 &rst iat=1988,1986,1984,1969, &end
#
#  trans-omega constraint for residue 128
 &rst iat=2007,2005,2003,1988, &end
#
#  trans-omega constraint for residue 129
 &rst iat=2021,2019,2017,2007, &end
#
#  trans-omega constraint for residue 130
 &rst iat=2041,2039,2037,2021, &end
#
#  trans-omega constraint for residue 131
 &rst iat=2056,2054,2052,2041, &end
#
#  trans-omega constraint for residue 132
 &rst iat=2072,2070,2068,2056, &end
#
#  trans-omega constraint for residue 133
 &rst iat=2088,2086,2084,2072, &end
#
#  trans-omega constraint for residue 134
 &rst iat=2105,2103,2101,2088, &end
#
#  trans-omega constraint for residue 135
 &rst iat=2120,2118,2116,2105, &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1 -11.684  -6.985   2.877
    2    H2   MET   1           2H       MET   1 -13.015  -6.290   2.213
    3    H3   MET   1           3H       MET   1 -12.724  -6.135   3.814
    4    HA   MET   1           HA       MET   1 -10.772  -4.823   3.430
    5    HB2  MET   1           2HB      MET   1 -11.429  -5.312   0.499
    6    HB3  MET   1           3HB      MET   1 -10.425  -3.971   1.041
    7    HG2  MET   1           2HG      MET   1  -8.953  -5.711   0.391
    8    HG3  MET   1           3HG      MET   1  -8.866  -5.532   2.135
    9    HE1  MET   1           3HE      MET   1  -9.548  -7.856  -0.880
   10    HE2  MET   1           1HE      MET   1 -10.522  -9.176  -0.201
   11    HE3  MET   1           2HE      MET   1 -11.237  -7.563  -0.403
   12    HA   PRO   2           HA       PRO   2 -13.653  -1.601   3.970
   13    HB2  PRO   2           2HB      PRO   2 -11.428   0.340   3.369
   14    HB3  PRO   2           3HB      PRO   2 -12.514   0.268   4.790
   15    HG2  PRO   2           2HG      PRO   2  -9.972  -0.625   4.986
   16    HG3  PRO   2           3HG      PRO   2 -11.306  -1.589   5.704
   17    HD2  PRO   2           2HD      PRO   2  -9.946  -1.979   3.017
   18    HD3  PRO   2           3HD      PRO   2 -10.282  -3.180   4.299
   19    H    VAL   3           H        VAL   3 -11.779  -1.424   0.984
   20    HA   VAL   3           HA       VAL   3 -14.040  -0.272  -0.506
   21    HB   VAL   3           HB       VAL   3 -12.750   1.668   0.356
   22   HG11  VAL   3          1HG1      VAL   3 -10.477   0.724   0.393
   23   HG12  VAL   3          2HG1      VAL   3 -10.461   0.667  -1.382
   24   HG13  VAL   3          3HG1      VAL   3 -10.546   2.225  -0.538
   25   HG21  VAL   3          3HG2      VAL   3 -12.636   2.923  -1.674
   26   HG22  VAL   3          1HG2      VAL   3 -12.525   1.465  -2.666
   27   HG23  VAL   3          2HG2      VAL   3 -14.021   1.827  -1.766
   28    H    ARG   4           H        ARG   4 -13.782  -0.495  -2.824
   29    HA   ARG   4           HA       ARG   4 -12.506  -3.012  -3.531
   30    HB2  ARG   4           2HB      ARG   4 -13.786  -2.932  -5.535
   31    HB3  ARG   4           3HB      ARG   4 -14.779  -2.569  -4.131
   32    HG2  ARG   4           2HG      ARG   4 -14.558  -0.077  -4.770
   33    HG3  ARG   4           3HG      ARG   4 -13.845  -0.636  -6.292
   34    HD2  ARG   4           2HD      ARG   4 -15.916  -2.125  -6.556
   35    HD3  ARG   4           3HD      ARG   4 -16.642  -1.217  -5.233
   36    HE   ARG   4           HE       ARG   4 -16.303  -0.407  -7.997
   37   HH11  ARG   4          1HH1      ARG   4 -16.582   1.047  -4.809
   38   HH12  ARG   4          2HH1      ARG   4 -17.143   2.558  -5.473
   39   HH21  ARG   4          1HH2      ARG   4 -17.122   1.493  -8.730
   40   HH22  ARG   4          2HH2      ARG   4 -17.415   2.812  -7.625
   41    H    ARG   5           H        ARG   5 -10.443  -1.758  -2.950
   42    HA   ARG   5           HA       ARG   5  -9.001  -1.050  -5.490
   43    HB2  ARG   5           2HB      ARG   5  -8.529   0.141  -2.726
   44    HB3  ARG   5           3HB      ARG   5  -7.553   0.470  -4.150
   45    HG2  ARG   5           2HG      ARG   5 -10.517   1.167  -3.917
   46    HG3  ARG   5           3HG      ARG   5  -9.187   2.268  -3.562
   47    HD2  ARG   5           2HD      ARG   5  -8.361   2.052  -5.880
   48    HD3  ARG   5           3HD      ARG   5  -9.721   0.975  -6.267
   49    HE   ARG   5           HE       ARG   5 -10.957   3.214  -5.238
   50   HH11  ARG   5          1HH1      ARG   5  -8.713   2.841  -7.958
   51   HH12  ARG   5          2HH1      ARG   5  -9.470   4.210  -8.777
   52   HH21  ARG   5          2HH2      ARG   5 -11.827   4.852  -6.512
   53   HH22  ARG   5          1HH2      ARG   5 -10.956   5.285  -7.986
   54    H    GLY   6           H        GLY   6  -6.875  -1.721  -5.684
   55    HA2  GLY   6           HA2      GLY   6  -4.987  -3.035  -5.332
   56    HA3  GLY   6           HA3      GLY   6  -5.564  -3.443  -3.715
   57    H    HIS   7           H        HIS   7  -7.868  -4.764  -4.002
   58    HA   HIS   7           HA       HIS   7  -7.283  -7.151  -5.669
   59    HB2  HIS   7           2HB      HIS   7  -8.934  -8.281  -4.413
   60    HB3  HIS   7           3HB      HIS   7  -7.959  -7.380  -3.260
   61    HD2  HIS   7           HD2      HIS   7 -11.511  -7.822  -4.487
   62    HE1  HIS   7           HE1      HIS   7 -11.677  -4.533  -1.777
   63    HE2  HIS   7           HE2      HIS   7 -13.069  -6.188  -3.129
   64    H    VAL   8           H        VAL   8  -8.898  -8.083  -7.041
   65    HA   VAL   8           HA       VAL   8 -11.090  -6.304  -7.988
   66    HB   VAL   8           HB       VAL   8  -9.388  -7.948  -9.899
   67   HG11  VAL   8          1HG1      VAL   8 -11.529  -5.821 -10.376
   68   HG12  VAL   8          2HG1      VAL   8 -10.575  -6.636 -11.634
   69   HG13  VAL   8          3HG1      VAL   8 -11.712  -7.563 -10.664
   70   HG21  VAL   8          3HG2      VAL   8  -7.999  -6.077  -9.133
   71   HG22  VAL   8          1HG2      VAL   8  -8.554  -5.772 -10.777
   72   HG23  VAL   8          2HG2      VAL   8  -9.335  -4.937  -9.415
   73    H    ALA   9           H        ALA   9 -13.017  -7.355  -8.225
   74    HA   ALA   9           HA       ALA   9 -13.383 -10.052  -7.261
   75    HB1  ALA   9           3HB      ALA   9 -15.749  -9.610  -7.931
   76    HB2  ALA   9           1HB      ALA   9 -15.067  -8.263  -7.005
   77    HB3  ALA   9           2HB      ALA   9 -15.230  -8.141  -8.772
   78    HA   PRO  10           HA       PRO  10 -13.069 -12.411 -11.131
   79    HB2  PRO  10           2HB      PRO  10 -15.346 -14.010 -11.052
   80    HB3  PRO  10           3HB      PRO  10 -13.802 -14.346 -10.241
   81    HG2  PRO  10           2HG      PRO  10 -16.296 -13.057  -9.082
   82    HG3  PRO  10           3HG      PRO  10 -15.262 -14.318  -8.342
   83    HD2  PRO  10           2HD      PRO  10 -15.044 -11.717  -7.643
   84    HD3  PRO  10           3HD      PRO  10 -13.584 -12.732  -7.804
   85    H    GLN  11           H        GLN  11 -13.294 -11.040 -12.738
   86    HA   GLN  11           HA       GLN  11 -15.369  -9.206 -13.016
   87    HB2  GLN  11           2HB      GLN  11 -14.280  -8.410 -14.937
   88    HB3  GLN  11           3HB      GLN  11 -13.042  -8.932 -13.810
   89    HG2  GLN  11           2HG      GLN  11 -13.968 -10.398 -16.322
   90    HG3  GLN  11           3HG      GLN  11 -12.471  -9.502 -16.117
   91   HE21  GLN  11          2HE2      GLN  11 -13.244 -12.519 -16.627
   92   HE22  GLN  11          1HE2      GLN  11 -12.126 -13.324 -15.524
   93    H    ASN  12           H        ASN  12 -15.302 -12.453 -14.341
   94    HA   ASN  12           HA       ASN  12 -17.140 -11.938 -16.541
   95    HB2  ASN  12           2HB      ASN  12 -16.135 -14.449 -15.127
   96    HB3  ASN  12           3HB      ASN  12 -17.395 -14.510 -16.355
   97   HD21  ASN  12          1HD2      ASN  12 -15.600 -15.981 -17.263
   98   HD22  ASN  12          2HD2      ASN  12 -14.486 -15.172 -18.355
   99    H    THR  13           H        THR  13 -17.580 -13.367 -13.294
  100    HA   THR  13           HA       THR  13 -20.482 -13.497 -13.531
  101    HB   THR  13           HB       THR  13 -18.944 -15.043 -12.251
  102    HG1  THR  13           HG1      THR  13 -20.550 -15.418 -10.720
  103   HG21  THR  13          1HG2      THR  13 -19.185 -12.956 -10.064
  104   HG22  THR  13          2HG2      THR  13 -18.385 -14.547  -9.970
  105   HG23  THR  13          3HG2      THR  13 -17.728 -13.272 -11.017
  106    H    PHE  14           H        PHE  14 -18.146 -11.295 -11.987
  107    HA   PHE  14           HA       PHE  14 -19.975  -9.593 -10.626
  108    HB2  PHE  14           2HB      PHE  14 -17.509  -9.628 -10.420
  109    HB3  PHE  14           3HB      PHE  14 -17.355  -8.982 -12.041
  110    HD1  PHE  14           HD2      PHE  14 -18.399  -8.215  -8.560
  111    HD2  PHE  14           HD1      PHE  14 -17.744  -6.612 -12.512
  112    HE1  PHE  14           HE2      PHE  14 -18.533  -5.906  -7.648
  113    HE2  PHE  14           HE1      PHE  14 -17.882  -4.306 -11.597
  114    HZ   PHE  14           HZ       PHE  14 -18.276  -3.951  -9.166
  115    H    LEU  15           H        LEU  15 -18.803  -9.609 -14.017
  116    HA   LEU  15           HA       LEU  15 -20.493  -7.375 -14.799
  117    HB2  LEU  15           2HB      LEU  15 -18.505  -7.841 -16.081
  118    HB3  LEU  15           3HB      LEU  15 -19.065  -9.479 -16.451
  119    HG   LEU  15           HG       LEU  15 -20.905  -8.626 -17.777
  120   HD11  LEU  15          1HD1      LEU  15 -21.117  -6.224 -18.355
  121   HD12  LEU  15          2HD1      LEU  15 -21.414  -6.491 -16.649
  122   HD13  LEU  15          3HD1      LEU  15 -19.856  -5.825 -17.154
  123   HD21  LEU  15          3HD2      LEU  15 -18.276  -7.290 -18.533
  124   HD22  LEU  15          1HD2      LEU  15 -18.721  -8.980 -18.860
  125   HD23  LEU  15          2HD2      LEU  15 -19.619  -7.665 -19.637
  126    H    ASP  16           H        ASP  16 -20.909 -10.949 -15.181
  127    HA   ASP  16           HA       ASP  16 -23.398 -11.087 -16.382
  128    HB2  ASP  16           2HB      ASP  16 -21.950 -12.985 -15.663
  129    HB3  ASP  16           3HB      ASP  16 -22.500 -12.747 -14.011
  130    H    THR  17           H        THR  17 -22.773 -10.325 -12.998
  131    HA   THR  17           HA       THR  17 -25.543 -10.156 -12.127
  132    HB   THR  17           HB       THR  17 -23.118  -8.694 -11.009
  133    HG1  THR  17           HG1      THR  17 -22.860 -10.919 -10.930
  134   HG21  THR  17          1HG2      THR  17 -25.188  -7.692 -10.169
  135   HG22  THR  17          2HG2      THR  17 -25.845  -9.302  -9.790
  136   HG23  THR  17          3HG2      THR  17 -24.439  -8.672  -8.901
  137    H    ILE  18           H        ILE  18 -23.340  -7.744 -13.552
  138    HA   ILE  18           HA       ILE  18 -25.239  -5.546 -13.404
  139    HB   ILE  18           HB       ILE  18 -22.856  -5.872 -15.232
  140   HG12  ILE  18          2HG1      ILE  18 -22.065  -6.055 -12.948
  141   HG13  ILE  18          3HG1      ILE  18 -21.494  -4.614 -13.742
  142   HG21  ILE  18          1HG2      ILE  18 -24.434  -3.406 -14.425
  143   HG22  ILE  18          2HG2      ILE  18 -22.856  -3.354 -15.246
  144   HG23  ILE  18          3HG2      ILE  18 -24.236  -4.096 -16.044
  145   HD11  ILE  18          3HD1      ILE  18 -23.803  -4.763 -11.722
  146   HD12  ILE  18          1HD1      ILE  18 -22.149  -4.236 -11.360
  147   HD13  ILE  18          2HD1      ILE  18 -23.161  -3.266 -12.443
  148    H    ILE  19           H        ILE  19 -24.391  -8.031 -15.852
  149    HA   ILE  19           HA       ILE  19 -26.052  -7.102 -17.916
  150    HB   ILE  19           HB       ILE  19 -25.608 -10.018 -17.156
  151   HG12  ILE  19          2HG1      ILE  19 -23.419  -9.221 -17.602
  152   HG13  ILE  19          3HG1      ILE  19 -23.936 -10.030 -19.055
  153   HG21  ILE  19          1HG2      ILE  19 -26.135 -10.454 -19.562
  154   HG22  ILE  19          2HG2      ILE  19 -27.499  -9.833 -18.638
  155   HG23  ILE  19          3HG2      ILE  19 -26.609  -8.746 -19.721
  156   HD11  ILE  19          3HD1      ILE  19 -23.764  -7.045 -18.548
  157   HD12  ILE  19          1HD1      ILE  19 -22.797  -8.019 -19.663
  158   HD13  ILE  19          2HD1      ILE  19 -24.538  -7.739 -19.998
  159    H    ARG  20           H        ARG  20 -26.880  -9.366 -15.231
  160    HA   ARG  20           HA       ARG  20 -29.708  -9.501 -15.807
  161    HB2  ARG  20           2HB      ARG  20 -28.037  -9.995 -13.338
  162    HB3  ARG  20           3HB      ARG  20 -29.805 -10.096 -13.290
  163    HG2  ARG  20           2HG      ARG  20 -29.876 -11.779 -15.012
  164    HG3  ARG  20           3HG      ARG  20 -28.135 -11.646 -15.321
  165    HD2  ARG  20           2HD      ARG  20 -29.318 -12.441 -12.637
  166    HD3  ARG  20           3HD      ARG  20 -28.857 -13.601 -13.895
  167    HE   ARG  20           HE       ARG  20 -26.551 -12.413 -13.792
  168   HH11  ARG  20          2HH1      ARG  20 -28.423 -12.682 -10.830
  169   HH12  ARG  20          1HH1      ARG  20 -26.986 -12.953  -9.880
  170   HH21  ARG  20          1HH2      ARG  20 -24.935 -13.111 -12.635
  171   HH22  ARG  20          2HH2      ARG  20 -24.972 -13.006 -10.875
  172    H    LYS  21           H        LYS  21 -27.821  -7.144 -14.086
  173    HA   LYS  21           HA       LYS  21 -30.052  -5.645 -13.011
  174    HB2  LYS  21           2HB      LYS  21 -27.298  -5.426 -12.795
  175    HB3  LYS  21           3HB      LYS  21 -27.687  -4.034 -13.807
  176    HG2  LYS  21           2HG      LYS  21 -27.719  -3.286 -11.546
  177    HG3  LYS  21           3HG      LYS  21 -29.413  -3.398 -12.050
  178    HD2  LYS  21           2HD      LYS  21 -29.578  -5.625 -10.918
  179    HD3  LYS  21           3HD      LYS  21 -27.885  -5.481 -10.412
  180    HE2  LYS  21           2HE      LYS  21 -28.383  -3.609  -8.980
  181    HE3  LYS  21           3HE      LYS  21 -29.991  -3.406  -9.698
  182    HZ1  LYS  21           HZ1      LYS  21 -29.191  -5.800  -8.145
  183    HZ2  LYS  21           HZ2      LYS  21 -30.111  -4.584  -7.545
  184    HZ3  LYS  21           HZ3      LYS  21 -30.677  -5.488  -8.784
  185    H    PHE  22           H        PHE  22 -28.356  -5.217 -16.153
  186    HA   PHE  22           HA       PHE  22 -30.601  -3.446 -16.977
  187    HB2  PHE  22           2HB      PHE  22 -29.285  -2.492 -18.633
  188    HB3  PHE  22           3HB      PHE  22 -28.361  -2.510 -17.155
  189    HD1  PHE  22           HD2      PHE  22 -28.677  -4.027 -20.562
  190    HD2  PHE  22           HD1      PHE  22 -26.214  -3.575 -17.061
  191    HE1  PHE  22           HE2      PHE  22 -26.763  -4.996 -21.792
  192    HE2  PHE  22           HE1      PHE  22 -24.280  -4.529 -18.310
  193    HZ   PHE  22           HZ       PHE  22 -24.556  -5.245 -20.671
  194    H    GLU  23           H        GLU  23 -30.366  -6.596 -17.067
  195    HA   GLU  23           HA       GLU  23 -30.316  -7.519 -19.617
  196    HB2  GLU  23           2HB      GLU  23 -30.132  -9.002 -17.821
  197    HB3  GLU  23           3HB      GLU  23 -31.630  -8.505 -17.081
  198    HG2  GLU  23           2HG      GLU  23 -31.833  -9.839 -19.767
  199    HG3  GLU  23           3HG      GLU  23 -31.217 -10.790 -18.432
  200    H    GLY  24           H        GLY  24 -33.161  -6.105 -18.092
  201    HA2  GLY  24           HA2      GLY  24 -35.020  -5.100 -18.974
  202    HA3  GLY  24           HA3      GLY  24 -34.184  -5.122 -20.520
  203    H    GLN  25           H        GLN  25 -34.892  -8.258 -19.206
  204    HA   GLN  25           HA       GLN  25 -37.184  -8.596 -21.133
  205    HB2  GLN  25           2HB      GLN  25 -34.782 -10.353 -20.546
  206    HB3  GLN  25           3HB      GLN  25 -36.210 -10.935 -21.404
  207    HG2  GLN  25           2HG      GLN  25 -35.853  -9.522 -23.264
  208    HG3  GLN  25           3HG      GLN  25 -34.781  -8.440 -22.381
  209   HE21  GLN  25          2HE2      GLN  25 -32.585  -9.048 -21.973
  210   HE22  GLN  25          1HE2      GLN  25 -31.845 -10.359 -22.902
  211    H    SER  26           H        SER  26 -35.675  -9.876 -18.167
  212    HA   SER  26           HA       SER  26 -38.397 -10.502 -17.067
  213    HB2  SER  26           2HB      SER  26 -35.723 -11.762 -16.366
  214    HB3  SER  26           3HB      SER  26 -37.245 -12.036 -15.503
  215    HG   SER  26           HG       SER  26 -36.799 -13.648 -17.113
  216    H    ARG  27           H        ARG  27 -35.366  -8.736 -16.626
  217    HA   ARG  27           HA       ARG  27 -36.416  -7.540 -14.102
  218    HB2  ARG  27           2HB      ARG  27 -33.642  -7.497 -15.353
  219    HB3  ARG  27           3HB      ARG  27 -34.087  -6.619 -13.892
  220    HG2  ARG  27           2HG      ARG  27 -34.092  -9.662 -14.214
  221    HG3  ARG  27           3HG      ARG  27 -32.964  -8.673 -13.295
  222    HD2  ARG  27           2HD      ARG  27 -35.435  -7.955 -12.254
  223    HD3  ARG  27           3HD      ARG  27 -35.693  -9.641 -12.640
  224    HE   ARG  27           HE       ARG  27 -34.041  -8.488 -10.518
  225   HH11  ARG  27          2HH2      ARG  27 -34.260 -11.477 -12.359
  226   HH12  ARG  27          1HH2      ARG  27 -33.350 -12.333 -11.143
  227   HH21  ARG  27          1HH1      ARG  27 -32.989  -9.500  -9.163
  228   HH22  ARG  27          2HH1      ARG  27 -32.607 -11.221  -9.306
  229    H    LYS  28           H        LYS  28 -36.218  -5.250 -13.756
  230    HA   LYS  28           HA       LYS  28 -36.980  -3.639 -16.154
  231    HB2  LYS  28           2HB      LYS  28 -38.563  -3.644 -13.551
  232    HB3  LYS  28           3HB      LYS  28 -38.963  -2.859 -15.041
  233    HG2  LYS  28           2HG      LYS  28 -40.377  -4.629 -15.218
  234    HG3  LYS  28           3HG      LYS  28 -39.004  -5.355 -16.017
  235    HD2  LYS  28           2HD      LYS  28 -38.488  -6.627 -13.979
  236    HD3  LYS  28           3HD      LYS  28 -39.690  -5.713 -13.049
  237    HE2  LYS  28           2HE      LYS  28 -41.516  -6.654 -14.251
  238    HE3  LYS  28           3HE      LYS  28 -40.477  -7.219 -15.557
  239    HZ1  LYS  28           HZ1      LYS  28 -39.521  -8.857 -14.062
  240    HZ2  LYS  28           HZ2      LYS  28 -40.439  -8.343 -12.800
  241    HZ3  LYS  28           HZ3      LYS  28 -41.142  -9.047 -14.096
  242    H    PHE  29           H        PHE  29 -36.681  -1.337 -15.983
  243    HA   PHE  29           HA       PHE  29 -35.569  -0.139 -13.599
  244    HB2  PHE  29           2HB      PHE  29 -33.237   0.052 -14.287
  245    HB3  PHE  29           3HB      PHE  29 -33.668  -1.624 -14.120
  246    HD1  PHE  29           HD2      PHE  29 -34.004  -3.087 -16.158
  247    HD2  PHE  29           HD1      PHE  29 -32.419   0.927 -16.367
  248    HE1  PHE  29           HE2      PHE  29 -33.086  -3.554 -18.416
  249    HE2  PHE  29           HE1      PHE  29 -31.446   0.420 -18.599
  250    HZ   PHE  29           HZ       PHE  29 -31.775  -1.826 -19.617
  251    H    ILE  30           H        ILE  30 -34.625   1.959 -13.822
  252    HA   ILE  30           HA       ILE  30 -35.239   3.400 -16.351
  253    HB   ILE  30           HB       ILE  30 -35.950   5.360 -14.922
  254   HG12  ILE  30          2HG1      ILE  30 -36.911   5.017 -12.749
  255   HG13  ILE  30          3HG1      ILE  30 -36.501   3.303 -12.750
  256   HG21  ILE  30          1HG2      ILE  30 -38.239   4.640 -14.878
  257   HG22  ILE  30          2HG2      ILE  30 -37.421   3.918 -16.280
  258   HG23  ILE  30          3HG2      ILE  30 -37.755   2.928 -14.848
  259   HD11  ILE  30          3HD1      ILE  30 -34.418   5.532 -12.792
  260   HD12  ILE  30          1HD1      ILE  30 -35.027   4.742 -11.333
  261   HD13  ILE  30          2HD1      ILE  30 -34.137   3.788 -12.516
  262    H    ILE  31           H        ILE  31 -34.228   5.644 -16.297
  263    HA   ILE  31           HA       ILE  31 -31.501   5.575 -15.094
  264    HB   ILE  31           HB       ILE  31 -32.175   6.676 -17.820
  265   HG12  ILE  31          2HG1      ILE  31 -32.646   4.242 -17.942
  266   HG13  ILE  31          3HG1      ILE  31 -31.294   4.751 -18.957
  267   HG21  ILE  31          1HG2      ILE  31 -30.180   7.604 -16.806
  268   HG22  ILE  31          2HG2      ILE  31 -29.520   5.992 -16.506
  269   HG23  ILE  31          3HG2      ILE  31 -29.727   6.578 -18.171
  270   HD11  ILE  31          3HD1      ILE  31 -30.920   2.613 -17.659
  271   HD12  ILE  31          1HD1      ILE  31 -29.663   3.857 -17.496
  272   HD13  ILE  31          2HD1      ILE  31 -30.846   3.635 -16.197
  273    H    ALA  32           H        ALA  32 -31.294   7.220 -13.808
  274    HA   ALA  32           HA       ALA  32 -32.529   9.837 -14.560
  275    HB1  ALA  32           3HB      ALA  32 -32.687   8.508 -11.836
  276    HB2  ALA  32           1HB      ALA  32 -33.095  10.196 -12.131
  277    HB3  ALA  32           2HB      ALA  32 -34.020   8.897 -12.922
  278    H    ASN  33           H        ASN  33 -31.673  11.759 -13.710
  279    HA   ASN  33           HA       ASN  33 -28.740  11.605 -13.304
  280    HB2  ASN  33           2HB      ASN  33 -28.850  14.117 -13.359
  281    HB3  ASN  33           3HB      ASN  33 -29.216  13.267 -14.838
  282   HD21  ASN  33          2HD2      ASN  33 -29.968  15.552 -15.280
  283   HD22  ASN  33          1HD2      ASN  33 -31.672  15.825 -14.955
  284    H    ALA  34           H        ALA  34 -28.039  11.071 -11.367
  285    HA   ALA  34           HA       ALA  34 -29.424  11.589  -8.882
  286    HB1  ALA  34           3HB      ALA  34 -27.399  10.622  -7.886
  287    HB2  ALA  34           1HB      ALA  34 -27.883   9.670  -9.297
  288    HB3  ALA  34           2HB      ALA  34 -26.523  10.806  -9.412
  289    H    ARG  35           H        ARG  35 -27.445  13.549 -10.830
  290    HA   ARG  35           HA       ARG  35 -26.226  15.143  -8.660
  291    HB2  ARG  35           2HB      ARG  35 -25.990  15.366 -11.683
  292    HB3  ARG  35           3HB      ARG  35 -25.012  16.246 -10.520
  293    HG2  ARG  35           2HG      ARG  35 -24.974  13.211 -10.879
  294    HG3  ARG  35           3HG      ARG  35 -23.845  14.358 -11.575
  295    HD2  ARG  35           2HD      ARG  35 -22.646  13.634  -9.777
  296    HD3  ARG  35           3HD      ARG  35 -23.350  15.110  -9.138
  297    HE   ARG  35           HE       ARG  35 -24.281  12.291  -8.572
  298   HH11  ARG  35          2HH1      ARG  35 -23.969  15.571  -7.335
  299   HH12  ARG  35          1HH1      ARG  35 -24.512  15.083  -5.754
  300   HH21  ARG  35          1HH2      ARG  35 -24.858  11.765  -6.626
  301   HH22  ARG  35          2HH2      ARG  35 -25.053  12.964  -5.356
  302    H    VAL  36           H        VAL  36 -29.222  15.289 -10.005
  303    HA   VAL  36           HA       VAL  36 -29.347  18.272  -9.945
  304    HB   VAL  36           HB       VAL  36 -29.773  16.864 -12.129
  305   HG11  VAL  36          1HG1      VAL  36 -32.579  16.867 -10.969
  306   HG12  VAL  36          2HG1      VAL  36 -32.107  16.413 -12.594
  307   HG13  VAL  36          3HG1      VAL  36 -31.569  15.421 -11.219
  308   HG21  VAL  36          3HG2      VAL  36 -29.909  19.280 -11.973
  309   HG22  VAL  36          1HG2      VAL  36 -31.166  18.590 -13.008
  310   HG23  VAL  36          2HG2      VAL  36 -31.586  19.162 -11.369
  311    H    GLU  37           H        GLU  37 -30.899  19.285  -8.719
  312    HA   GLU  37           HA       GLU  37 -31.815  18.004  -6.382
  313    HB2  GLU  37           2HB      GLU  37 -31.386  20.436  -6.743
  314    HB3  GLU  37           3HB      GLU  37 -32.880  20.547  -7.679
  315    HG2  GLU  37           2HG      GLU  37 -34.197  19.931  -5.689
  316    HG3  GLU  37           3HG      GLU  37 -32.716  19.655  -4.765
  317    H    ASN  38           H        ASN  38 -33.464  18.305  -9.479
  318    HA   ASN  38           HA       ASN  38 -36.042  17.362  -8.465
  319    HB2  ASN  38           2HB      ASN  38 -35.682  19.073 -10.318
  320    HB3  ASN  38           3HB      ASN  38 -35.118  17.747 -11.338
  321   HD21  ASN  38          2HD2      ASN  38 -36.816  17.833 -12.856
  322   HD22  ASN  38          1HD2      ASN  38 -38.486  17.524 -12.409
  323    H    CYS  39           H        CYS  39 -33.226  15.660  -9.042
  324    HA   CYS  39           HA       CYS  39 -32.667  13.582  -9.845
  325    HB2  CYS  39           2HB      CYS  39 -33.627  11.851  -8.375
  326    HB3  CYS  39           3HB      CYS  39 -33.097  13.287  -7.498
  327    HG   CYS  39           HG       CYS  39 -36.173  12.735  -8.558
  328    H    ALA  40           H        ALA  40 -33.801  14.319 -12.070
  329    HA   ALA  40           HA       ALA  40 -36.287  12.886 -12.541
  330    HB1  ALA  40           3HB      ALA  40 -36.481  14.229 -14.541
  331    HB2  ALA  40           1HB      ALA  40 -36.095  15.235 -13.142
  332    HB3  ALA  40           2HB      ALA  40 -34.821  14.838 -14.327
  333    H    VAL  41           H        VAL  41 -36.830  11.575 -14.213
  334    HA   VAL  41           HA       VAL  41 -34.941   9.520 -14.952
  335    HB   VAL  41           HB       VAL  41 -37.895   9.901 -15.564
  336   HG11  VAL  41          1HG1      VAL  41 -37.880   7.439 -15.998
  337   HG12  VAL  41          2HG1      VAL  41 -36.907   8.318 -17.175
  338   HG13  VAL  41          3HG1      VAL  41 -36.108   7.452 -15.848
  339   HG21  VAL  41          3HG2      VAL  41 -38.276   8.242 -13.803
  340   HG22  VAL  41          1HG2      VAL  41 -36.529   8.174 -13.454
  341   HG23  VAL  41          2HG2      VAL  41 -37.463   9.653 -13.142
  342    H    ILE  42           H        ILE  42 -33.499  10.494 -16.297
  343    HA   ILE  42           HA       ILE  42 -34.170  11.958 -18.703
  344    HB   ILE  42           HB       ILE  42 -31.771  11.732 -19.212
  345   HG12  ILE  42          2HG1      ILE  42 -31.611  10.026 -16.682
  346   HG13  ILE  42          3HG1      ILE  42 -31.403   9.433 -18.333
  347   HG21  ILE  42          1HG2      ILE  42 -32.205  12.478 -16.286
  348   HG22  ILE  42          2HG2      ILE  42 -30.981  13.120 -17.398
  349   HG23  ILE  42          3HG2      ILE  42 -32.684  13.496 -17.661
  350   HD11  ILE  42          3HD1      ILE  42 -29.432  10.947 -18.568
  351   HD12  ILE  42          1HD1      ILE  42 -29.594  11.334 -16.828
  352   HD13  ILE  42          2HD1      ILE  42 -29.266   9.672 -17.343
  353    H    TYR  43           H        TYR  43 -33.902   8.572 -17.947
  354    HA   TYR  43           HA       TYR  43 -34.954   7.873 -20.579
  355    HB2  TYR  43           2HB      TYR  43 -32.380   7.961 -20.894
  356    HB3  TYR  43           3HB      TYR  43 -32.322   6.535 -19.917
  357    HD1  TYR  43           HD2      TYR  43 -34.158   7.873 -22.916
  358    HD2  TYR  43           HD1      TYR  43 -32.370   4.443 -20.994
  359    HE1  TYR  43           HE2      TYR  43 -34.621   6.486 -24.937
  360    HE2  TYR  43           HE1      TYR  43 -32.809   3.076 -23.018
  361    HH   TYR  43           HH       TYR  43 -33.607   3.056 -25.170
  362    H    CYS  44           H        CYS  44 -35.561   5.549 -20.806
  363    HA   CYS  44           HA       CYS  44 -35.827   4.141 -18.256
  364    HB2  CYS  44           2HB      CYS  44 -38.378   4.076 -18.519
  365    HB3  CYS  44           3HB      CYS  44 -37.662   5.600 -17.965
  366    HG   CYS  44           HG       CYS  44 -37.592   6.791 -20.257
  367    H    ASN  45           H        ASN  45 -36.345   1.921 -18.382
  368    HA   ASN  45           HA       ASN  45 -35.938   0.819 -21.083
  369    HB2  ASN  45           2HB      ASN  45 -34.671   0.080 -19.010
  370    HB3  ASN  45           3HB      ASN  45 -36.144  -0.743 -18.491
  371   HD21  ASN  45          2HD2      ASN  45 -33.774  -0.513 -21.211
  372   HD22  ASN  45          1HD2      ASN  45 -34.048  -2.163 -21.744
  373    H    ASP  46           H        ASP  46 -37.156  -0.918 -21.944
  374    HA   ASP  46           HA       ASP  46 -40.020  -0.629 -21.908
  375    HB2  ASP  46           2HB      ASP  46 -38.638  -1.512 -23.797
  376    HB3  ASP  46           3HB      ASP  46 -38.298  -2.958 -22.844
  377    H    GLY  47           H        GLY  47 -37.772  -2.632 -20.012
  378    HA2  GLY  47           HA2      GLY  47 -39.514  -4.407 -18.719
  379    HA3  GLY  47           HA3      GLY  47 -38.093  -3.649 -17.991
  380    H    PHE  48           H        PHE  48 -38.798  -0.976 -17.648
  381    HA   PHE  48           HA       PHE  48 -40.694  -0.938 -15.509
  382    HB2  PHE  48           2HB      PHE  48 -39.628   1.027 -15.263
  383    HB3  PHE  48           3HB      PHE  48 -39.045   1.023 -16.917
  384    HD1  PHE  48           HD1      PHE  48 -41.864   2.060 -14.719
  385    HD2  PHE  48           HD2      PHE  48 -40.205   2.271 -18.696
  386    HE1  PHE  48           HE1      PHE  48 -43.721   3.534 -15.421
  387    HE2  PHE  48           HE2      PHE  48 -42.084   3.717 -19.395
  388    HZ   PHE  48           HZ       PHE  48 -43.849   4.346 -17.776
  389    H    CYS  49           H        CYS  49 -41.082  -0.505 -18.988
  390    HA   CYS  49           HA       CYS  49 -43.754   0.589 -18.901
  391    HB2  CYS  49           2HB      CYS  49 -42.080   0.654 -20.853
  392    HB3  CYS  49           3HB      CYS  49 -42.634  -0.991 -21.235
  393    HG   CYS  49           HG       CYS  49 -45.213  -0.367 -21.291
  394    H    GLU  50           H        GLU  50 -42.491  -2.754 -19.073
  395    HA   GLU  50           HA       GLU  50 -45.171  -3.964 -19.071
  396    HB2  GLU  50           2HB      GLU  50 -42.463  -5.217 -18.478
  397    HB3  GLU  50           3HB      GLU  50 -43.979  -6.071 -18.792
  398    HG2  GLU  50           2HG      GLU  50 -44.063  -4.944 -21.061
  399    HG3  GLU  50           3HG      GLU  50 -42.432  -4.345 -20.762
  400    H    LEU  51           H        LEU  51 -42.868  -2.981 -16.605
  401    HA   LEU  51           HA       LEU  51 -43.907  -4.404 -14.379
  402    HB2  LEU  51           2HB      LEU  51 -41.741  -3.208 -14.490
  403    HB3  LEU  51           3HB      LEU  51 -42.571  -1.680 -14.580
  404    HG   LEU  51           HG       LEU  51 -43.540  -1.951 -12.373
  405   HD11  LEU  51          1HD1      LEU  51 -41.703  -4.379 -12.165
  406   HD12  LEU  51          2HD1      LEU  51 -42.588  -3.617 -10.826
  407   HD13  LEU  51          3HD1      LEU  51 -43.486  -4.404 -12.127
  408   HD21  LEU  51          3HD2      LEU  51 -41.442  -1.505 -11.152
  409   HD22  LEU  51          1HD2      LEU  51 -40.508  -2.160 -12.517
  410   HD23  LEU  51          2HD2      LEU  51 -41.474  -0.677 -12.715
  411    H    CYS  52           H        CYS  52 -44.530  -1.016 -15.384
  412    HA   CYS  52           HA       CYS  52 -46.859  -0.854 -13.560
  413    HB2  CYS  52           2HB      CYS  52 -45.416   1.236 -15.244
  414    HB3  CYS  52           3HB      CYS  52 -46.710   1.547 -14.074
  415    HG   CYS  52           HG       CYS  52 -44.429   2.256 -13.016
  416    H    GLY  53           H        GLY  53 -46.317  -1.321 -16.979
  417    HA2  GLY  53           HA2      GLY  53 -47.846  -1.569 -18.716
  418    HA3  GLY  53           HA3      GLY  53 -49.174  -1.438 -17.564
  419    H    TYR  54           H        TYR  54 -46.802   1.159 -17.651
  420    HA   TYR  54           HA       TYR  54 -48.851   3.078 -18.567
  421    HB2  TYR  54           2HB      TYR  54 -46.032   3.508 -17.543
  422    HB3  TYR  54           3HB      TYR  54 -47.235   4.761 -17.834
  423    HD1  TYR  54           HD2      TYR  54 -49.340   2.535 -16.308
  424    HD2  TYR  54           HD1      TYR  54 -45.814   4.873 -15.447
  425    HE1  TYR  54           HE2      TYR  54 -49.910   2.509 -13.896
  426    HE2  TYR  54           HE1      TYR  54 -46.404   4.859 -13.029
  427    HH   TYR  54           HH       TYR  54 -49.257   3.111 -11.777
  428    H    SER  55           H        SER  55 -46.158   4.577 -19.416
  429    HA   SER  55           HA       SER  55 -45.315   3.367 -21.897
  430    HB2  SER  55           2HB      SER  55 -47.397   4.381 -22.719
  431    HB3  SER  55           3HB      SER  55 -46.953   5.935 -21.992
  432    HG   SER  55           HG       SER  55 -46.443   5.725 -24.274
  433    H    ARG  56           H        ARG  56 -43.425   4.480 -22.664
  434    HA   ARG  56           HA       ARG  56 -41.757   5.624 -20.589
  435    HB2  ARG  56           2HB      ARG  56 -41.372   5.563 -23.619
  436    HB3  ARG  56           3HB      ARG  56 -40.139   5.973 -22.428
  437    HG2  ARG  56           2HG      ARG  56 -40.806   3.628 -21.352
  438    HG3  ARG  56           3HG      ARG  56 -41.456   3.285 -22.954
  439    HD2  ARG  56           2HD      ARG  56 -38.602   4.030 -22.237
  440    HD3  ARG  56           3HD      ARG  56 -39.178   2.411 -22.640
  441    HE   ARG  56           HE       ARG  56 -39.833   3.854 -24.885
  442   HH11  ARG  56          1HH1      ARG  56 -36.809   3.471 -23.120
  443   HH12  ARG  56          2HH1      ARG  56 -35.853   3.713 -24.565
  444   HH21  ARG  56          1HH2      ARG  56 -38.506   4.157 -26.677
  445   HH22  ARG  56          2HH2      ARG  56 -36.777   4.065 -26.494
  446    H    ALA  57           H        ALA  57 -43.712   7.176 -23.082
  447    HA   ALA  57           HA       ALA  57 -42.843   9.865 -22.656
  448    HB1  ALA  57           3HB      ALA  57 -44.152   9.100 -24.605
  449    HB2  ALA  57           1HB      ALA  57 -45.547   8.768 -23.549
  450    HB3  ALA  57           2HB      ALA  57 -44.970  10.434 -23.770
  451    H    GLU  58           H        GLU  58 -44.843   7.804 -20.628
  452    HA   GLU  58           HA       GLU  58 -46.021   9.996 -19.077
  453    HB2  GLU  58           2HB      GLU  58 -45.964   7.014 -18.493
  454    HB3  GLU  58           3HB      GLU  58 -46.957   8.212 -17.707
  455    HG2  GLU  58           2HG      GLU  58 -47.190   7.663 -20.695
  456    HG3  GLU  58           3HG      GLU  58 -48.050   6.730 -19.496
  457    H    VAL  59           H        VAL  59 -43.014   8.200 -19.036
  458    HA   VAL  59           HA       VAL  59 -42.439   9.186 -16.268
  459    HB   VAL  59           HB       VAL  59 -40.556   7.562 -16.252
  460   HG11  VAL  59          1HG1      VAL  59 -43.360   6.395 -16.469
  461   HG12  VAL  59          2HG1      VAL  59 -41.973   5.709 -15.584
  462   HG13  VAL  59          3HG1      VAL  59 -42.698   7.226 -15.045
  463   HG21  VAL  59          3HG2      VAL  59 -40.463   7.125 -18.687
  464   HG22  VAL  59          1HG2      VAL  59 -40.565   5.663 -17.690
  465   HG23  VAL  59          2HG2      VAL  59 -42.008   6.250 -18.544
  466    H    MET  60           H        MET  60 -41.524   9.678 -19.573
  467    HA   MET  60           HA       MET  60 -38.964  10.556 -19.517
  468    HB2  MET  60           2HB      MET  60 -41.443  11.413 -21.004
  469    HB3  MET  60           3HB      MET  60 -40.049  12.474 -21.126
  470    HG2  MET  60           2HG      MET  60 -39.949   9.526 -21.793
  471    HG3  MET  60           3HG      MET  60 -40.217  10.821 -22.952
  472    HE1  MET  60           3HE      MET  60 -36.263   9.178 -21.677
  473    HE2  MET  60           1HE      MET  60 -37.606   9.114 -20.512
  474    HE3  MET  60           2HE      MET  60 -37.789   8.390 -22.127
  475    H    GLN  61           H        GLN  61 -38.025  11.620 -17.966
  476    HA   GLN  61           HA       GLN  61 -37.216  13.334 -16.836
  477    HB2  GLN  61           2HB      GLN  61 -38.989  15.138 -18.484
  478    HB3  GLN  61           3HB      GLN  61 -37.491  15.577 -17.679
  479    HG2  GLN  61           2HG      GLN  61 -36.152  14.634 -19.315
  480    HG3  GLN  61           3HG      GLN  61 -37.249  13.307 -19.653
  481   HE21  GLN  61          2HE2      GLN  61 -37.696  13.343 -21.786
  482   HE22  GLN  61          1HE2      GLN  61 -38.301  14.755 -22.625
  483    H    ARG  62           H        ARG  62 -39.822  11.993 -15.883
  484    HA   ARG  62           HA       ARG  62 -40.785  13.965 -13.899
  485    HB2  ARG  62           2HB      ARG  62 -41.310  11.018 -14.527
  486    HB3  ARG  62           3HB      ARG  62 -41.657  11.624 -12.930
  487    HG2  ARG  62           2HG      ARG  62 -43.675  11.862 -13.861
  488    HG3  ARG  62           3HG      ARG  62 -43.030  13.487 -14.085
  489    HD2  ARG  62           2HD      ARG  62 -42.908  11.349 -16.234
  490    HD3  ARG  62           3HD      ARG  62 -44.347  12.334 -16.014
  491    HE   ARG  62           HE       ARG  62 -41.888  13.096 -17.306
  492   HH11  ARG  62          2HH1      ARG  62 -44.563  14.583 -15.583
  493   HH12  ARG  62          1HH1      ARG  62 -44.313  16.106 -16.392
  494   HH21  ARG  62          2HH2      ARG  62 -41.661  14.938 -18.275
  495   HH22  ARG  62          1HH2      ARG  62 -42.673  16.319 -17.896
  496    HA   PRO  63           HA       PRO  63 -37.720  12.957 -10.775
  497    HB2  PRO  63           2HB      PRO  63 -39.192  12.761  -8.460
  498    HB3  PRO  63           3HB      PRO  63 -38.781  14.312  -9.251
  499    HG2  PRO  63           2HG      PRO  63 -41.346  12.713  -9.519
  500    HG3  PRO  63           3HG      PRO  63 -41.160  14.466  -9.184
  501    HD2  PRO  63           2HD      PRO  63 -41.653  13.575 -11.682
  502    HD3  PRO  63           3HD      PRO  63 -40.504  14.917 -11.417
  503    H    CYS  64           H        CYS  64 -36.774  11.109 -10.126
  504    HA   CYS  64           HA       CYS  64 -37.835   8.506 -10.666
  505    HB2  CYS  64           2HB      CYS  64 -35.457   9.305 -10.776
  506    HB3  CYS  64           3HB      CYS  64 -35.429   9.376  -9.011
  507    HG   CYS  64           HG       CYS  64 -36.268   6.785  -8.806
  508    H    THR  65           H        THR  65 -38.416  10.502  -7.958
  509    HA   THR  65           HA       THR  65 -38.549   8.761  -5.797
  510    HB   THR  65           HB       THR  65 -40.406  11.130  -6.116
  511    HG1  THR  65           HG1      THR  65 -38.701  12.412  -5.435
  512   HG21  THR  65          1HG2      THR  65 -39.868  11.381  -3.704
  513   HG22  THR  65          2HG2      THR  65 -40.542   9.776  -4.030
  514   HG23  THR  65          3HG2      THR  65 -38.790   9.966  -3.813
  515    H    CYS  66           H        CYS  66 -39.488   6.905  -6.209
  516    HA   CYS  66           HA       CYS  66 -41.686   6.098  -7.496
  517    HB2  CYS  66           2HB      CYS  66 -40.960   5.057  -4.719
  518    HB3  CYS  66           3HB      CYS  66 -41.787   4.153  -5.996
  519    HG   CYS  66           HG       CYS  66 -39.806   4.258  -7.739
  520    H    ASP  67           H        ASP  67 -41.961   7.877  -4.543
  521    HA   ASP  67           HA       ASP  67 -44.601   7.486  -3.659
  522    HB2  ASP  67           2HB      ASP  67 -42.911   8.990  -2.628
  523    HB3  ASP  67           3HB      ASP  67 -43.047  10.086  -3.998
  524    H    PHE  68           H        PHE  68 -43.483   9.408  -6.488
  525    HA   PHE  68           HA       PHE  68 -46.008  10.597  -7.133
  526    HB2  PHE  68           2HB      PHE  68 -43.444  10.095  -8.676
  527    HB3  PHE  68           3HB      PHE  68 -44.847  10.794  -9.449
  528    HD1  PHE  68           HD1      PHE  68 -42.620  11.359  -6.453
  529    HD2  PHE  68           HD2      PHE  68 -45.209  13.102  -9.427
  530    HE1  PHE  68           HE1      PHE  68 -41.983  13.625  -5.676
  531    HE2  PHE  68           HE2      PHE  68 -44.573  15.369  -8.645
  532    HZ   PHE  68           HZ       PHE  68 -42.961  15.636  -6.769
  533    H    LEU  69           H        LEU  69 -44.996   7.332  -7.531
  534    HA   LEU  69           HA       LEU  69 -47.443   6.779  -9.095
  535    HB2  LEU  69           2HB      LEU  69 -46.316   4.975 -10.327
  536    HB3  LEU  69           3HB      LEU  69 -45.788   6.598 -10.705
  537    HG   LEU  69           HG       LEU  69 -43.723   6.215  -9.272
  538   HD11  LEU  69          1HD1      LEU  69 -44.452   4.262  -7.941
  539   HD12  LEU  69          2HD1      LEU  69 -44.652   3.318  -9.431
  540   HD13  LEU  69          3HD1      LEU  69 -43.038   3.863  -8.919
  541   HD21  LEU  69          3HD2      LEU  69 -43.711   6.087 -11.732
  542   HD22  LEU  69          1HD2      LEU  69 -42.596   4.911 -11.022
  543   HD23  LEU  69          2HD2      LEU  69 -44.167   4.370 -11.653
  544    H    HIS  70           H        HIS  70 -46.914   6.781  -6.133
  545    HA   HIS  70           HA       HIS  70 -46.960   4.027  -5.305
  546    HB2  HIS  70           2HB      HIS  70 -47.291   4.763  -3.183
  547    HB3  HIS  70           3HB      HIS  70 -46.555   6.183  -3.879
  548    HD2  HIS  70           HD2      HIS  70 -49.649   4.917  -2.138
  549    HE1  HIS  70           HE1      HIS  70 -50.617   8.930  -3.214
  550    HE2  HIS  70           HE2      HIS  70 -51.353   6.910  -1.850
  551    H    GLY  71           H        GLY  71 -48.682   2.747  -4.503
  552    HA2  GLY  71           HA2      GLY  71 -51.412   3.335  -5.592
  553    HA3  GLY  71           HA3      GLY  71 -50.654   1.754  -5.747
  554    HA   PRO  72           HA       PRO  72 -53.367   2.295  -1.951
  555    HB2  PRO  72           2HB      PRO  72 -54.571  -0.265  -3.010
  556    HB3  PRO  72           3HB      PRO  72 -55.387   1.126  -2.228
  557    HG2  PRO  72           2HG      PRO  72 -55.483   0.859  -4.910
  558    HG3  PRO  72           3HG      PRO  72 -55.125   2.471  -4.203
  559    HD2  PRO  72           2HD      PRO  72 -53.171   0.426  -5.297
  560    HD3  PRO  72           3HD      PRO  72 -53.268   2.179  -5.626
  561    H    ARG  73           H        ARG  73 -51.236  -0.236  -2.891
  562    HA   ARG  73           HA       ARG  73 -51.164  -1.383  -0.125
  563    HB2  ARG  73           2HB      ARG  73 -51.681  -2.908  -1.993
  564    HB3  ARG  73           3HB      ARG  73 -50.123  -2.544  -2.736
  565    HG2  ARG  73           2HG      ARG  73 -48.902  -3.659  -1.068
  566    HG3  ARG  73           3HG      ARG  73 -50.257  -3.676   0.072
  567    HD2  ARG  73           2HD      ARG  73 -50.374  -5.133  -2.600
  568    HD3  ARG  73           3HD      ARG  73 -49.667  -5.869  -1.163
  569    HE   ARG  73           HE       ARG  73 -51.807  -5.601   0.007
  570   HH11  ARG  73          1HH1      ARG  73 -52.100  -5.568  -3.535
  571   HH12  ARG  73          2HH1      ARG  73 -53.762  -6.062  -3.428
  572   HH21  ARG  73          1HH2      ARG  73 -53.906  -6.201  -0.016
  573   HH22  ARG  73          2HH2      ARG  73 -54.747  -6.399  -1.524
  574    H    THR  74           H        THR  74 -49.513   0.957  -1.949
  575    HA   THR  74           HA       THR  74 -46.821   0.270  -1.116
  576    HB   THR  74           HB       THR  74 -47.690   3.062  -1.813
  577    HG1  THR  74           HG1      THR  74 -46.711   1.405  -3.816
  578   HG21  THR  74          1HG2      THR  74 -45.117   1.469  -2.171
  579   HG22  THR  74          2HG2      THR  74 -45.388   3.085  -2.862
  580   HG23  THR  74          3HG2      THR  74 -45.371   2.866  -1.107
  581    H    GLN  75           H        GLN  75 -45.697   0.766   0.608
  582    HA   GLN  75           HA       GLN  75 -47.150   1.833   2.922
  583    HB2  GLN  75           2HB      GLN  75 -44.268   0.896   2.753
  584    HB3  GLN  75           3HB      GLN  75 -45.203   1.226   4.209
  585    HG2  GLN  75           2HG      GLN  75 -45.682  -1.033   2.235
  586    HG3  GLN  75           3HG      GLN  75 -45.031  -1.144   3.868
  587   HE21  GLN  75          2HE2      GLN  75 -48.007  -1.157   2.002
  588   HE22  GLN  75          1HE2      GLN  75 -49.056  -1.156   3.410
  589    H    ARG  76           H        ARG  76 -46.885   3.750   3.877
  590    HA   ARG  76           HA       ARG  76 -45.760   5.927   2.316
  591    HB2  ARG  76           2HB      ARG  76 -46.637   6.012   5.193
  592    HB3  ARG  76           3HB      ARG  76 -46.501   7.374   4.083
  593    HG2  ARG  76           2HG      ARG  76 -48.602   5.164   4.059
  594    HG3  ARG  76           3HG      ARG  76 -48.828   6.893   4.312
  595    HD2  ARG  76           2HD      ARG  76 -47.989   7.242   1.926
  596    HD3  ARG  76           3HD      ARG  76 -48.073   5.495   1.706
  597    HE   ARG  76           HE       ARG  76 -50.354   7.362   2.217
  598   HH11  ARG  76          1HH2      ARG  76 -49.456   4.093   1.125
  599   HH12  ARG  76          2HH2      ARG  76 -51.065   3.812   0.556
  600   HH21  ARG  76          1HH1      ARG  76 -52.347   6.841   1.489
  601   HH22  ARG  76          2HH1      ARG  76 -52.645   5.286   0.775
  602    H    ARG  77           H        ARG  77 -44.666   4.174   5.192
  603    HA   ARG  77           HA       ARG  77 -42.235   5.573   5.693
  604    HB2  ARG  77           2HB      ARG  77 -41.447   3.510   6.700
  605    HB3  ARG  77           3HB      ARG  77 -43.103   3.891   7.202
  606    HG2  ARG  77           2HG      ARG  77 -44.031   2.156   5.835
  607    HG3  ARG  77           3HG      ARG  77 -42.479   1.830   5.048
  608    HD2  ARG  77           2HD      ARG  77 -41.551   1.079   7.236
  609    HD3  ARG  77           3HD      ARG  77 -43.142   1.330   7.959
  610    HE   ARG  77           HE       ARG  77 -43.899  -0.632   7.010
  611   HH11  ARG  77          1HH1      ARG  77 -40.845   0.074   5.342
  612   HH12  ARG  77          2HH1      ARG  77 -40.942  -1.483   4.508
  613   HH21  ARG  77          2HH2      ARG  77 -43.743  -2.609   5.886
  614   HH22  ARG  77          1HH2      ARG  77 -42.378  -2.812   4.784
  615    H    ALA  78           H        ALA  78 -42.926   3.128   3.248
  616    HA   ALA  78           HA       ALA  78 -40.191   2.785   2.352
  617    HB1  ALA  78           3HB      ALA  78 -41.307   1.581   0.490
  618    HB2  ALA  78           1HB      ALA  78 -41.900   1.030   2.053
  619    HB3  ALA  78           2HB      ALA  78 -42.870   2.102   1.009
  620    H    ALA  79           H        ALA  79 -43.037   4.613   1.123
  621    HA   ALA  79           HA       ALA  79 -41.598   5.801  -1.092
  622    HB1  ALA  79           3HB      ALA  79 -44.114   6.708   0.392
  623    HB2  ALA  79           1HB      ALA  79 -43.605   7.245  -1.219
  624    HB3  ALA  79           2HB      ALA  79 -44.077   5.552  -0.964
  625    H    ALA  80           H        ALA  80 -42.080   6.816   2.285
  626    HA   ALA  80           HA       ALA  80 -40.990   9.439   2.003
  627    HB1  ALA  80           3HB      ALA  80 -42.452   8.778   3.851
  628    HB2  ALA  80           1HB      ALA  80 -41.252   7.589   4.409
  629    HB3  ALA  80           2HB      ALA  80 -40.886   9.330   4.486
  630    H    GLN  81           H        GLN  81 -39.464   6.436   3.365
  631    HA   GLN  81           HA       GLN  81 -36.811   7.359   3.571
  632    HB2  GLN  81           2HB      GLN  81 -37.971   4.636   2.941
  633    HB3  GLN  81           3HB      GLN  81 -36.229   4.905   3.088
  634    HG2  GLN  81           2HG      GLN  81 -36.431   5.705   5.363
  635    HG3  GLN  81           3HG      GLN  81 -38.194   5.667   5.286
  636   HE21  GLN  81          2HE2      GLN  81 -39.207   3.514   4.894
  637   HE22  GLN  81          1HE2      GLN  81 -38.410   2.092   5.597
  638    H    ILE  82           H        ILE  82 -38.455   6.147   0.573
  639    HA   ILE  82           HA       ILE  82 -36.080   6.409  -1.033
  640    HB   ILE  82           HB       ILE  82 -39.022   6.195  -1.617
  641   HG12  ILE  82          2HG1      ILE  82 -36.647   4.458  -2.457
  642   HG13  ILE  82          3HG1      ILE  82 -37.403   4.292  -0.870
  643   HG21  ILE  82          1HG2      ILE  82 -38.246   7.705  -3.334
  644   HG22  ILE  82          2HG2      ILE  82 -36.781   6.740  -3.606
  645   HG23  ILE  82          3HG2      ILE  82 -38.382   6.099  -4.065
  646   HD11  ILE  82          3HD1      ILE  82 -38.795   3.882  -3.522
  647   HD12  ILE  82          1HD1      ILE  82 -38.349   2.671  -2.299
  648   HD13  ILE  82          2HD1      ILE  82 -39.588   3.905  -1.923
  649    H    ALA  83           H        ALA  83 -38.859   8.667  -0.545
  650    HA   ALA  83           HA       ALA  83 -37.850  10.810  -2.053
  651    HB1  ALA  83           3HB      ALA  83 -40.103  10.717  -1.033
  652    HB2  ALA  83           1HB      ALA  83 -39.377  10.959   0.573
  653    HB3  ALA  83           2HB      ALA  83 -39.247  12.231  -0.649
  654    H    GLN  84           H        GLN  84 -36.899   9.831   1.232
  655    HA   GLN  84           HA       GLN  84 -35.170  12.142   1.697
  656    HB2  GLN  84           2HB      GLN  84 -34.860   9.444   3.046
  657    HB3  GLN  84           3HB      GLN  84 -34.298  11.017   3.573
  658    HG2  GLN  84           2HG      GLN  84 -37.024   9.843   3.728
  659    HG3  GLN  84           3HG      GLN  84 -36.086  10.549   4.983
  660   HE21  GLN  84          1HE2      GLN  84 -38.564  11.082   2.693
  661   HE22  GLN  84          2HE2      GLN  84 -38.755  12.821   2.967
  662    H    ALA  85           H        ALA  85 -34.690   8.836   0.311
  663    HA   ALA  85           HA       ALA  85 -31.814   8.971   0.290
  664    HB1  ALA  85           3HB      ALA  85 -33.081   6.849   0.230
  665    HB2  ALA  85           1HB      ALA  85 -33.753   7.281  -1.360
  666    HB3  ALA  85           2HB      ALA  85 -32.014   6.994  -1.178
  667    H    LEU  86           H        LEU  86 -34.343   9.935  -2.001
  668    HA   LEU  86           HA       LEU  86 -32.407  10.722  -4.043
  669    HB2  LEU  86           2HB      LEU  86 -35.346  11.415  -3.995
  670    HB3  LEU  86           3HB      LEU  86 -34.239  11.367  -5.354
  671    HG   LEU  86           HG       LEU  86 -35.706   9.142  -3.975
  672   HD11  LEU  86          1HD1      LEU  86 -36.381  10.192  -6.138
  673   HD12  LEU  86          2HD1      LEU  86 -34.886   9.599  -6.867
  674   HD13  LEU  86          3HD1      LEU  86 -36.100   8.443  -6.268
  675   HD21  LEU  86          3HD2      LEU  86 -33.114   8.624  -5.524
  676   HD22  LEU  86          1HD2      LEU  86 -33.416   8.185  -3.831
  677   HD23  LEU  86          2HD2      LEU  86 -34.333   7.403  -5.097
  678    H    LEU  87           H        LEU  87 -34.187  12.386  -1.449
  679    HA   LEU  87           HA       LEU  87 -33.388  15.066  -1.974
  680    HB2  LEU  87           2HB      LEU  87 -35.148  14.766  -0.534
  681    HB3  LEU  87           3HB      LEU  87 -34.456  13.354   0.222
  682    HG   LEU  87           HG       LEU  87 -33.290  15.944   0.853
  683   HD11  LEU  87          1HD1      LEU  87 -35.702  16.224   1.183
  684   HD12  LEU  87          2HD1      LEU  87 -35.752  14.721   2.128
  685   HD13  LEU  87          3HD1      LEU  87 -34.889  16.147   2.753
  686   HD21  LEU  87          3HD2      LEU  87 -33.586  13.448   2.534
  687   HD22  LEU  87          1HD2      LEU  87 -32.088  14.049   1.789
  688   HD23  LEU  87          2HD2      LEU  87 -32.857  14.971   3.066
  689    H    GLY  88           H        GLY  88 -31.726  12.305  -0.534
  690    HA2  GLY  88           HA2      GLY  88 -29.348  12.140  -0.981
  691    HA3  GLY  88           HA3      GLY  88 -29.155  13.856  -0.636
  692    H    ALA  89           H        ALA  89 -31.214  12.066   1.566
  693    HA   ALA  89           HA       ALA  89 -29.575  12.589   3.835
  694    HB1  ALA  89           3HB      ALA  89 -31.169  11.101   5.012
  695    HB2  ALA  89           1HB      ALA  89 -31.998  12.278   3.981
  696    HB3  ALA  89           2HB      ALA  89 -31.843  10.585   3.452
  697    H    GLU  90           H        GLU  90 -30.162   9.533   2.051
  698    HA   GLU  90           HA       GLU  90 -27.397   8.768   2.160
  699    HB2  GLU  90           2HB      GLU  90 -27.754   6.538   3.205
  700    HB3  GLU  90           3HB      GLU  90 -27.828   7.887   4.326
  701    HG2  GLU  90           2HG      GLU  90 -30.314   7.757   4.342
  702    HG3  GLU  90           3HG      GLU  90 -30.249   6.395   3.225
  703    H    GLU  91           H        GLU  91 -26.875   7.455   0.473
  704    HA   GLU  91           HA       GLU  91 -28.895   6.596  -1.527
  705    HB2  GLU  91           2HB      GLU  91 -26.827   7.435  -2.303
  706    HB3  GLU  91           3HB      GLU  91 -25.868   6.417  -1.232
  707    HG2  GLU  91           2HG      GLU  91 -27.688   4.947  -3.065
  708    HG3  GLU  91           3HG      GLU  91 -26.529   5.976  -3.896
  709    H    ARG  92           H        ARG  92 -30.200   5.075  -0.715
  710    HA   ARG  92           HA       ARG  92 -29.090   2.571   0.469
  711    HB2  ARG  92           2HB      ARG  92 -29.647   4.332   2.207
  712    HB3  ARG  92           3HB      ARG  92 -31.313   4.305   1.647
  713    HG2  ARG  92           2HG      ARG  92 -31.194   3.015   3.636
  714    HG3  ARG  92           3HG      ARG  92 -31.428   1.864   2.324
  715    HD2  ARG  92           2HD      ARG  92 -29.015   1.318   2.352
  716    HD3  ARG  92           3HD      ARG  92 -28.723   2.547   3.580
  717    HE   ARG  92           HE       ARG  92 -29.900  -0.118   3.948
  718   HH11  ARG  92          1HH1      ARG  92 -29.512   3.037   5.518
  719   HH12  ARG  92          2HH1      ARG  92 -29.748   2.332   7.096
  720   HH21  ARG  92          1HH2      ARG  92 -30.204  -0.885   5.997
  721   HH22  ARG  92          2HH2      ARG  92 -30.140   0.197   7.356
  722    H    LYS  93           H        LYS  93 -30.206   0.754   0.046
  723    HA   LYS  93           HA       LYS  93 -32.395   0.758  -1.904
  724    HB2  LYS  93           2HB      LYS  93 -30.556  -0.844  -1.990
  725    HB3  LYS  93           3HB      LYS  93 -31.093  -1.533  -0.437
  726    HG2  LYS  93           2HG      LYS  93 -33.341  -1.956  -1.691
  727    HG3  LYS  93           3HG      LYS  93 -32.420  -1.590  -3.155
  728    HD2  LYS  93           2HD      LYS  93 -31.743  -3.736  -1.109
  729    HD3  LYS  93           3HD      LYS  93 -32.537  -4.019  -2.662
  730    HE2  LYS  93           2HE      LYS  93 -30.533  -3.098  -3.837
  731    HE3  LYS  93           3HE      LYS  93 -29.722  -2.886  -2.273
  732    HZ1  LYS  93           HZ1      LYS  93 -29.922  -5.326  -1.965
  733    HZ2  LYS  93           HZ2      LYS  93 -30.619  -5.452  -3.454
  734    HZ3  LYS  93           HZ3      LYS  93 -29.066  -4.968  -3.319
  735    H    VAL  94           H        VAL  94 -34.469   0.462  -1.575
  736    HA   VAL  94           HA       VAL  94 -35.581  -0.310   1.076
  737    HB   VAL  94           HB       VAL  94 -36.820   1.952  -0.515
  738   HG11  VAL  94          1HG1      VAL  94 -36.926   1.241   2.454
  739   HG12  VAL  94          2HG1      VAL  94 -37.802   2.569   1.663
  740   HG13  VAL  94          3HG1      VAL  94 -38.203   0.908   1.263
  741   HG21  VAL  94          3HG2      VAL  94 -35.813   3.617   1.029
  742   HG22  VAL  94          1HG2      VAL  94 -34.760   2.349   1.696
  743   HG23  VAL  94          2HG2      VAL  94 -34.608   2.863  -0.003
  744    H    GLU  95           H        GLU  95 -37.697  -1.183   0.926
  745    HA   GLU  95           HA       GLU  95 -38.375  -2.473  -1.645
  746    HB2  GLU  95           2HB      GLU  95 -39.981  -3.695  -0.366
  747    HB3  GLU  95           3HB      GLU  95 -38.456  -3.661   0.552
  748    HG2  GLU  95           2HG      GLU  95 -39.405  -1.733   1.905
  749    HG3  GLU  95           3HG      GLU  95 -40.944  -1.962   1.073
  750    H    ILE  96           H        ILE  96 -40.657  -2.216  -2.501
  751    HA   ILE  96           HA       ILE  96 -42.394  -0.302  -1.443
  752    HB   ILE  96           HB       ILE  96 -42.429   0.967  -3.888
  753   HG12  ILE  96          2HG1      ILE  96 -40.340   1.955  -4.451
  754   HG13  ILE  96          3HG1      ILE  96 -39.495   1.076  -3.175
  755   HG21  ILE  96          1HG2      ILE  96 -40.990   2.166  -1.559
  756   HG22  ILE  96          2HG2      ILE  96 -41.904   2.975  -2.833
  757   HG23  ILE  96          3HG2      ILE  96 -42.755   1.973  -1.650
  758   HD11  ILE  96          3HD1      ILE  96 -39.458  -0.896  -4.332
  759   HD12  ILE  96          1HD1      ILE  96 -40.859  -0.478  -5.355
  760   HD13  ILE  96          2HD1      ILE  96 -39.271   0.280  -5.627
  761    H    ALA  97           H        ALA  97 -44.412  -0.253  -2.396
  762    HA   ALA  97           HA       ALA  97 -44.961  -2.510  -4.221
  763    HB1  ALA  97           3HB      ALA  97 -47.066  -0.755  -2.975
  764    HB2  ALA  97           1HB      ALA  97 -47.241  -2.378  -3.577
  765    HB3  ALA  97           2HB      ALA  97 -46.345  -2.108  -2.072
  766    H    PHE  98           H        PHE  98 -46.015  -2.322  -6.159
  767    HA   PHE  98           HA       PHE  98 -46.278   0.423  -7.351
  768    HB2  PHE  98           2HB      PHE  98 -45.474  -2.137  -8.777
  769    HB3  PHE  98           3HB      PHE  98 -45.711  -0.564  -9.528
  770    HD1  PHE  98           HD1      PHE  98 -44.318   1.402  -8.106
  771    HD2  PHE  98           HD2      PHE  98 -43.209  -2.740  -8.589
  772    HE1  PHE  98           HE1      PHE  98 -41.932   1.999  -7.756
  773    HE2  PHE  98           HE2      PHE  98 -40.839  -2.138  -8.266
  774    HZ   PHE  98           HZ       PHE  98 -40.194   0.238  -7.844
  775    H    TYR  99           H        TYR  99 -47.937   0.588  -9.036
  776    HA   TYR  99           HA       TYR  99 -49.912  -1.604  -8.994
  777    HB2  TYR  99           2HB      TYR  99 -51.790  -0.294  -8.818
  778    HB3  TYR  99           3HB      TYR  99 -50.735   0.318  -7.566
  779    HD1  TYR  99           HD1      TYR  99 -49.456   2.528  -7.998
  780    HD2  TYR  99           HD2      TYR  99 -52.662   1.108 -10.517
  781    HE1  TYR  99           HE1      TYR  99 -49.780   4.824  -8.886
  782    HE2  TYR  99           HE2      TYR  99 -52.977   3.412 -11.409
  783    HH   TYR  99           HH       TYR  99 -50.977   6.175 -10.304
  784    H    ARG 100           H        ARG 100 -50.767  -2.190 -10.853
  785    HA   ARG 100           HA       ARG 100 -49.619  -1.078 -13.315
  786    HB2  ARG 100           2HB      ARG 100 -51.187  -3.568 -12.605
  787    HB3  ARG 100           3HB      ARG 100 -51.079  -3.047 -14.297
  788    HG2  ARG 100           2HG      ARG 100 -48.681  -3.039 -14.258
  789    HG3  ARG 100           3HG      ARG 100 -48.630  -3.389 -12.523
  790    HD2  ARG 100           2HD      ARG 100 -49.520  -5.605 -12.864
  791    HD3  ARG 100           3HD      ARG 100 -49.879  -5.256 -14.573
  792    HE   ARG 100           HE       ARG 100 -47.141  -4.742 -14.193
  793   HH11  ARG 100          2HH2      ARG 100 -49.080  -7.633 -13.806
  794   HH12  ARG 100          1HH2      ARG 100 -47.850  -8.667 -14.479
  795   HH21  ARG 100          2HH1      ARG 100 -45.806  -6.071 -15.400
  796   HH22  ARG 100          1HH1      ARG 100 -45.974  -7.802 -15.254
  797    H    LYS 101           H        LYS 101 -50.730  -0.415 -15.090
  798    HA   LYS 101           HA       LYS 101 -52.931   1.356 -14.895
  799    HB2  LYS 101           2HB      LYS 101 -51.344   1.450 -16.651
  800    HB3  LYS 101           3HB      LYS 101 -51.651  -0.197 -17.173
  801    HG2  LYS 101           2HG      LYS 101 -53.914   1.811 -17.302
  802    HG3  LYS 101           3HG      LYS 101 -52.599   1.917 -18.476
  803    HD2  LYS 101           2HD      LYS 101 -52.922  -0.376 -19.192
  804    HD3  LYS 101           3HD      LYS 101 -54.195  -0.635 -17.995
  805    HE2  LYS 101           2HE      LYS 101 -55.581   1.122 -19.038
  806    HE3  LYS 101           3HE      LYS 101 -54.310   1.438 -20.229
  807    HZ1  LYS 101           HZ1      LYS 101 -55.783  -1.131 -19.950
  808    HZ2  LYS 101           HZ2      LYS 101 -56.018  -0.031 -21.130
  809    HZ3  LYS 101           HZ3      LYS 101 -54.606  -0.841 -21.048
  810    H    ASP 102           H        ASP 102 -52.986  -2.134 -15.277
  811    HA   ASP 102           HA       ASP 102 -55.781  -2.391 -15.918
  812    HB2  ASP 102           2HB      ASP 102 -53.950  -4.053 -16.364
  813    HB3  ASP 102           3HB      ASP 102 -53.882  -4.392 -14.635
  814    H    GLY 103           H        GLY 103 -54.342  -1.419 -12.977
  815    HA2  GLY 103           HA2      GLY 103 -55.552  -0.630 -11.160
  816    HA3  GLY 103           HA3      GLY 103 -56.920  -1.660 -11.561
  817    H    SER 104           H        SER 104 -53.757  -3.166 -11.343
  818    HA   SER 104           HA       SER 104 -54.508  -4.421  -8.710
  819    HB2  SER 104           2HB      SER 104 -52.761  -5.507 -10.944
  820    HB3  SER 104           3HB      SER 104 -53.000  -6.269  -9.362
  821    HG   SER 104           HG       SER 104 -55.019  -5.709 -11.303
  822    H    CYS 105           H        CYS 105 -53.114  -4.310  -6.993
  823    HA   CYS 105           HA       CYS 105 -50.527  -2.882  -7.376
  824    HB2  CYS 105           2HB      CYS 105 -52.371  -1.419  -6.549
  825    HB3  CYS 105           3HB      CYS 105 -52.519  -2.451  -5.117
  826    HG   CYS 105           HG       CYS 105 -49.666  -1.107  -6.159
  827    H    PHE 106           H        PHE 106 -48.760  -3.624  -6.329
  828    HA   PHE 106           HA       PHE 106 -48.973  -5.905  -4.420
  829    HB2  PHE 106           2HB      PHE 106 -47.434  -7.189  -6.001
  830    HB3  PHE 106           3HB      PHE 106 -49.118  -7.050  -6.462
  831    HD1  PHE 106           HD2      PHE 106 -45.671  -5.898  -7.281
  832    HD2  PHE 106           HD1      PHE 106 -49.829  -5.794  -8.422
  833    HE1  PHE 106           HE2      PHE 106 -45.058  -4.865  -9.455
  834    HE2  PHE 106           HE1      PHE 106 -49.213  -4.757 -10.582
  835    HZ   PHE 106           HZ       PHE 106 -46.818  -4.292 -11.110
  836    H    LEU 107           H        LEU 107 -47.294  -6.175  -3.084
  837    HA   LEU 107           HA       LEU 107 -44.846  -4.497  -3.325
  838    HB2  LEU 107           2HB      LEU 107 -46.297  -4.295  -1.265
  839    HB3  LEU 107           3HB      LEU 107 -45.997  -5.981  -0.927
  840    HG   LEU 107           HG       LEU 107 -44.699  -4.539   0.497
  841   HD11  LEU 107          1HD1      LEU 107 -43.563  -6.708  -0.319
  842   HD12  LEU 107          2HD1      LEU 107 -42.612  -5.662  -1.394
  843   HD13  LEU 107          3HD1      LEU 107 -42.506  -5.433   0.336
  844   HD21  LEU 107          3HD2      LEU 107 -43.297  -3.479  -1.926
  845   HD22  LEU 107          1HD2      LEU 107 -44.461  -2.586  -0.895
  846   HD23  LEU 107          2HD2      LEU 107 -42.908  -3.105  -0.236
  847    H    CYS 108           H        CYS 108 -43.055  -5.487  -3.932
  848    HA   CYS 108           HA       CYS 108 -42.593  -8.377  -3.367
  849    HB2  CYS 108           2HB      CYS 108 -41.954  -6.940  -5.976
  850    HB3  CYS 108           3HB      CYS 108 -41.584  -8.634  -5.591
  851    HG   CYS 108           HG       CYS 108 -44.105  -9.358  -5.171
  852    H    LEU 109           H        LEU 109 -40.056  -8.801  -3.720
  853    HA   LEU 109           HA       LEU 109 -38.776  -6.897  -1.913
  854    HB2  LEU 109           2HB      LEU 109 -38.674  -9.365  -1.665
  855    HB3  LEU 109           3HB      LEU 109 -37.734  -9.467  -3.145
  856    HG   LEU 109           HG       LEU 109 -35.882  -8.193  -2.062
  857   HD11  LEU 109          1HD1      LEU 109 -37.105  -6.807  -0.455
  858   HD12  LEU 109          2HD1      LEU 109 -37.672  -8.259   0.405
  859   HD13  LEU 109          3HD1      LEU 109 -35.947  -7.828   0.397
  860   HD21  LEU 109          3HD2      LEU 109 -36.877 -10.548  -0.413
  861   HD22  LEU 109          1HD2      LEU 109 -35.958 -10.653  -1.932
  862   HD23  LEU 109          2HD2      LEU 109 -35.206  -9.944  -0.495
  863    H    VAL 110           H        VAL 110 -39.192  -5.309  -3.760
  864    HA   VAL 110           HA       VAL 110 -37.630  -5.214  -6.069
  865    HB   VAL 110           HB       VAL 110 -38.897  -2.916  -4.601
  866   HG11  VAL 110          1HG1      VAL 110 -38.979  -1.851  -6.880
  867   HG12  VAL 110          2HG1      VAL 110 -37.323  -2.094  -6.343
  868   HG13  VAL 110          3HG1      VAL 110 -38.042  -3.217  -7.516
  869   HG21  VAL 110          3HG2      VAL 110 -40.548  -4.690  -5.226
  870   HG22  VAL 110          1HG2      VAL 110 -40.789  -3.216  -6.139
  871   HG23  VAL 110          2HG2      VAL 110 -39.982  -4.602  -6.906
  872    H    ASP 111           H        ASP 111 -35.818  -4.096  -6.731
  873    HA   ASP 111           HA       ASP 111 -33.848  -3.804  -4.494
  874    HB2  ASP 111           2HB      ASP 111 -33.820  -5.727  -6.257
  875    HB3  ASP 111           3HB      ASP 111 -33.060  -4.521  -7.294
  876    H    VAL 112           H        VAL 112 -34.560  -1.529  -4.280
  877    HA   VAL 112           HA       VAL 112 -34.124   0.295  -6.506
  878    HB   VAL 112           HB       VAL 112 -34.938   0.893  -3.635
  879   HG11  VAL 112          1HG1      VAL 112 -36.029   2.865  -4.558
  880   HG12  VAL 112          2HG1      VAL 112 -34.324   2.910  -5.006
  881   HG13  VAL 112          3HG1      VAL 112 -35.551   2.413  -6.200
  882   HG21  VAL 112          3HG2      VAL 112 -36.502  -0.750  -4.576
  883   HG22  VAL 112          1HG2      VAL 112 -37.259   0.838  -4.509
  884   HG23  VAL 112          2HG2      VAL 112 -36.650   0.207  -6.062
  885    H    VAL 113           H        VAL 113 -31.790  -0.323  -6.637
  886    HA   VAL 113           HA       VAL 113 -30.125   1.334  -4.767
  887    HB   VAL 113           HB       VAL 113 -29.850  -1.017  -4.372
  888   HG11  VAL 113          1HG1      VAL 113 -28.715  -2.524  -5.864
  889   HG12  VAL 113          2HG1      VAL 113 -30.157  -1.912  -6.685
  890   HG13  VAL 113          3HG1      VAL 113 -28.551  -1.278  -7.111
  891   HG21  VAL 113          3HG2      VAL 113 -27.417  -1.054  -4.341
  892   HG22  VAL 113          1HG2      VAL 113 -27.352   0.262  -5.532
  893   HG23  VAL 113          2HG2      VAL 113 -28.017   0.553  -3.904
  894    HA   PRO 114           HA       PRO 114 -29.100   3.408  -8.614
  895    HB2  PRO 114           2HB      PRO 114 -27.866   5.593  -7.713
  896    HB3  PRO 114           3HB      PRO 114 -29.565   5.270  -7.315
  897    HG2  PRO 114           2HG      PRO 114 -27.109   4.679  -5.655
  898    HG3  PRO 114           3HG      PRO 114 -28.617   5.523  -5.142
  899    HD2  PRO 114           2HD      PRO 114 -28.134   2.838  -4.698
  900    HD3  PRO 114           3HD      PRO 114 -29.763   3.524  -4.930
  901    H    VAL 115           H        VAL 115 -26.880   4.725  -9.438
  902    HA   VAL 115           HA       VAL 115 -24.628   2.783  -9.173
  903    HB   VAL 115           HB       VAL 115 -24.065   3.287 -11.522
  904   HG11  VAL 115          1HG1      VAL 115 -25.136   1.195 -10.851
  905   HG12  VAL 115          2HG1      VAL 115 -26.741   1.930 -11.044
  906   HG13  VAL 115          3HG1      VAL 115 -25.683   1.709 -12.455
  907   HG21  VAL 115          3HG2      VAL 115 -26.877   4.397 -11.728
  908   HG22  VAL 115          1HG2      VAL 115 -25.375   5.341 -11.820
  909   HG23  VAL 115          2HG2      VAL 115 -25.720   4.129 -13.057
  910    H    LYS 116           H        LYS 116 -22.686   3.403  -8.927
  911    HA   LYS 116           HA       LYS 116 -21.970   6.279  -8.712
  912    HB2  LYS 116           2HB      LYS 116 -20.598   5.560  -6.665
  913    HB3  LYS 116           3HB      LYS 116 -22.316   5.800  -6.443
  914    HG2  LYS 116           2HG      LYS 116 -21.293   3.023  -6.967
  915    HG3  LYS 116           3HG      LYS 116 -21.073   3.799  -5.390
  916    HD2  LYS 116           2HD      LYS 116 -23.434   4.081  -5.049
  917    HD3  LYS 116           3HD      LYS 116 -23.820   3.622  -6.705
  918    HE2  LYS 116           2HE      LYS 116 -22.876   1.330  -6.241
  919    HE3  LYS 116           3HE      LYS 116 -22.695   1.806  -4.545
  920    HZ1  LYS 116           HZ1      LYS 116 -25.272   1.777  -6.043
  921    HZ2  LYS 116           HZ2      LYS 116 -24.805   0.660  -4.931
  922    HZ3  LYS 116           HZ3      LYS 116 -25.098   2.201  -4.460
  923    H    ASN 117           H        ASN 117 -19.716   6.665  -8.499
  924    HA   ASN 117           HA       ASN 117 -18.296   5.167 -10.652
  925    HB2  ASN 117           2HB      ASN 117 -17.096   7.095 -11.112
  926    HB3  ASN 117           3HB      ASN 117 -18.697   7.693 -10.742
  927   HD21  ASN 117          2HD2      ASN 117 -18.988   8.724  -8.505
  928   HD22  ASN 117          1HD2      ASN 117 -17.535   9.443  -7.826
  929    H    GLU 118           H        GLU 118 -15.686   5.491 -10.250
  930    HA   GLU 118           HA       GLU 118 -15.024   3.475  -8.343
  931    HB2  GLU 118           2HB      GLU 118 -12.757   3.816  -8.998
  932    HB3  GLU 118           3HB      GLU 118 -13.787   3.854 -10.418
  933    HG2  GLU 118           2HG      GLU 118 -13.591   6.260 -10.617
  934    HG3  GLU 118           3HG      GLU 118 -12.811   6.395  -9.040
  935    H    ASP 119           H        ASP 119 -15.254   6.930  -7.856
  936    HA   ASP 119           HA       ASP 119 -13.816   6.949  -5.324
  937    HB2  ASP 119           2HB      ASP 119 -14.211   8.900  -6.943
  938    HB3  ASP 119           3HB      ASP 119 -15.854   8.970  -6.302
  939    H    GLY 120           H        GLY 120 -17.003   5.918  -6.240
  940    HA2  GLY 120           HA2      GLY 120 -18.524   4.807  -4.841
  941    HA3  GLY 120           HA3      GLY 120 -17.828   5.571  -3.412
  942    H    ALA 121           H        ALA 121 -18.249   8.030  -5.632
  943    HA   ALA 121           HA       ALA 121 -20.739   8.965  -4.394
  944    HB1  ALA 121           3HB      ALA 121 -19.010  10.287  -6.514
  945    HB2  ALA 121           1HB      ALA 121 -20.317  11.035  -5.585
  946    HB3  ALA 121           2HB      ALA 121 -18.838  10.504  -4.758
  947    H    VAL 122           H        VAL 122 -22.674   8.869  -5.168
  948    HA   VAL 122           HA       VAL 122 -23.384   7.325  -7.483
  949    HB   VAL 122           HB       VAL 122 -24.596   7.159  -5.452
  950   HG11  VAL 122          1HG1      VAL 122 -24.499   9.545  -4.655
  951   HG12  VAL 122          2HG1      VAL 122 -25.780   9.922  -5.834
  952   HG13  VAL 122          3HG1      VAL 122 -26.080   8.766  -4.534
  953   HG21  VAL 122          3HG2      VAL 122 -26.867   7.270  -6.320
  954   HG22  VAL 122          1HG2      VAL 122 -26.326   8.270  -7.683
  955   HG23  VAL 122          2HG2      VAL 122 -25.742   6.601  -7.510
  956    H    ILE 123           H        ILE 123 -22.765   8.123  -9.350
  957    HA   ILE 123           HA       ILE 123 -23.368  10.895 -10.069
  958    HB   ILE 123           HB       ILE 123 -22.075  10.721 -11.906
  959   HG12  ILE 123          2HG1      ILE 123 -22.868   8.835 -13.105
  960   HG13  ILE 123          3HG1      ILE 123 -21.130   8.766 -12.968
  961   HG21  ILE 123          1HG2      ILE 123 -19.935   9.937 -11.148
  962   HG22  ILE 123          2HG2      ILE 123 -20.830  10.597  -9.765
  963   HG23  ILE 123          3HG2      ILE 123 -20.693   8.841  -9.976
  964   HD11  ILE 123          3HD1      ILE 123 -22.008   6.545 -12.751
  965   HD12  ILE 123          1HD1      ILE 123 -21.387   7.013 -11.159
  966   HD13  ILE 123          2HD1      ILE 123 -23.140   7.032 -11.499
  967    H    MET 124           H        MET 124 -24.805   7.715 -10.632
  968    HA   MET 124           HA       MET 124 -27.064   9.160 -11.894
  969    HB2  MET 124           2HB      MET 124 -25.546   6.962 -13.254
  970    HB3  MET 124           3HB      MET 124 -27.304   6.920 -13.336
  971    HG2  MET 124           2HG      MET 124 -27.125   8.240 -15.095
  972    HG3  MET 124           3HG      MET 124 -26.850   9.547 -13.961
  973    HE1  MET 124           3HE      MET 124 -24.868  11.075 -14.131
  974    HE2  MET 124           1HE      MET 124 -23.917  11.036 -15.629
  975    HE3  MET 124           2HE      MET 124 -25.699  11.041 -15.703
  976    H    PHE 125           H        PHE 125 -28.974   8.322 -11.765
  977    HA   PHE 125           HA       PHE 125 -29.508   6.473  -9.455
  978    HB2  PHE 125           2HB      PHE 125 -30.875   8.947 -10.539
  979    HB3  PHE 125           3HB      PHE 125 -31.839   7.695  -9.771
  980    HD1  PHE 125           HD2      PHE 125 -28.845   7.676  -7.865
  981    HD2  PHE 125           HD1      PHE 125 -32.354  10.041  -8.680
  982    HE1  PHE 125           HE2      PHE 125 -28.608   8.782  -5.672
  983    HE2  PHE 125           HE1      PHE 125 -32.068  11.195  -6.494
  984    HZ   PHE 125           HZ       PHE 125 -30.199  10.555  -4.985
  985    H    ILE 126           H        ILE 126 -29.064   4.687 -10.848
  986    HA   ILE 126           HA       ILE 126 -31.306   4.096 -12.735
  987    HB   ILE 126           HB       ILE 126 -28.723   2.579 -12.303
  988   HG12  ILE 126          2HG1      ILE 126 -29.687   4.472 -14.499
  989   HG13  ILE 126          3HG1      ILE 126 -28.362   4.760 -13.392
  990   HG21  ILE 126          1HG2      ILE 126 -30.873   1.255 -13.029
  991   HG22  ILE 126          2HG2      ILE 126 -30.779   2.162 -14.514
  992   HG23  ILE 126          3HG2      ILE 126 -29.438   1.105 -14.050
  993   HD11  ILE 126          3HD1      ILE 126 -27.442   4.131 -15.482
  994   HD12  ILE 126          1HD1      ILE 126 -27.180   2.779 -14.338
  995   HD13  ILE 126          2HD1      ILE 126 -28.455   2.672 -15.574
  996    H    LEU 127           H        LEU 127 -32.759   4.131 -11.031
  997    HA   LEU 127           HA       LEU 127 -32.531   2.024  -8.974
  998    HB2  LEU 127           2HB      LEU 127 -34.584   4.253  -9.288
  999    HB3  LEU 127           3HB      LEU 127 -34.501   3.086  -7.981
 1000    HG   LEU 127           HG       LEU 127 -32.357   5.149  -8.692
 1001   HD11  LEU 127          1HD1      LEU 127 -33.845   4.859  -6.066
 1002   HD12  LEU 127          2HD1      LEU 127 -32.532   5.984  -6.439
 1003   HD13  LEU 127          3HD1      LEU 127 -34.100   6.151  -7.270
 1004   HD21  LEU 127          3HD2      LEU 127 -31.298   4.178  -6.530
 1005   HD22  LEU 127          1HD2      LEU 127 -32.383   2.809  -6.796
 1006   HD23  LEU 127          2HD2      LEU 127 -31.190   3.251  -8.038
 1007    H    ASN 128           H        ASN 128 -32.323   0.386 -10.169
 1008    HA   ASN 128           HA       ASN 128 -34.110  -0.712 -12.032
 1009    HB2  ASN 128           2HB      ASN 128 -32.497  -2.268  -9.958
 1010    HB3  ASN 128           3HB      ASN 128 -33.032  -2.837 -11.534
 1011   HD21  ASN 128          2HD2      ASN 128 -30.572  -1.030  -9.798
 1012   HD22  ASN 128          1HD2      ASN 128 -29.622  -0.661 -11.211
 1013    H    PHE 129           H        PHE 129 -36.360  -0.750 -11.636
 1014    HA   PHE 129           HA       PHE 129 -37.255  -1.471  -8.952
 1015    HB2  PHE 129           2HB      PHE 129 -38.891  -0.787 -11.398
 1016    HB3  PHE 129           3HB      PHE 129 -39.417  -0.956  -9.716
 1017    HD1  PHE 129           HD1      PHE 129 -37.398   0.669  -8.232
 1018    HD2  PHE 129           HD2      PHE 129 -39.392   1.425 -11.982
 1019    HE1  PHE 129           HE1      PHE 129 -37.094   3.108  -7.910
 1020    HE2  PHE 129           HE2      PHE 129 -39.098   3.864 -11.642
 1021    HZ   PHE 129           HZ       PHE 129 -37.934   4.709  -9.611
 1022    H    GLU 130           H        GLU 130 -35.955  -3.539  -9.584
 1023    HA   GLU 130           HA       GLU 130 -37.458  -5.469 -11.191
 1024    HB2  GLU 130           2HB      GLU 130 -35.699  -7.051 -10.358
 1025    HB3  GLU 130           3HB      GLU 130 -35.155  -5.681 -11.362
 1026    HG2  GLU 130           2HG      GLU 130 -34.308  -4.514  -9.491
 1027    HG3  GLU 130           3HG      GLU 130 -35.092  -5.591  -8.353
 1028    H    VAL 131           H        VAL 131 -39.233  -6.030 -10.454
 1029    HA   VAL 131           HA       VAL 131 -40.060  -6.771  -7.769
 1030    HB   VAL 131           HB       VAL 131 -41.129  -7.220 -10.549
 1031   HG11  VAL 131          1HG1      VAL 131 -43.204  -8.250  -9.499
 1032   HG12  VAL 131          2HG1      VAL 131 -41.800  -9.305  -9.662
 1033   HG13  VAL 131          3HG1      VAL 131 -42.188  -8.607  -8.086
 1034   HG21  VAL 131          3HG2      VAL 131 -41.455  -5.055  -9.325
 1035   HG22  VAL 131          1HG2      VAL 131 -42.975  -5.873  -9.728
 1036   HG23  VAL 131          2HG2      VAL 131 -42.350  -5.933  -8.068
 1037    H    VAL 132           H        VAL 132 -39.384  -8.475  -6.599
 1038    HA   VAL 132           HA       VAL 132 -39.002 -11.023  -8.018
 1039    HB   VAL 132           HB       VAL 132 -36.893 -11.608  -7.287
 1040   HG11  VAL 132          1HG1      VAL 132 -35.297  -9.942  -8.034
 1041   HG12  VAL 132          2HG1      VAL 132 -36.699  -9.935  -9.110
 1042   HG13  VAL 132          3HG1      VAL 132 -36.500  -8.656  -7.878
 1043   HG21  VAL 132          3HG2      VAL 132 -35.472 -10.295  -5.720
 1044   HG22  VAL 132          1HG2      VAL 132 -36.859  -9.229  -5.425
 1045   HG23  VAL 132          2HG2      VAL 132 -36.924 -10.944  -4.960
 1046    H    MET 133           H        MET 133 -39.383 -12.845  -6.761
 1047    HA   MET 133           HA       MET 133 -40.104 -12.525  -3.908
 1048    HB2  MET 133           2HB      MET 133 -41.997 -13.693  -5.997
 1049    HB3  MET 133           3HB      MET 133 -42.207 -13.799  -4.247
 1050    HG2  MET 133           2HG      MET 133 -42.238 -11.279  -4.152
 1051    HG3  MET 133           3HG      MET 133 -42.195 -11.264  -5.915
 1052    HE1  MET 133           3HE      MET 133 -44.295 -11.763  -2.705
 1053    HE2  MET 133           1HE      MET 133 -45.786 -12.534  -3.285
 1054    HE3  MET 133           2HE      MET 133 -44.273 -13.460  -3.241
 1055    H    GLU 134           H        GLU 134 -40.087 -14.468  -2.729
 1056    HA   GLU 134           HA       GLU 134 -38.213 -16.487  -3.668
 1057    HB2  GLU 134           2HB      GLU 134 -39.866 -16.347  -1.116
 1058    HB3  GLU 134           3HB      GLU 134 -38.564 -17.496  -1.450
 1059    HG2  GLU 134           2HG      GLU 134 -36.986 -15.554  -1.736
 1060    HG3  GLU 134           3HG      GLU 134 -38.278 -14.469  -1.221
 1061    H    LYS 135           H        LYS 135 -38.559 -18.746  -3.779
 1062    HA   LYS 135           HA       LYS 135 -41.143 -19.557  -4.964
 1063    HB2  LYS 135           2HB      LYS 135 -38.457 -20.973  -4.740
 1064    HB3  LYS 135           3HB      LYS 135 -39.901 -21.654  -5.499
 1065    HG2  LYS 135           2HG      LYS 135 -39.951 -19.776  -7.121
 1066    HG3  LYS 135           3HG      LYS 135 -38.470 -19.113  -6.402
 1067    HD2  LYS 135           2HD      LYS 135 -37.267 -21.216  -6.943
 1068    HD3  LYS 135           3HD      LYS 135 -38.719 -21.865  -7.711
 1069    HE2  LYS 135           2HE      LYS 135 -37.279 -19.310  -8.571
 1070    HE3  LYS 135           3HE      LYS 135 -36.996 -20.899  -9.285
 1071    HZ1  LYS 135           HZ1      LYS 135 -39.594 -19.460  -9.340
 1072    HZ2  LYS 135           HZ2      LYS 135 -38.582 -19.651 -10.603
 1073    HZ3  LYS 135           HZ3      LYS 135 -39.336 -20.948  -9.967
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1 -33.391  -9.713   8.319
    2    H2   MET   1           2H       MET   1 -32.405 -10.777   9.081
    3    H3   MET   1           3H       MET   1 -33.141 -11.200   7.684
    4    HA   MET   1           HA       MET   1 -31.901  -9.579   6.442
    5    HB2  MET   1           2HB      MET   1 -31.688  -7.982   8.371
    6    HB3  MET   1           3HB      MET   1 -30.440  -9.029   9.057
    7    HG2  MET   1           2HG      MET   1 -29.052  -8.665   7.013
    8    HG3  MET   1           3HG      MET   1 -30.340  -7.667   6.334
    9    HE1  MET   1           3HE      MET   1 -28.672  -7.800  10.010
   10    HE2  MET   1           1HE      MET   1 -27.370  -7.963   8.807
   11    HE3  MET   1           2HE      MET   1 -27.491  -6.492   9.796
   12    HA   PRO   2           HA       PRO   2 -29.254 -13.121   5.835
   13    HB2  PRO   2           2HB      PRO   2 -27.659 -11.209   4.130
   14    HB3  PRO   2           3HB      PRO   2 -28.207 -12.873   3.752
   15    HG2  PRO   2           2HG      PRO   2 -29.536 -10.758   2.723
   16    HG3  PRO   2           3HG      PRO   2 -30.464 -12.127   3.423
   17    HD2  PRO   2           2HD      PRO   2 -29.755  -9.479   4.722
   18    HD3  PRO   2           3HD      PRO   2 -31.337 -10.318   4.657
   19    H    VAL   3           H        VAL   3 -27.208 -13.943   6.401
   20    HA   VAL   3           HA       VAL   3 -25.137 -12.219   7.567
   21    HB   VAL   3           HB       VAL   3 -26.766 -12.603   9.404
   22   HG11  VAL   3          1HG1      VAL   3 -26.989 -14.762  10.487
   23   HG12  VAL   3          2HG1      VAL   3 -27.552 -14.879   8.815
   24   HG13  VAL   3          3HG1      VAL   3 -25.962 -15.537   9.267
   25   HG21  VAL   3          3HG2      VAL   3 -24.112 -13.968   9.960
   26   HG22  VAL   3          1HG2      VAL   3 -24.364 -12.205   9.871
   27   HG23  VAL   3          2HG2      VAL   3 -25.184 -13.160  11.113
   28    H    ARG   4           H        ARG   4 -23.105 -13.294   7.835
   29    HA   ARG   4           HA       ARG   4 -22.628 -15.480   5.937
   30    HB2  ARG   4           2HB      ARG   4 -20.800 -13.930   7.828
   31    HB3  ARG   4           3HB      ARG   4 -20.267 -15.320   6.894
   32    HG2  ARG   4           2HG      ARG   4 -19.609 -13.540   5.584
   33    HG3  ARG   4           3HG      ARG   4 -21.067 -14.123   4.783
   34    HD2  ARG   4           2HD      ARG   4 -22.357 -12.262   5.783
   35    HD3  ARG   4           3HD      ARG   4 -20.915 -11.739   6.683
   36    HE   ARG   4           HE       ARG   4 -20.314 -11.857   3.888
   37   HH11  ARG   4          1HH1      ARG   4 -22.136  -9.826   6.089
   38   HH12  ARG   4          2HH1      ARG   4 -21.978  -8.425   5.066
   39   HH21  ARG   4          1HH2      ARG   4 -20.150 -10.031   2.638
   40   HH22  ARG   4          2HH2      ARG   4 -20.881  -8.544   3.166
   41    H    ARG   5           H        ARG   5 -22.331 -17.561   6.307
   42    HA   ARG   5           HA       ARG   5 -22.054 -18.748   8.986
   43    HB2  ARG   5           2HB      ARG   5 -24.121 -20.031   8.891
   44    HB3  ARG   5           3HB      ARG   5 -24.492 -18.312   8.831
   45    HG2  ARG   5           2HG      ARG   5 -24.849 -18.446   6.379
   46    HG3  ARG   5           3HG      ARG   5 -24.388 -20.154   6.407
   47    HD2  ARG   5           2HD      ARG   5 -26.314 -20.566   8.001
   48    HD3  ARG   5           3HD      ARG   5 -26.821 -18.888   7.698
   49    HE   ARG   5           HE       ARG   5 -26.362 -20.440   5.262
   50   HH11  ARG   5          1HH1      ARG   5 -28.832 -19.888   7.694
   51   HH12  ARG   5          2HH1      ARG   5 -30.123 -20.324   6.608
   52   HH21  ARG   5          2HH2      ARG   5 -28.046 -20.888   3.921
   53   HH22  ARG   5          1HH2      ARG   5 -29.681 -20.889   4.520
   54    H    GLY   6           H        GLY   6 -22.056 -21.175   8.849
   55    HA2  GLY   6           HA2      GLY   6 -20.202 -22.047   6.782
   56    HA3  GLY   6           HA3      GLY   6 -20.766 -22.969   8.171
   57    H    HIS   7           H        HIS   7 -23.425 -21.819   6.315
   58    HA   HIS   7           HA       HIS   7 -23.641 -24.359   4.758
   59    HB2  HIS   7           2HB      HIS   7 -24.774 -24.638   6.940
   60    HB3  HIS   7           3HB      HIS   7 -25.772 -23.223   6.605
   61    HD2  HIS   7           HD2      HIS   7 -27.912 -23.576   5.065
   62    HE1  HIS   7           HE1      HIS   7 -27.304 -27.675   4.062
   63    HE2  HIS   7           HE2      HIS   7 -28.928 -25.721   3.927
   64    H    VAL   8           H        VAL   8 -24.720 -24.271   2.857
   65    HA   VAL   8           HA       VAL   8 -25.816 -21.638   1.938
   66    HB   VAL   8           HB       VAL   8 -24.379 -23.655   0.174
   67   HG11  VAL   8          1HG1      VAL   8 -25.978 -22.197  -1.043
   68   HG12  VAL   8          2HG1      VAL   8 -25.241 -20.761  -0.308
   69   HG13  VAL   8          3HG1      VAL   8 -24.320 -21.772  -1.439
   70   HG21  VAL   8          3HG2      VAL   8 -23.328 -21.050   1.367
   71   HG22  VAL   8          1HG2      VAL   8 -22.706 -22.685   1.684
   72   HG23  VAL   8          2HG2      VAL   8 -22.530 -21.981   0.080
   73    H    ALA   9           H        ALA   9 -27.747 -21.691   0.839
   74    HA   ALA   9           HA       ALA   9 -29.574 -23.888   1.082
   75    HB1  ALA   9           3HB      ALA   9 -30.239 -21.516   0.909
   76    HB2  ALA   9           1HB      ALA   9 -29.560 -21.433  -0.733
   77    HB3  ALA   9           2HB      ALA   9 -30.971 -22.452  -0.402
   78    HA   PRO  10           HA       PRO  10 -28.884 -26.643  -2.375
   79    HB2  PRO  10           2HB      PRO  10 -31.574 -25.731  -3.390
   80    HB3  PRO  10           3HB      PRO  10 -30.898 -27.388  -3.346
   81    HG2  PRO  10           2HG      PRO  10 -32.607 -26.585  -1.403
   82    HG3  PRO  10           3HG      PRO  10 -31.134 -27.511  -0.972
   83    HD2  PRO  10           2HD      PRO  10 -31.638 -24.552  -0.699
   84    HD3  PRO  10           3HD      PRO  10 -30.750 -25.662   0.379
   85    H    GLN  11           H        GLN  11 -27.376 -26.070  -3.714
   86    HA   GLN  11           HA       GLN  11 -26.954 -23.463  -4.554
   87    HB2  GLN  11           2HB      GLN  11 -24.950 -24.157  -5.519
   88    HB3  GLN  11           3HB      GLN  11 -25.218 -25.168  -4.111
   89    HG2  GLN  11           2HG      GLN  11 -25.594 -25.950  -7.036
   90    HG3  GLN  11           3HG      GLN  11 -24.284 -26.437  -5.969
   91   HE21  GLN  11          2HE2      GLN  11 -26.649 -27.910  -7.478
   92   HE22  GLN  11          1HE2      GLN  11 -27.187 -29.014  -6.213
   93    H    ASN  12           H        ASN  12 -28.601 -25.947  -6.417
   94    HA   ASN  12           HA       ASN  12 -28.351 -24.707  -9.009
   95    HB2  ASN  12           2HB      ASN  12 -30.256 -26.761  -7.784
   96    HB3  ASN  12           3HB      ASN  12 -30.477 -26.146  -9.417
   97   HD21  ASN  12          2HD2      ASN  12 -30.237 -28.603  -9.733
   98   HD22  ASN  12          1HD2      ASN  12 -28.597 -29.130 -10.083
   99    H    THR  13           H        THR  13 -30.944 -24.557  -6.535
  100    HA   THR  13           HA       THR  13 -32.482 -22.587  -8.055
  101    HB   THR  13           HB       THR  13 -33.301 -24.472  -6.510
  102    HG1  THR  13           HG1      THR  13 -35.157 -23.345  -6.196
  103   HG21  THR  13          1HG2      THR  13 -33.791 -23.900  -4.223
  104   HG22  THR  13          2HG2      THR  13 -32.048 -23.722  -4.490
  105   HG23  THR  13          3HG2      THR  13 -33.069 -22.280  -4.415
  106    H    PHE  14           H        PHE  14 -30.289 -22.524  -5.258
  107    HA   PHE  14           HA       PHE  14 -30.501 -19.779  -4.541
  108    HB2  PHE  14           2HB      PHE  14 -29.315 -21.603  -3.316
  109    HB3  PHE  14           3HB      PHE  14 -28.100 -21.641  -4.577
  110    HD1  PHE  14           HD1      PHE  14 -29.679 -19.270  -2.114
  111    HD2  PHE  14           HD2      PHE  14 -26.138 -20.349  -4.332
  112    HE1  PHE  14           HE1      PHE  14 -28.378 -17.550  -0.880
  113    HE2  PHE  14           HE2      PHE  14 -24.843 -18.626  -3.100
  114    HZ   PHE  14           HZ       PHE  14 -25.960 -17.226  -1.372
  115    H    LEU  15           H        LEU  15 -28.609 -21.435  -7.059
  116    HA   LEU  15           HA       LEU  15 -27.476 -18.982  -8.161
  117    HB2  LEU  15           2HB      LEU  15 -26.308 -21.037  -8.565
  118    HB3  LEU  15           3HB      LEU  15 -27.736 -21.780  -9.294
  119    HG   LEU  15           HG       LEU  15 -27.648 -20.262 -11.189
  120   HD11  LEU  15          1HD1      LEU  15 -25.764 -18.733 -11.578
  121   HD12  LEU  15          2HD1      LEU  15 -26.638 -18.251 -10.136
  122   HD13  LEU  15          3HD1      LEU  15 -25.100 -19.108  -9.962
  123   HD21  LEU  15          3HD2      LEU  15 -25.587 -21.095 -12.228
  124   HD22  LEU  15          1HD2      LEU  15 -24.944 -21.541 -10.632
  125   HD23  LEU  15          2HD2      LEU  15 -26.378 -22.367 -11.281
  126    H    ASP  16           H        ASP  16 -30.287 -21.006  -9.196
  127    HA   ASP  16           HA       ASP  16 -31.281 -19.564 -11.310
  128    HB2  ASP  16           2HB      ASP  16 -32.281 -21.604 -10.296
  129    HB3  ASP  16           3HB      ASP  16 -32.979 -20.612  -9.033
  130    H    THR  17           H        THR  17 -31.612 -18.624  -7.895
  131    HA   THR  17           HA       THR  17 -33.253 -16.274  -8.358
  132    HB   THR  17           HB       THR  17 -31.173 -16.779  -6.183
  133    HG1  THR  17           HG1      THR  17 -33.959 -16.774  -5.872
  134   HG21  THR  17          1HG2      THR  17 -32.464 -15.085  -4.862
  135   HG22  THR  17          2HG2      THR  17 -31.583 -14.383  -6.221
  136   HG23  THR  17          3HG2      THR  17 -33.338 -14.638  -6.349
  137    H    ILE  18           H        ILE  18 -29.727 -16.726  -8.438
  138    HA   ILE  18           HA       ILE  18 -29.098 -13.925  -8.939
  139    HB   ILE  18           HB       ILE  18 -27.452 -16.389  -9.531
  140   HG12  ILE  18          2HG1      ILE  18 -27.999 -16.464  -7.172
  141   HG13  ILE  18          3HG1      ILE  18 -26.301 -16.179  -7.449
  142   HG21  ILE  18          1HG2      ILE  18 -26.527 -14.486 -10.661
  143   HG22  ILE  18          2HG2      ILE  18 -26.649 -13.479  -9.207
  144   HG23  ILE  18          3HG2      ILE  18 -25.500 -14.837  -9.273
  145   HD11  ILE  18          3HD1      ILE  18 -26.610 -13.771  -6.862
  146   HD12  ILE  18          1HD1      ILE  18 -28.358 -14.047  -6.663
  147   HD13  ILE  18          2HD1      ILE  18 -27.202 -14.828  -5.570
  148    H    ILE  19           H        ILE  19 -29.706 -16.824 -10.955
  149    HA   ILE  19           HA       ILE  19 -29.167 -15.658 -13.455
  150    HB   ILE  19           HB       ILE  19 -31.397 -17.641 -12.846
  151   HG12  ILE  19          2HG1      ILE  19 -29.393 -18.732 -12.167
  152   HG13  ILE  19          3HG1      ILE  19 -29.830 -19.373 -13.729
  153   HG21  ILE  19          1HG2      ILE  19 -31.146 -18.230 -15.262
  154   HG22  ILE  19          2HG2      ILE  19 -31.767 -16.603 -14.989
  155   HG23  ILE  19          3HG2      ILE  19 -30.069 -16.827 -15.450
  156   HD11  ILE  19          3HD1      ILE  19 -27.619 -17.388 -13.095
  157   HD12  ILE  19          1HD1      ILE  19 -27.454 -19.066 -13.633
  158   HD13  ILE  19          2HD1      ILE  19 -28.094 -17.831 -14.755
  159    H    ARG  20           H        ARG  20 -32.308 -15.690 -11.657
  160    HA   ARG  20           HA       ARG  20 -33.707 -13.941 -13.468
  161    HB2  ARG  20           2HB      ARG  20 -34.138 -14.038 -10.467
  162    HB3  ARG  20           3HB      ARG  20 -35.285 -13.461 -11.657
  163    HG2  ARG  20           2HG      ARG  20 -34.376 -16.383 -11.498
  164    HG3  ARG  20           3HG      ARG  20 -35.707 -15.706 -10.577
  165    HD2  ARG  20           2HD      ARG  20 -36.853 -16.520 -12.374
  166    HD3  ARG  20           3HD      ARG  20 -36.593 -14.849 -12.895
  167    HE   ARG  20           HE       ARG  20 -34.543 -16.881 -13.597
  168   HH11  ARG  20          2HH1      ARG  20 -36.829 -14.576 -14.904
  169   HH12  ARG  20          1HH1      ARG  20 -36.499 -15.091 -16.530
  170   HH21  ARG  20          1HH2      ARG  20 -34.465 -17.682 -15.710
  171   HH22  ARG  20          2HH2      ARG  20 -35.317 -16.810 -16.960
  172    H    LYS  21           H        LYS  21 -31.507 -13.290 -10.898
  173    HA   LYS  21           HA       LYS  21 -31.936 -10.441 -10.608
  174    HB2  LYS  21           2HB      LYS  21 -30.434 -12.226  -9.209
  175    HB3  LYS  21           3HB      LYS  21 -29.169 -11.522 -10.226
  176    HG2  LYS  21           2HG      LYS  21 -29.141 -10.292  -8.225
  177    HG3  LYS  21           3HG      LYS  21 -29.951  -9.236  -9.393
  178    HD2  LYS  21           2HD      LYS  21 -32.162  -9.964  -8.466
  179    HD3  LYS  21           3HD      LYS  21 -31.326 -11.011  -7.305
  180    HE2  LYS  21           2HE      LYS  21 -30.251  -9.079  -6.257
  181    HE3  LYS  21           3HE      LYS  21 -30.884  -8.008  -7.519
  182    HZ1  LYS  21           HZ1      LYS  21 -33.121  -8.542  -6.788
  183    HZ2  LYS  21           HZ2      LYS  21 -32.544  -9.454  -5.536
  184    HZ3  LYS  21           HZ3      LYS  21 -32.247  -7.830  -5.587
  185    H    PHE  22           H        PHE  22 -29.677 -12.246 -12.747
  186    HA   PHE  22           HA       PHE  22 -29.222  -9.654 -14.179
  187    HB2  PHE  22           2HB      PHE  22 -27.187 -10.454 -15.002
  188    HB3  PHE  22           3HB      PHE  22 -27.234 -10.757 -13.284
  189    HD1  PHE  22           HD1      PHE  22 -27.525 -12.404 -16.651
  190    HD2  PHE  22           HD2      PHE  22 -26.832 -12.950 -12.433
  191    HE1  PHE  22           HE1      PHE  22 -26.848 -14.747 -17.067
  192    HE2  PHE  22           HE2      PHE  22 -26.128 -15.295 -12.860
  193    HZ   PHE  22           HZ       PHE  22 -26.144 -16.199 -15.174
  194    H    GLU  23           H        GLU  23 -31.210 -12.277 -14.626
  195    HA   GLU  23           HA       GLU  23 -30.809 -13.275 -17.071
  196    HB2  GLU  23           2HB      GLU  23 -32.413 -14.148 -15.529
  197    HB3  GLU  23           3HB      GLU  23 -33.448 -12.760 -15.694
  198    HG2  GLU  23           2HG      GLU  23 -32.843 -14.156 -18.280
  199    HG3  GLU  23           3HG      GLU  23 -33.516 -15.179 -17.061
  200    H    GLY  24           H        GLY  24 -32.426 -10.211 -16.467
  201    HA2  GLY  24           HA2      GLY  24 -32.284  -8.307 -17.842
  202    HA3  GLY  24           HA3      GLY  24 -31.983  -9.320 -19.243
  203    H    GLN  25           H        GLN  25 -34.752 -10.684 -18.018
  204    HA   GLN  25           HA       GLN  25 -36.642  -8.625 -19.089
  205    HB2  GLN  25           2HB      GLN  25 -36.846 -11.659 -19.271
  206    HB3  GLN  25           3HB      GLN  25 -38.090 -10.502 -19.728
  207    HG2  GLN  25           2HG      GLN  25 -36.544  -9.516 -21.426
  208    HG3  GLN  25           3HG      GLN  25 -35.330 -10.727 -21.002
  209   HE21  GLN  25          2HE2      GLN  25 -35.723 -10.904 -23.535
  210   HE22  GLN  25          1HE2      GLN  25 -36.881 -12.152 -23.978
  211    H    SER  26           H        SER  26 -36.061 -11.142 -16.614
  212    HA   SER  26           HA       SER  26 -38.296 -10.478 -14.924
  213    HB2  SER  26           2HB      SER  26 -35.530 -11.594 -14.340
  214    HB3  SER  26           3HB      SER  26 -36.724 -11.300 -13.063
  215    HG   SER  26           HG       SER  26 -38.178 -12.670 -14.168
  216    H    ARG  27           H        ARG  27 -35.194  -8.896 -15.469
  217    HA   ARG  27           HA       ARG  27 -35.544  -6.829 -13.414
  218    HB2  ARG  27           2HB      ARG  27 -33.588  -7.462 -15.607
  219    HB3  ARG  27           3HB      ARG  27 -33.680  -5.791 -15.120
  220    HG2  ARG  27           2HG      ARG  27 -33.467  -7.780 -12.874
  221    HG3  ARG  27           3HG      ARG  27 -32.052  -7.592 -13.928
  222    HD2  ARG  27           2HD      ARG  27 -31.949  -5.212 -13.548
  223    HD3  ARG  27           3HD      ARG  27 -33.477  -5.217 -12.659
  224    HE   ARG  27           HE       ARG  27 -32.317  -6.705 -10.958
  225   HH11  ARG  27          2HH1      ARG  27 -30.375  -4.317 -12.660
  226   HH12  ARG  27          1HH1      ARG  27 -29.088  -4.475 -11.488
  227   HH21  ARG  27          1HH2      ARG  27 -30.939  -6.640  -9.520
  228   HH22  ARG  27          2HH2      ARG  27 -29.428  -5.725  -9.633
  229    H    LYS  28           H        LYS  28 -36.017  -4.777 -13.670
  230    HA   LYS  28           HA       LYS  28 -36.867  -3.538 -16.220
  231    HB2  LYS  28           2HB      LYS  28 -38.410  -3.235 -13.595
  232    HB3  LYS  28           3HB      LYS  28 -38.800  -2.530 -15.138
  233    HG2  LYS  28           2HG      LYS  28 -40.229  -4.211 -15.316
  234    HG3  LYS  28           3HG      LYS  28 -38.882  -5.169 -15.854
  235    HD2  LYS  28           2HD      LYS  28 -38.629  -6.000 -13.466
  236    HD3  LYS  28           3HD      LYS  28 -39.953  -4.933 -12.995
  237    HE2  LYS  28           2HE      LYS  28 -41.000  -7.008 -13.234
  238    HE3  LYS  28           3HE      LYS  28 -41.421  -6.133 -14.706
  239    HZ1  LYS  28           HZ1      LYS  28 -40.703  -8.415 -15.182
  240    HZ2  LYS  28           HZ2      LYS  28 -39.631  -7.382 -15.853
  241    HZ3  LYS  28           HZ3      LYS  28 -39.255  -8.151 -14.457
  242    H    PHE  29           H        PHE  29 -36.516  -1.172 -16.153
  243    HA   PHE  29           HA       PHE  29 -35.479   0.117 -13.782
  244    HB2  PHE  29           2HB      PHE  29 -33.160   0.399 -14.451
  245    HB3  PHE  29           3HB      PHE  29 -33.512  -1.292 -14.294
  246    HD1  PHE  29           HD2      PHE  29 -33.639  -2.787 -16.275
  247    HD2  PHE  29           HD1      PHE  29 -32.481   1.358 -16.590
  248    HE1  PHE  29           HE2      PHE  29 -32.615  -3.240 -18.490
  249    HE2  PHE  29           HE1      PHE  29 -31.447   0.891 -18.804
  250    HZ   PHE  29           HZ       PHE  29 -31.501  -1.406 -19.746
  251    H    ILE  30           H        ILE  30 -34.663   2.176 -14.043
  252    HA   ILE  30           HA       ILE  30 -35.227   3.641 -16.556
  253    HB   ILE  30           HB       ILE  30 -35.630   5.656 -14.956
  254   HG12  ILE  30          2HG1      ILE  30 -36.797   5.210 -12.887
  255   HG13  ILE  30          3HG1      ILE  30 -36.519   3.475 -13.032
  256   HG21  ILE  30          1HG2      ILE  30 -37.673   3.475 -15.332
  257   HG22  ILE  30          2HG2      ILE  30 -38.017   5.196 -15.026
  258   HG23  ILE  30          3HG2      ILE  30 -37.191   4.712 -16.523
  259   HD11  ILE  30          3HD1      ILE  30 -34.121   3.771 -12.668
  260   HD12  ILE  30          1HD1      ILE  30 -34.291   5.546 -12.771
  261   HD13  ILE  30          2HD1      ILE  30 -35.010   4.650 -11.422
  262    H    ILE  31           H        ILE  31 -34.112   5.707 -16.633
  263    HA   ILE  31           HA       ILE  31 -31.467   5.728 -15.279
  264    HB   ILE  31           HB       ILE  31 -32.019   6.989 -17.967
  265   HG12  ILE  31          2HG1      ILE  31 -32.433   4.549 -18.257
  266   HG13  ILE  31          3HG1      ILE  31 -31.039   5.144 -19.169
  267   HG21  ILE  31          1HG2      ILE  31 -30.139   7.851 -16.690
  268   HG22  ILE  31          2HG2      ILE  31 -29.471   6.232 -16.480
  269   HG23  ILE  31          3HG2      ILE  31 -29.541   6.966 -18.104
  270   HD11  ILE  31          3HD1      ILE  31 -30.682   2.936 -17.994
  271   HD12  ILE  31          1HD1      ILE  31 -29.473   4.184 -17.642
  272   HD13  ILE  31          2HD1      ILE  31 -30.746   3.837 -16.457
  273    H    ALA  32           H        ALA  32 -31.520   7.175 -13.858
  274    HA   ALA  32           HA       ALA  32 -32.995   9.723 -14.315
  275    HB1  ALA  32           3HB      ALA  32 -33.311   9.821 -11.783
  276    HB2  ALA  32           1HB      ALA  32 -34.307   8.639 -12.676
  277    HB3  ALA  32           2HB      ALA  32 -32.930   8.103 -11.742
  278    H    ASN  33           H        ASN  33 -32.130  11.606 -13.604
  279    HA   ASN  33           HA       ASN  33 -29.207  11.708 -13.429
  280    HB2  ASN  33           2HB      ASN  33 -30.588  13.190 -14.805
  281    HB3  ASN  33           3HB      ASN  33 -31.422  13.798 -13.378
  282   HD21  ASN  33          2HD2      ASN  33 -30.295  15.465 -15.139
  283   HD22  ASN  33          1HD2      ASN  33 -28.838  16.195 -14.477
  284    H    ALA  34           H        ALA  34 -28.237  11.279 -11.513
  285    HA   ALA  34           HA       ALA  34 -29.595  11.546  -8.955
  286    HB1  ALA  34           3HB      ALA  34 -27.914   9.781  -9.463
  287    HB2  ALA  34           1HB      ALA  34 -26.660  11.036  -9.581
  288    HB3  ALA  34           2HB      ALA  34 -27.479  10.739  -8.041
  289    H    ARG  35           H        ARG  35 -28.092  13.849 -10.908
  290    HA   ARG  35           HA       ARG  35 -26.897  15.400  -8.652
  291    HB2  ARG  35           2HB      ARG  35 -26.511  15.915 -11.609
  292    HB3  ARG  35           3HB      ARG  35 -25.542  16.492 -10.264
  293    HG2  ARG  35           2HG      ARG  35 -25.656  13.701 -11.447
  294    HG3  ARG  35           3HG      ARG  35 -24.292  14.797 -11.376
  295    HD2  ARG  35           2HD      ARG  35 -25.516  13.226  -9.077
  296    HD3  ARG  35           3HD      ARG  35 -23.942  12.990  -9.835
  297    HE   ARG  35           HE       ARG  35 -23.871  15.600  -8.881
  298   HH11  ARG  35          1HH1      ARG  35 -24.214  12.413  -7.381
  299   HH12  ARG  35          2HH1      ARG  35 -23.624  13.007  -5.855
  300   HH21  ARG  35          1HH2      ARG  35 -23.103  16.231  -6.900
  301   HH22  ARG  35          2HH2      ARG  35 -22.978  15.081  -5.603
  302    H    VAL  36           H        VAL  36 -29.771  15.397 -10.304
  303    HA   VAL  36           HA       VAL  36 -30.160  18.342 -10.122
  304    HB   VAL  36           HB       VAL  36 -30.436  17.158 -12.334
  305   HG11  VAL  36          1HG1      VAL  36 -32.480  16.027 -12.863
  306   HG12  VAL  36          2HG1      VAL  36 -31.770  15.190 -11.468
  307   HG13  VAL  36          3HG1      VAL  36 -33.140  16.296 -11.242
  308   HG21  VAL  36          3HG2      VAL  36 -32.323  18.511 -13.009
  309   HG22  VAL  36          1HG2      VAL  36 -32.814  18.746 -11.316
  310   HG23  VAL  36          2HG2      VAL  36 -31.271  19.414 -11.906
  311    H    GLU  37           H        GLU  37 -31.782  19.237  -8.900
  312    HA   GLU  37           HA       GLU  37 -32.498  17.904  -6.529
  313    HB2  GLU  37           2HB      GLU  37 -32.277  20.359  -6.908
  314    HB3  GLU  37           3HB      GLU  37 -33.813  20.351  -7.782
  315    HG2  GLU  37           2HG      GLU  37 -34.992  19.630  -5.736
  316    HG3  GLU  37           3HG      GLU  37 -33.456  19.489  -4.876
  317    H    ASN  38           H        ASN  38 -34.358  18.127  -9.536
  318    HA   ASN  38           HA       ASN  38 -36.802  17.030  -8.407
  319    HB2  ASN  38           2HB      ASN  38 -36.580  18.612 -10.401
  320    HB3  ASN  38           3HB      ASN  38 -35.973  17.239 -11.329
  321   HD21  ASN  38          2HD2      ASN  38 -37.770  17.390 -12.796
  322   HD22  ASN  38          1HD2      ASN  38 -39.381  16.917 -12.287
  323    H    CYS  39           H        CYS  39 -33.856  15.509  -9.097
  324    HA   CYS  39           HA       CYS  39 -33.160  13.405  -9.608
  325    HB2  CYS  39           2HB      CYS  39 -35.593  12.652  -7.944
  326    HB3  CYS  39           3HB      CYS  39 -34.119  11.700  -8.165
  327    HG   CYS  39           HG       CYS  39 -34.402  14.754  -6.846
  328    H    ALA  40           H        ALA  40 -34.593  14.357 -11.826
  329    HA   ALA  40           HA       ALA  40 -36.756  12.585 -12.420
  330    HB1  ALA  40           3HB      ALA  40 -37.141  13.966 -14.348
  331    HB2  ALA  40           1HB      ALA  40 -36.792  14.974 -12.946
  332    HB3  ALA  40           2HB      ALA  40 -35.530  14.719 -14.182
  333    H    VAL  41           H        VAL  41 -37.187  11.400 -14.237
  334    HA   VAL  41           HA       VAL  41 -35.202   9.466 -15.045
  335    HB   VAL  41           HB       VAL  41 -38.156   9.837 -15.701
  336   HG11  VAL  41          1HG1      VAL  41 -37.104   8.469 -17.471
  337   HG12  VAL  41          2HG1      VAL  41 -36.334   7.457 -16.234
  338   HG13  VAL  41          3HG1      VAL  41 -38.101   7.460 -16.425
  339   HG21  VAL  41          3HG2      VAL  41 -37.703   9.314 -13.309
  340   HG22  VAL  41          1HG2      VAL  41 -38.516   7.991 -14.138
  341   HG23  VAL  41          2HG2      VAL  41 -36.768   7.888 -13.803
  342    H    ILE  42           H        ILE  42 -33.748  10.462 -16.296
  343    HA   ILE  42           HA       ILE  42 -34.370  12.148 -18.595
  344    HB   ILE  42           HB       ILE  42 -31.934  12.029 -18.993
  345   HG12  ILE  42          2HG1      ILE  42 -31.809  10.281 -16.489
  346   HG13  ILE  42          3HG1      ILE  42 -31.584   9.675 -18.139
  347   HG21  ILE  42          1HG2      ILE  42 -31.300  13.347 -17.060
  348   HG22  ILE  42          2HG2      ILE  42 -33.005  13.670 -17.384
  349   HG23  ILE  42          3HG2      ILE  42 -32.549  12.579 -16.056
  350   HD11  ILE  42          3HD1      ILE  42 -29.820  11.615 -16.632
  351   HD12  ILE  42          1HD1      ILE  42 -29.457   9.960 -17.144
  352   HD13  ILE  42          2HD1      ILE  42 -29.643  11.227 -18.374
  353    H    TYR  43           H        TYR  43 -34.046   8.739 -18.032
  354    HA   TYR  43           HA       TYR  43 -34.965   8.146 -20.727
  355    HB2  TYR  43           2HB      TYR  43 -32.345   8.347 -20.893
  356    HB3  TYR  43           3HB      TYR  43 -32.336   6.811 -20.079
  357    HD1  TYR  43           HD1      TYR  43 -33.577   8.586 -23.105
  358    HD2  TYR  43           HD2      TYR  43 -32.794   4.763 -21.256
  359    HE1  TYR  43           HE1      TYR  43 -33.973   7.440 -25.287
  360    HE2  TYR  43           HE2      TYR  43 -33.198   3.627 -23.429
  361    HH   TYR  43           HH       TYR  43 -33.728   3.881 -25.644
  362    H    CYS  44           H        CYS  44 -35.473   5.777 -21.057
  363    HA   CYS  44           HA       CYS  44 -35.832   4.362 -18.490
  364    HB2  CYS  44           2HB      CYS  44 -38.250   4.077 -18.962
  365    HB3  CYS  44           3HB      CYS  44 -37.812   5.780 -18.724
  366    HG   CYS  44           HG       CYS  44 -37.933   4.207 -21.653
  367    H    ASN  45           H        ASN  45 -36.237   2.126 -18.588
  368    HA   ASN  45           HA       ASN  45 -35.818   0.866 -21.241
  369    HB2  ASN  45           2HB      ASN  45 -34.566   0.109 -19.169
  370    HB3  ASN  45           3HB      ASN  45 -36.081  -0.595 -18.598
  371   HD21  ASN  45          2HD2      ASN  45 -33.687  -0.630 -21.289
  372   HD22  ASN  45          1HD2      ASN  45 -34.105  -2.256 -21.806
  373    H    ASP  46           H        ASP  46 -37.224  -0.668 -22.064
  374    HA   ASP  46           HA       ASP  46 -40.043  -0.022 -21.829
  375    HB2  ASP  46           2HB      ASP  46 -38.643  -2.343 -23.204
  376    HB3  ASP  46           3HB      ASP  46 -40.355  -1.948 -23.365
  377    H    GLY  47           H        GLY  47 -37.964  -2.447 -20.272
  378    HA2  GLY  47           HA2      GLY  47 -39.846  -4.202 -19.160
  379    HA3  GLY  47           HA3      GLY  47 -38.356  -3.668 -18.368
  380    H    PHE  48           H        PHE  48 -38.847  -0.970 -17.813
  381    HA   PHE  48           HA       PHE  48 -40.688  -1.227 -15.582
  382    HB2  PHE  48           2HB      PHE  48 -39.278   0.204 -14.755
  383    HB3  PHE  48           3HB      PHE  48 -38.562   0.543 -16.307
  384    HD1  PHE  48           HD1      PHE  48 -39.284   2.483 -17.678
  385    HD2  PHE  48           HD2      PHE  48 -40.966   1.678 -13.791
  386    HE1  PHE  48           HE1      PHE  48 -40.090   4.822 -17.519
  387    HE2  PHE  48           HE2      PHE  48 -41.810   4.003 -13.663
  388    HZ   PHE  48           HZ       PHE  48 -41.362   5.589 -15.525
  389    H    CYS  49           H        CYS  49 -40.930  -0.031 -18.819
  390    HA   CYS  49           HA       CYS  49 -43.395   1.457 -18.576
  391    HB2  CYS  49           2HB      CYS  49 -41.741   1.561 -20.505
  392    HB3  CYS  49           3HB      CYS  49 -42.366  -0.017 -21.031
  393    HG   CYS  49           HG       CYS  49 -44.902   0.723 -21.094
  394    H    GLU  50           H        GLU  50 -42.599  -2.018 -19.092
  395    HA   GLU  50           HA       GLU  50 -45.434  -2.810 -19.177
  396    HB2  GLU  50           2HB      GLU  50 -42.936  -4.496 -18.777
  397    HB3  GLU  50           3HB      GLU  50 -44.565  -5.091 -19.105
  398    HG2  GLU  50           2HG      GLU  50 -44.569  -3.824 -21.272
  399    HG3  GLU  50           3HG      GLU  50 -42.890  -3.383 -20.987
  400    H    LEU  51           H        LEU  51 -42.925  -2.577 -16.687
  401    HA   LEU  51           HA       LEU  51 -44.112  -3.917 -14.539
  402    HB2  LEU  51           2HB      LEU  51 -41.859  -2.985 -14.564
  403    HB3  LEU  51           3HB      LEU  51 -42.512  -1.360 -14.551
  404    HG   LEU  51           HG       LEU  51 -43.470  -1.575 -12.397
  405   HD11  LEU  51          1HD1      LEU  51 -42.826  -3.455 -10.911
  406   HD12  LEU  51          2HD1      LEU  51 -43.881  -3.978 -12.229
  407   HD13  LEU  51          3HD1      LEU  51 -42.135  -4.313 -12.308
  408   HD21  LEU  51          3HD2      LEU  51 -40.525  -2.317 -12.508
  409   HD22  LEU  51          1HD2      LEU  51 -41.208  -0.676 -12.653
  410   HD23  LEU  51          2HD2      LEU  51 -41.362  -1.563 -11.129
  411    H    CYS  52           H        CYS  52 -44.483  -0.433 -15.399
  412    HA   CYS  52           HA       CYS  52 -46.833  -0.182 -13.609
  413    HB2  CYS  52           2HB      CYS  52 -45.478   1.905 -15.370
  414    HB3  CYS  52           3HB      CYS  52 -46.673   2.193 -14.088
  415    HG   CYS  52           HG       CYS  52 -43.610   0.953 -13.887
  416    H    GLY  53           H        GLY  53 -46.234  -0.665 -16.976
  417    HA2  GLY  53           HA2      GLY  53 -47.683  -1.455 -18.579
  418    HA3  GLY  53           HA3      GLY  53 -49.059  -1.138 -17.529
  419    H    TYR  54           H        TYR  54 -47.097   1.666 -18.017
  420    HA   TYR  54           HA       TYR  54 -49.269   2.901 -19.593
  421    HB2  TYR  54           2HB      TYR  54 -46.964   4.066 -18.020
  422    HB3  TYR  54           3HB      TYR  54 -48.056   5.032 -19.003
  423    HD1  TYR  54           HD1      TYR  54 -50.473   5.200 -18.516
  424    HD2  TYR  54           HD2      TYR  54 -47.701   3.296 -15.821
  425    HE1  TYR  54           HE1      TYR  54 -52.115   5.440 -16.662
  426    HE2  TYR  54           HE2      TYR  54 -49.353   3.523 -13.962
  427    HH   TYR  54           HH       TYR  54 -52.558   5.062 -14.454
  428    H    SER  55           H        SER  55 -46.550   4.728 -20.230
  429    HA   SER  55           HA       SER  55 -45.630   3.406 -22.682
  430    HB2  SER  55           2HB      SER  55 -47.772   4.372 -23.425
  431    HB3  SER  55           3HB      SER  55 -47.272   5.962 -22.816
  432    HG   SER  55           HG       SER  55 -46.873   5.613 -25.102
  433    H    ARG  56           H        ARG  56 -43.648   4.195 -23.271
  434    HA   ARG  56           HA       ARG  56 -42.113   5.664 -21.381
  435    HB2  ARG  56           2HB      ARG  56 -40.310   5.545 -23.044
  436    HB3  ARG  56           3HB      ARG  56 -41.115   4.001 -22.768
  437    HG2  ARG  56           2HG      ARG  56 -42.419   4.406 -24.928
  438    HG3  ARG  56           3HG      ARG  56 -41.391   5.829 -25.192
  439    HD2  ARG  56           2HD      ARG  56 -39.380   4.339 -25.080
  440    HD3  ARG  56           3HD      ARG  56 -40.452   2.950 -24.854
  441    HE   ARG  56           HE       ARG  56 -40.672   4.692 -27.279
  442   HH11  ARG  56          2HH1      ARG  56 -40.071   1.400 -26.056
  443   HH12  ARG  56          1HH1      ARG  56 -40.099   0.768 -27.676
  444   HH21  ARG  56          1HH2      ARG  56 -40.710   3.740 -29.257
  445   HH22  ARG  56          2HH2      ARG  56 -40.461   2.026 -29.410
  446    H    ALA  57           H        ALA  57 -43.801   6.844 -24.213
  447    HA   ALA  57           HA       ALA  57 -42.667   9.466 -24.363
  448    HB1  ALA  57           3HB      ALA  57 -44.732   9.956 -25.641
  449    HB2  ALA  57           1HB      ALA  57 -44.036   8.398 -26.130
  450    HB3  ALA  57           2HB      ALA  57 -45.459   8.439 -25.063
  451    H    GLU  58           H        GLU  58 -44.655   8.098 -21.885
  452    HA   GLU  58           HA       GLU  58 -45.611  10.724 -20.901
  453    HB2  GLU  58           2HB      GLU  58 -46.291   7.909 -19.966
  454    HB3  GLU  58           3HB      GLU  58 -46.981   9.417 -19.393
  455    HG2  GLU  58           2HG      GLU  58 -47.848   9.876 -21.703
  456    HG3  GLU  58           3HG      GLU  58 -47.268   8.290 -22.209
  457    H    VAL  59           H        VAL  59 -43.026   8.388 -20.341
  458    HA   VAL  59           HA       VAL  59 -42.857   9.123 -17.458
  459    HB   VAL  59           HB       VAL  59 -41.321   7.418 -17.134
  460   HG11  VAL  59          1HG1      VAL  59 -43.657   6.675 -17.569
  461   HG12  VAL  59          2HG1      VAL  59 -43.205   6.320 -19.251
  462   HG13  VAL  59          3HG1      VAL  59 -42.455   5.427 -17.929
  463   HG21  VAL  59          3HG2      VAL  59 -40.730   7.539 -20.069
  464   HG22  VAL  59          1HG2      VAL  59 -39.637   7.472 -18.691
  465   HG23  VAL  59          2HG2      VAL  59 -40.510   6.022 -19.224
  466    H    MET  60           H        MET  60 -41.484  10.151 -20.394
  467    HA   MET  60           HA       MET  60 -38.888  10.929 -19.760
  468    HB2  MET  60           2HB      MET  60 -40.997  12.354 -21.443
  469    HB3  MET  60           3HB      MET  60 -39.307  12.854 -21.364
  470    HG2  MET  60           2HG      MET  60 -40.342  10.209 -22.408
  471    HG3  MET  60           3HG      MET  60 -39.752  11.559 -23.351
  472    HE1  MET  60           3HE      MET  60 -38.963   8.181 -22.137
  473    HE2  MET  60           1HE      MET  60 -37.286   8.186 -21.554
  474    HE3  MET  60           2HE      MET  60 -38.570   8.898 -20.560
  475    H    GLN  61           H        GLN  61 -38.184  11.880 -18.095
  476    HA   GLN  61           HA       GLN  61 -37.628  13.460 -16.657
  477    HB2  GLN  61           2HB      GLN  61 -39.518  15.341 -18.070
  478    HB3  GLN  61           3HB      GLN  61 -38.124  15.778 -17.095
  479    HG2  GLN  61           2HG      GLN  61 -36.594  15.270 -18.768
  480    HG3  GLN  61           3HG      GLN  61 -37.552  13.978 -19.453
  481   HE21  GLN  61          1HE2      GLN  61 -37.625  14.524 -21.587
  482   HE22  GLN  61          2HE2      GLN  61 -38.454  15.958 -22.155
  483    H    ARG  62           H        ARG  62 -40.120  11.689 -16.075
  484    HA   ARG  62           HA       ARG  62 -41.397  13.225 -13.905
  485    HB2  ARG  62           2HB      ARG  62 -41.349  10.327 -14.852
  486    HB3  ARG  62           3HB      ARG  62 -41.842  10.667 -13.207
  487    HG2  ARG  62           2HG      ARG  62 -43.784  10.495 -14.464
  488    HG3  ARG  62           3HG      ARG  62 -43.610  12.193 -14.008
  489    HD2  ARG  62           2HD      ARG  62 -42.811  11.129 -16.729
  490    HD3  ARG  62           3HD      ARG  62 -44.471  11.601 -16.334
  491    HE   ARG  62           HE       ARG  62 -42.421  13.621 -15.791
  492   HH11  ARG  62          1HH1      ARG  62 -44.496  12.402 -18.304
  493   HH12  ARG  62          2HH1      ARG  62 -44.692  13.971 -19.056
  494   HH21  ARG  62          1HH2      ARG  62 -42.695  15.616 -16.782
  495   HH22  ARG  62          2HH2      ARG  62 -43.644  15.731 -18.231
  496    HA   PRO  63           HA       PRO  63 -38.242  12.595 -10.825
  497    HB2  PRO  63           2HB      PRO  63 -39.639  12.363  -8.495
  498    HB3  PRO  63           3HB      PRO  63 -39.493  13.906  -9.394
  499    HG2  PRO  63           2HG      PRO  63 -41.766  11.904  -9.505
  500    HG3  PRO  63           3HG      PRO  63 -41.873  13.677  -9.257
  501    HD2  PRO  63           2HD      PRO  63 -42.238  12.555 -11.703
  502    HD3  PRO  63           3HD      PRO  63 -41.372  14.112 -11.530
  503    H    CYS  64           H        CYS  64 -37.080  10.846 -10.120
  504    HA   CYS  64           HA       CYS  64 -38.009   8.141 -10.490
  505    HB2  CYS  64           2HB      CYS  64 -35.673   9.013 -10.753
  506    HB3  CYS  64           3HB      CYS  64 -35.575   9.201  -8.996
  507    HG   CYS  64           HG       CYS  64 -36.343   6.608  -8.586
  508    H    THR  65           H        THR  65 -38.232  10.304  -7.757
  509    HA   THR  65           HA       THR  65 -38.338   8.591  -5.593
  510    HB   THR  65           HB       THR  65 -40.048  11.084  -5.787
  511    HG1  THR  65           HG1      THR  65 -38.223  12.252  -5.269
  512   HG21  THR  65          1HG2      THR  65 -39.234  11.284  -3.412
  513   HG22  THR  65          2HG2      THR  65 -40.191   9.819  -3.694
  514   HG23  THR  65          3HG2      THR  65 -38.422   9.708  -3.617
  515    H    CYS  66           H        CYS  66 -39.426   6.816  -5.876
  516    HA   CYS  66           HA       CYS  66 -41.727   6.151  -7.031
  517    HB2  CYS  66           2HB      CYS  66 -40.779   5.019  -4.365
  518    HB3  CYS  66           3HB      CYS  66 -41.858   4.199  -5.505
  519    HG   CYS  66           HG       CYS  66 -40.182   4.206  -7.542
  520    H    ASP  67           H        ASP  67 -41.858   8.063  -4.156
  521    HA   ASP  67           HA       ASP  67 -44.523   7.495  -3.255
  522    HB2  ASP  67           2HB      ASP  67 -42.806   8.974  -2.088
  523    HB3  ASP  67           3HB      ASP  67 -43.121  10.199  -3.307
  524    H    PHE  68           H        PHE  68 -43.297   9.479  -5.935
  525    HA   PHE  68           HA       PHE  68 -45.676  10.778  -6.778
  526    HB2  PHE  68           2HB      PHE  68 -43.330  11.246  -7.488
  527    HB3  PHE  68           3HB      PHE  68 -43.303   9.733  -8.380
  528    HD1  PHE  68           HD2      PHE  68 -44.730  13.158  -8.250
  529    HD2  PHE  68           HD1      PHE  68 -44.377   9.529 -10.553
  530    HE1  PHE  68           HE2      PHE  68 -45.602  14.343 -10.255
  531    HE2  PHE  68           HE1      PHE  68 -45.285  10.706 -12.543
  532    HZ   PHE  68           HZ       PHE  68 -45.882  13.118 -12.402
  533    H    LEU  69           H        LEU  69 -44.782   7.410  -7.027
  534    HA   LEU  69           HA       LEU  69 -47.192   6.854  -8.667
  535    HB2  LEU  69           2HB      LEU  69 -46.049   4.990  -9.750
  536    HB3  LEU  69           3HB      LEU  69 -45.384   6.564 -10.120
  537    HG   LEU  69           HG       LEU  69 -43.498   6.102  -8.486
  538   HD11  LEU  69          1HD1      LEU  69 -44.436   4.236  -7.169
  539   HD12  LEU  69          2HD1      LEU  69 -44.599   3.260  -8.636
  540   HD13  LEU  69          3HD1      LEU  69 -42.992   3.704  -8.024
  541   HD21  LEU  69          3HD2      LEU  69 -42.291   4.677 -10.084
  542   HD22  LEU  69          1HD2      LEU  69 -43.829   4.226 -10.858
  543   HD23  LEU  69          2HD2      LEU  69 -43.250   5.905 -10.918
  544    H    HIS  70           H        HIS  70 -46.742   6.966  -5.662
  545    HA   HIS  70           HA       HIS  70 -47.113   4.269  -4.741
  546    HB2  HIS  70           2HB      HIS  70 -47.502   5.120  -2.672
  547    HB3  HIS  70           3HB      HIS  70 -46.569   6.420  -3.367
  548    HD2  HIS  70           HD2      HIS  70 -48.580   8.342  -4.660
  549    HE1  HIS  70           HE1      HIS  70 -51.108   7.936  -1.252
  550    HE2  HIS  70           HE2      HIS  70 -50.591   9.359  -3.302
  551    H    GLY  71           H        GLY  71 -48.953   3.110  -4.175
  552    HA2  GLY  71           HA2      GLY  71 -51.600   4.016  -5.234
  553    HA3  GLY  71           HA3      GLY  71 -50.936   2.446  -5.689
  554    HA   PRO  72           HA       PRO  72 -53.725   2.334  -1.923
  555    HB2  PRO  72           2HB      PRO  72 -54.762  -0.082  -3.414
  556    HB3  PRO  72           3HB      PRO  72 -55.674   1.128  -2.457
  557    HG2  PRO  72           2HG      PRO  72 -55.663   1.289  -5.150
  558    HG3  PRO  72           3HG      PRO  72 -55.415   2.781  -4.180
  559    HD2  PRO  72           2HD      PRO  72 -53.323   1.040  -5.518
  560    HD3  PRO  72           3HD      PRO  72 -53.494   2.819  -5.539
  561    H    ARG  73           H        ARG  73 -51.439   0.083  -3.121
  562    HA   ARG  73           HA       ARG  73 -51.457  -1.535  -0.603
  563    HB2  ARG  73           2HB      ARG  73 -51.768  -2.609  -2.892
  564    HB3  ARG  73           3HB      ARG  73 -50.080  -2.206  -3.229
  565    HG2  ARG  73           2HG      ARG  73 -49.350  -3.646  -1.363
  566    HG3  ARG  73           3HG      ARG  73 -51.041  -3.912  -0.880
  567    HD2  ARG  73           2HD      ARG  73 -51.480  -4.964  -3.093
  568    HD3  ARG  73           3HD      ARG  73 -49.771  -4.734  -3.516
  569    HE   ARG  73           HE       ARG  73 -49.747  -6.133  -1.102
  570   HH11  ARG  73          1HH2      ARG  73 -51.048  -6.847  -4.311
  571   HH12  ARG  73          2HH2      ARG  73 -50.998  -8.562  -4.014
  572   HH21  ARG  73          1HH1      ARG  73 -49.681  -8.334  -0.853
  573   HH22  ARG  73          2HH1      ARG  73 -50.217  -9.374  -2.138
  574    H    THR  74           H        THR  74 -49.795   1.101  -1.942
  575    HA   THR  74           HA       THR  74 -47.107   0.305  -1.106
  576    HB   THR  74           HB       THR  74 -47.939   3.110  -1.847
  577    HG1  THR  74           HG1      THR  74 -46.974   1.421  -3.823
  578   HG21  THR  74          1HG2      THR  74 -45.620   2.909  -1.131
  579   HG22  THR  74          2HG2      THR  74 -45.374   1.483  -2.156
  580   HG23  THR  74          3HG2      THR  74 -45.627   3.085  -2.888
  581    H    GLN  75           H        GLN  75 -45.922   0.974   0.620
  582    HA   GLN  75           HA       GLN  75 -47.354   2.349   2.819
  583    HB2  GLN  75           2HB      GLN  75 -44.601   1.085   2.797
  584    HB3  GLN  75           3HB      GLN  75 -45.432   1.805   4.177
  585    HG2  GLN  75           2HG      GLN  75 -47.264   0.107   3.927
  586    HG3  GLN  75           3HG      GLN  75 -46.316  -0.681   2.662
  587   HE21  GLN  75          2HE2      GLN  75 -46.777  -2.447   4.492
  588   HE22  GLN  75          1HE2      GLN  75 -45.469  -2.604   5.655
  589    H    ARG  76           H        ARG  76 -46.914   4.323   3.539
  590    HA   ARG  76           HA       ARG  76 -45.402   6.144   1.821
  591    HB2  ARG  76           2HB      ARG  76 -46.617   6.785   4.496
  592    HB3  ARG  76           3HB      ARG  76 -46.114   7.925   3.247
  593    HG2  ARG  76           2HG      ARG  76 -48.455   5.984   3.153
  594    HG3  ARG  76           3HG      ARG  76 -48.527   7.738   3.179
  595    HD2  ARG  76           2HD      ARG  76 -47.379   6.051   0.897
  596    HD3  ARG  76           3HD      ARG  76 -49.005   6.702   0.934
  597    HE   ARG  76           HE       ARG  76 -46.593   8.126   0.180
  598   HH11  ARG  76          1HH1      ARG  76 -49.780   8.739   1.543
  599   HH12  ARG  76          2HH1      ARG  76 -49.802  10.362   0.905
  600   HH21  ARG  76          1HH2      ARG  76 -46.708  10.068  -0.600
  601   HH22  ARG  76          2HH2      ARG  76 -48.084  11.121  -0.292
  602    H    ARG  77           H        ARG  77 -44.786   4.715   5.023
  603    HA   ARG  77           HA       ARG  77 -42.238   5.870   5.486
  604    HB2  ARG  77           2HB      ARG  77 -41.723   3.955   6.817
  605    HB3  ARG  77           3HB      ARG  77 -43.371   4.545   7.114
  606    HG2  ARG  77           2HG      ARG  77 -44.311   2.706   5.842
  607    HG3  ARG  77           3HG      ARG  77 -42.702   2.072   5.451
  608    HD2  ARG  77           2HD      ARG  77 -43.666   2.473   8.310
  609    HD3  ARG  77           3HD      ARG  77 -44.025   1.022   7.393
  610    HE   ARG  77           HE       ARG  77 -41.446   1.792   8.533
  611   HH11  ARG  77          1HH1      ARG  77 -42.926  -0.377   6.167
  612   HH12  ARG  77          2HH1      ARG  77 -41.555  -1.454   6.218
  613   HH21  ARG  77          1HH2      ARG  77 -39.769   0.360   8.516
  614   HH22  ARG  77          2HH2      ARG  77 -39.832  -1.050   7.501
  615    H    ALA  78           H        ALA  78 -43.041   3.192   3.327
  616    HA   ALA  78           HA       ALA  78 -40.330   2.498   2.570
  617    HB1  ALA  78           3HB      ALA  78 -42.166   0.926   2.206
  618    HB2  ALA  78           1HB      ALA  78 -42.988   2.053   1.099
  619    HB3  ALA  78           2HB      ALA  78 -41.461   1.385   0.659
  620    H    ALA  79           H        ALA  79 -42.894   4.495   1.032
  621    HA   ALA  79           HA       ALA  79 -41.279   5.393  -1.156
  622    HB1  ALA  79           3HB      ALA  79 -43.717   6.726   0.093
  623    HB2  ALA  79           1HB      ALA  79 -43.136   6.854  -1.576
  624    HB3  ALA  79           2HB      ALA  79 -43.795   5.319  -1.006
  625    H    ALA  80           H        ALA  80 -41.802   6.770   2.069
  626    HA   ALA  80           HA       ALA  80 -40.466   9.248   1.650
  627    HB1  ALA  80           3HB      ALA  80 -40.552   9.387   4.121
  628    HB2  ALA  80           1HB      ALA  80 -42.109   8.894   3.425
  629    HB3  ALA  80           2HB      ALA  80 -41.057   7.683   4.193
  630    H    GLN  81           H        GLN  81 -39.285   6.203   3.284
  631    HA   GLN  81           HA       GLN  81 -36.598   6.930   3.593
  632    HB2  GLN  81           2HB      GLN  81 -37.747   4.865   4.423
  633    HB3  GLN  81           3HB      GLN  81 -37.581   4.171   2.804
  634    HG2  GLN  81           2HG      GLN  81 -35.121   4.340   2.965
  635    HG3  GLN  81           3HG      GLN  81 -35.254   5.209   4.495
  636   HE21  GLN  81          2HE2      GLN  81 -36.448   3.937   6.329
  637   HE22  GLN  81          1HE2      GLN  81 -36.062   2.222   6.389
  638    H    ILE  82           H        ILE  82 -38.189   5.702   0.584
  639    HA   ILE  82           HA       ILE  82 -35.784   5.799  -1.008
  640    HB   ILE  82           HB       ILE  82 -38.733   5.934  -1.653
  641   HG12  ILE  82          2HG1      ILE  82 -36.584   3.882  -2.352
  642   HG13  ILE  82          3HG1      ILE  82 -37.521   3.838  -0.853
  643   HG21  ILE  82          1HG2      ILE  82 -36.403   6.164  -3.595
  644   HG22  ILE  82          2HG2      ILE  82 -38.070   5.760  -4.080
  645   HG23  ILE  82          3HG2      ILE  82 -37.722   7.328  -3.345
  646   HD11  ILE  82          3HD1      ILE  82 -38.574   2.381  -2.351
  647   HD12  ILE  82          1HD1      ILE  82 -39.623   3.807  -2.170
  648   HD13  ILE  82          2HD1      ILE  82 -38.640   3.592  -3.646
  649    H    ALA  83           H        ALA  83 -38.370   8.278  -0.522
  650    HA   ALA  83           HA       ALA  83 -37.192  10.335  -2.007
  651    HB1  ALA  83           3HB      ALA  83 -39.468  10.322  -0.927
  652    HB2  ALA  83           1HB      ALA  83 -38.672  10.697   0.618
  653    HB3  ALA  83           2HB      ALA  83 -38.549  11.837  -0.724
  654    H    GLN  84           H        GLN  84 -36.314   9.288   1.269
  655    HA   GLN  84           HA       GLN  84 -34.439  11.484   1.745
  656    HB2  GLN  84           2HB      GLN  84 -34.325   8.766   3.089
  657    HB3  GLN  84           3HB      GLN  84 -33.663  10.295   3.632
  658    HG2  GLN  84           2HG      GLN  84 -36.484   9.324   3.714
  659    HG3  GLN  84           3HG      GLN  84 -35.518   9.921   5.006
  660   HE21  GLN  84          1HE2      GLN  84 -37.918  10.709   2.726
  661   HE22  GLN  84          2HE2      GLN  84 -37.952  12.455   3.020
  662    H    ALA  85           H        ALA  85 -34.205   8.187   0.314
  663    HA   ALA  85           HA       ALA  85 -31.311   8.191   0.185
  664    HB1  ALA  85           3HB      ALA  85 -31.629   6.208  -1.220
  665    HB2  ALA  85           1HB      ALA  85 -32.676   6.120   0.210
  666    HB3  ALA  85           2HB      ALA  85 -33.360   6.553  -1.373
  667    H    LEU  86           H        LEU  86 -33.895   9.323  -1.951
  668    HA   LEU  86           HA       LEU  86 -32.033  10.010  -4.094
  669    HB2  LEU  86           2HB      LEU  86 -34.911  10.899  -3.824
  670    HB3  LEU  86           3HB      LEU  86 -33.899  10.886  -5.254
  671    HG   LEU  86           HG       LEU  86 -35.410   8.658  -3.938
  672   HD11  LEU  86          1HD1      LEU  86 -34.686   9.226  -6.844
  673   HD12  LEU  86          2HD1      LEU  86 -35.939   8.115  -6.245
  674   HD13  LEU  86          3HD1      LEU  86 -36.110   9.866  -6.016
  675   HD21  LEU  86          3HD2      LEU  86 -32.868   8.154  -5.586
  676   HD22  LEU  86          1HD2      LEU  86 -33.192   7.563  -3.942
  677   HD23  LEU  86          2HD2      LEU  86 -34.128   6.938  -5.287
  678    H    LEU  87           H        LEU  87 -33.607  11.774  -1.419
  679    HA   LEU  87           HA       LEU  87 -32.636  14.385  -1.917
  680    HB2  LEU  87           2HB      LEU  87 -34.358  14.170  -0.417
  681    HB3  LEU  87           3HB      LEU  87 -33.722  12.710   0.298
  682    HG   LEU  87           HG       LEU  87 -32.273  15.141   0.922
  683   HD11  LEU  87          1HD1      LEU  87 -33.855  15.598   2.804
  684   HD12  LEU  87          2HD1      LEU  87 -34.617  15.800   1.217
  685   HD13  LEU  87          3HD1      LEU  87 -34.918  14.322   2.155
  686   HD21  LEU  87          3HD2      LEU  87 -31.932  14.157   3.094
  687   HD22  LEU  87          1HD2      LEU  87 -33.004  12.807   2.695
  688   HD23  LEU  87          2HD2      LEU  87 -31.461  13.013   1.842
  689    H    GLY  88           H        GLY  88 -31.111  11.531  -0.434
  690    HA2  GLY  88           HA2      GLY  88 -28.797  11.156  -0.978
  691    HA3  GLY  88           HA3      GLY  88 -28.455  12.873  -0.811
  692    H    ALA  89           H        ALA  89 -30.404  11.156   1.662
  693    HA   ALA  89           HA       ALA  89 -28.577  11.964   3.742
  694    HB1  ALA  89           3HB      ALA  89 -30.935  10.021   3.739
  695    HB2  ALA  89           1HB      ALA  89 -30.099  10.627   5.185
  696    HB3  ALA  89           2HB      ALA  89 -30.981  11.753   4.139
  697    H    GLU  90           H        GLU  90 -29.426   8.822   2.303
  698    HA   GLU  90           HA       GLU  90 -26.686   7.797   2.430
  699    HB2  GLU  90           2HB      GLU  90 -28.982   6.169   3.619
  700    HB3  GLU  90           3HB      GLU  90 -27.284   5.704   3.490
  701    HG2  GLU  90           2HG      GLU  90 -26.719   7.549   5.105
  702    HG3  GLU  90           3HG      GLU  90 -28.450   7.891   5.267
  703    H    GLU  91           H        GLU  91 -26.386   6.283   0.659
  704    HA   GLU  91           HA       GLU  91 -28.711   5.936  -1.174
  705    HB2  GLU  91           2HB      GLU  91 -25.799   5.103  -1.393
  706    HB3  GLU  91           3HB      GLU  91 -27.074   4.467  -2.439
  707    HG2  GLU  91           2HG      GLU  91 -26.345   6.272  -3.680
  708    HG3  GLU  91           3HG      GLU  91 -27.786   6.885  -2.881
  709    H    ARG  92           H        ARG  92 -30.144   4.531  -0.811
  710    HA   ARG  92           HA       ARG  92 -29.554   2.004   0.672
  711    HB2  ARG  92           2HB      ARG  92 -30.217   3.692   2.318
  712    HB3  ARG  92           3HB      ARG  92 -31.614   4.144   1.344
  713    HG2  ARG  92           2HG      ARG  92 -32.421   2.830   3.158
  714    HG3  ARG  92           3HG      ARG  92 -32.572   1.871   1.691
  715    HD2  ARG  92           2HD      ARG  92 -30.349   0.753   2.366
  716    HD3  ARG  92           3HD      ARG  92 -30.553   1.541   3.929
  717    HE   ARG  92           HE       ARG  92 -32.505  -0.371   2.649
  718   HH11  ARG  92          1HH2      ARG  92 -31.168   0.872   5.655
  719   HH12  ARG  92          2HH2      ARG  92 -32.128  -0.215   6.619
  720   HH21  ARG  92          2HH1      ARG  92 -33.654  -1.711   3.923
  721   HH22  ARG  92          1HH1      ARG  92 -33.504  -1.644   5.657
  722    H    LYS  93           H        LYS  93 -30.639   0.308   0.120
  723    HA   LYS  93           HA       LYS  93 -32.633   0.300  -2.072
  724    HB2  LYS  93           2HB      LYS  93 -30.706  -1.223  -2.113
  725    HB3  LYS  93           3HB      LYS  93 -31.291  -1.975  -0.608
  726    HG2  LYS  93           2HG      LYS  93 -33.473  -2.410  -1.998
  727    HG3  LYS  93           3HG      LYS  93 -32.461  -2.020  -3.391
  728    HD2  LYS  93           2HD      LYS  93 -31.837  -4.171  -1.331
  729    HD3  LYS  93           3HD      LYS  93 -32.576  -4.465  -2.908
  730    HE2  LYS  93           2HE      LYS  93 -30.573  -3.389  -3.992
  731    HE3  LYS  93           3HE      LYS  93 -29.807  -3.280  -2.399
  732    HZ1  LYS  93           HZ1      LYS  93 -29.086  -5.273  -3.564
  733    HZ2  LYS  93           HZ2      LYS  93 -29.979  -5.743  -2.271
  734    HZ3  LYS  93           HZ3      LYS  93 -30.624  -5.769  -3.790
  735    H    VAL  94           H        VAL  94 -34.721   0.091  -1.742
  736    HA   VAL  94           HA       VAL  94 -35.822  -0.710   0.922
  737    HB   VAL  94           HB       VAL  94 -36.991   1.602  -0.639
  738   HG11  VAL  94          1HG1      VAL  94 -38.348   0.586   1.185
  739   HG12  VAL  94          2HG1      VAL  94 -37.039   0.918   2.335
  740   HG13  VAL  94          3HG1      VAL  94 -37.914   2.247   1.543
  741   HG21  VAL  94          3HG2      VAL  94 -34.729   2.417  -0.193
  742   HG22  VAL  94          1HG2      VAL  94 -35.870   3.218   0.881
  743   HG23  VAL  94          2HG2      VAL  94 -34.863   1.895   1.507
  744    H    GLU  95           H        GLU  95 -37.854  -1.607   0.868
  745    HA   GLU  95           HA       GLU  95 -38.729  -2.768  -1.705
  746    HB2  GLU  95           2HB      GLU  95 -40.252  -4.057  -0.345
  747    HB3  GLU  95           3HB      GLU  95 -38.608  -4.151   0.325
  748    HG2  GLU  95           2HG      GLU  95 -39.229  -2.448   2.048
  749    HG3  GLU  95           3HG      GLU  95 -40.872  -2.399   1.415
  750    H    ILE  96           H        ILE  96 -40.928  -2.392  -2.487
  751    HA   ILE  96           HA       ILE  96 -42.606  -0.418  -1.324
  752    HB   ILE  96           HB       ILE  96 -42.458   0.904  -3.744
  753   HG12  ILE  96          2HG1      ILE  96 -40.185   1.672  -4.163
  754   HG13  ILE  96          3HG1      ILE  96 -39.542   0.523  -2.979
  755   HG21  ILE  96          1HG2      ILE  96 -40.916   1.891  -1.373
  756   HG22  ILE  96          2HG2      ILE  96 -41.747   2.817  -2.631
  757   HG23  ILE  96          3HG2      ILE  96 -42.700   1.884  -1.473
  758   HD11  ILE  96          3HD1      ILE  96 -40.321  -1.340  -4.373
  759   HD12  ILE  96          1HD1      ILE  96 -40.980  -0.184  -5.548
  760   HD13  ILE  96          2HD1      ILE  96 -39.219  -0.288  -5.255
  761    H    ALA  97           H        ALA  97 -44.630  -0.294  -2.301
  762    HA   ALA  97           HA       ALA  97 -45.152  -2.529  -4.160
  763    HB1  ALA  97           3HB      ALA  97 -46.616  -2.100  -2.098
  764    HB2  ALA  97           1HB      ALA  97 -47.286  -0.739  -3.026
  765    HB3  ALA  97           2HB      ALA  97 -47.436  -2.375  -3.644
  766    H    PHE  98           H        PHE  98 -45.955  -2.348  -6.188
  767    HA   PHE  98           HA       PHE  98 -46.163   0.365  -7.448
  768    HB2  PHE  98           2HB      PHE  98 -45.310  -2.316  -8.552
  769    HB3  PHE  98           3HB      PHE  98 -45.970  -1.081  -9.605
  770    HD1  PHE  98           HD2      PHE  98 -43.064  -2.004  -7.500
  771    HD2  PHE  98           HD1      PHE  98 -44.785   0.960 -10.123
  772    HE1  PHE  98           HE2      PHE  98 -40.852  -0.894  -7.721
  773    HE2  PHE  98           HE1      PHE  98 -42.573   2.068 -10.323
  774    HZ   PHE  98           HZ       PHE  98 -40.622   1.172  -9.084
  775    H    TYR  99           H        TYR  99 -47.843   0.713  -8.904
  776    HA   TYR  99           HA       TYR  99 -50.012  -1.295  -8.970
  777    HB2  TYR  99           2HB      TYR  99 -51.734   0.203  -8.827
  778    HB3  TYR  99           3HB      TYR  99 -50.669   0.662  -7.514
  779    HD1  TYR  99           HD2      TYR  99 -49.359   2.818  -7.678
  780    HD2  TYR  99           HD1      TYR  99 -52.222   1.641 -10.688
  781    HE1  TYR  99           HE2      TYR  99 -49.450   5.158  -8.512
  782    HE2  TYR  99           HE1      TYR  99 -52.290   3.984 -11.533
  783    HH   TYR  99           HH       TYR  99 -50.357   6.607 -10.036
  784    H    ARG 100           H        ARG 100 -50.789  -1.746 -10.898
  785    HA   ARG 100           HA       ARG 100 -49.477  -0.560 -13.287
  786    HB2  ARG 100           2HB      ARG 100 -49.183  -2.949 -12.759
  787    HB3  ARG 100           3HB      ARG 100 -50.911  -3.218 -12.921
  788    HG2  ARG 100           2HG      ARG 100 -50.810  -2.672 -15.312
  789    HG3  ARG 100           3HG      ARG 100 -49.120  -2.165 -15.166
  790    HD2  ARG 100           2HD      ARG 100 -50.123  -4.976 -14.619
  791    HD3  ARG 100           3HD      ARG 100 -49.395  -4.440 -16.147
  792    HE   ARG 100           HE       ARG 100 -47.484  -3.698 -14.332
  793   HH11  ARG 100          1HH1      ARG 100 -48.948  -6.827 -14.959
  794   HH12  ARG 100          2HH1      ARG 100 -47.583  -7.679 -14.290
  795   HH21  ARG 100          1HH2      ARG 100 -45.893  -4.787 -13.464
  796   HH22  ARG 100          2HH2      ARG 100 -45.857  -6.538 -13.455
  797    H    LYS 101           H        LYS 101 -50.703   0.012 -15.122
  798    HA   LYS 101           HA       LYS 101 -52.923   1.586 -14.469
  799    HB2  LYS 101           2HB      LYS 101 -53.041   2.270 -16.737
  800    HB3  LYS 101           3HB      LYS 101 -51.370   2.063 -16.242
  801    HG2  LYS 101           2HG      LYS 101 -51.367   1.243 -18.349
  802    HG3  LYS 101           3HG      LYS 101 -51.437  -0.234 -17.378
  803    HD2  LYS 101           2HD      LYS 101 -53.991  -0.190 -17.844
  804    HD3  LYS 101           3HD      LYS 101 -53.663   1.098 -19.001
  805    HE2  LYS 101           2HE      LYS 101 -52.379  -1.660 -18.963
  806    HE3  LYS 101           3HE      LYS 101 -53.802  -1.259 -19.940
  807    HZ1  LYS 101           HZ1      LYS 101 -51.807  -1.089 -21.283
  808    HZ2  LYS 101           HZ2      LYS 101 -52.435   0.407 -21.111
  809    HZ3  LYS 101           HZ3      LYS 101 -51.105  -0.034 -20.255
  810    H    ASP 102           H        ASP 102 -53.183  -1.731 -15.084
  811    HA   ASP 102           HA       ASP 102 -56.012  -1.721 -15.864
  812    HB2  ASP 102           2HB      ASP 102 -55.828  -4.070 -15.855
  813    HB3  ASP 102           3HB      ASP 102 -54.307  -3.491 -16.530
  814    H    GLY 103           H        GLY 103 -54.327  -1.241 -12.944
  815    HA2  GLY 103           HA2      GLY 103 -55.391  -0.700 -10.885
  816    HA3  GLY 103           HA3      GLY 103 -56.711  -1.809 -11.248
  817    H    SER 104           H        SER 104 -53.767  -3.402 -12.019
  818    HA   SER 104           HA       SER 104 -53.988  -5.097  -9.634
  819    HB2  SER 104           2HB      SER 104 -52.031  -5.112 -11.959
  820    HB3  SER 104           3HB      SER 104 -51.980  -6.243 -10.599
  821    HG   SER 104           HG       SER 104 -53.894  -6.007 -12.650
  822    H    CYS 105           H        CYS 105 -52.899  -4.928  -7.757
  823    HA   CYS 105           HA       CYS 105 -50.603  -3.015  -7.552
  824    HB2  CYS 105           2HB      CYS 105 -52.830  -3.500  -5.533
  825    HB3  CYS 105           3HB      CYS 105 -51.459  -2.393  -5.345
  826    HG   CYS 105           HG       CYS 105 -53.847  -2.324  -7.658
  827    H    PHE 106           H        PHE 106 -48.768  -3.775  -6.625
  828    HA   PHE 106           HA       PHE 106 -48.796  -6.267  -4.989
  829    HB2  PHE 106           2HB      PHE 106 -47.086  -7.250  -6.554
  830    HB3  PHE 106           3HB      PHE 106 -48.730  -7.182  -7.156
  831    HD1  PHE 106           HD2      PHE 106 -49.381  -5.685  -8.997
  832    HD2  PHE 106           HD1      PHE 106 -45.307  -5.840  -7.587
  833    HE1  PHE 106           HE2      PHE 106 -48.648  -4.399 -10.983
  834    HE2  PHE 106           HE1      PHE 106 -44.576  -4.572  -9.589
  835    HZ   PHE 106           HZ       PHE 106 -46.245  -3.815 -11.271
  836    H    LEU 107           H        LEU 107 -47.175  -6.480  -3.571
  837    HA   LEU 107           HA       LEU 107 -44.900  -4.555  -3.552
  838    HB2  LEU 107           2HB      LEU 107 -46.522  -4.414  -1.649
  839    HB3  LEU 107           3HB      LEU 107 -46.234  -6.097  -1.286
  840    HG   LEU 107           HG       LEU 107 -45.169  -4.614   0.287
  841   HD11  LEU 107          1HD1      LEU 107 -43.944  -6.812  -0.414
  842   HD12  LEU 107          2HD1      LEU 107 -42.789  -5.705  -1.199
  843   HD13  LEU 107          3HD1      LEU 107 -43.064  -5.577   0.522
  844   HD21  LEU 107          3HD2      LEU 107 -43.446  -3.587  -1.933
  845   HD22  LEU 107          1HD2      LEU 107 -44.708  -2.683  -1.028
  846   HD23  LEU 107          2HD2      LEU 107 -43.247  -3.232  -0.205
  847    H    CYS 108           H        CYS 108 -42.919  -5.357  -3.672
  848    HA   CYS 108           HA       CYS 108 -42.304  -8.154  -2.965
  849    HB2  CYS 108           2HB      CYS 108 -42.010  -6.917  -5.703
  850    HB3  CYS 108           3HB      CYS 108 -40.739  -8.003  -5.127
  851    HG   CYS 108           HG       CYS 108 -43.959  -8.692  -4.882
  852    H    LEU 109           H        LEU 109 -39.817  -8.406  -2.954
  853    HA   LEU 109           HA       LEU 109 -38.663  -6.175  -1.433
  854    HB2  LEU 109           2HB      LEU 109 -38.443  -8.521  -0.709
  855    HB3  LEU 109           3HB      LEU 109 -37.560  -8.910  -2.180
  856    HG   LEU 109           HG       LEU 109 -35.668  -7.511  -1.475
  857   HD11  LEU 109          1HD1      LEU 109 -35.633  -6.486   0.797
  858   HD12  LEU 109          2HD1      LEU 109 -36.764  -5.687  -0.292
  859   HD13  LEU 109          3HD1      LEU 109 -37.374  -6.810   0.950
  860   HD21  LEU 109          3HD2      LEU 109 -34.969  -8.780   0.486
  861   HD22  LEU 109          1HD2      LEU 109 -36.649  -9.274   0.800
  862   HD23  LEU 109          2HD2      LEU 109 -35.809  -9.835  -0.663
  863    H    VAL 110           H        VAL 110 -39.141  -4.942  -3.526
  864    HA   VAL 110           HA       VAL 110 -37.742  -5.312  -5.899
  865    HB   VAL 110           HB       VAL 110 -38.711  -2.704  -4.730
  866   HG11  VAL 110          1HG1      VAL 110 -38.166  -3.398  -7.646
  867   HG12  VAL 110          2HG1      VAL 110 -38.909  -1.902  -7.066
  868   HG13  VAL 110          3HG1      VAL 110 -37.234  -2.245  -6.666
  869   HG21  VAL 110          3HG2      VAL 110 -40.557  -4.333  -4.942
  870   HG22  VAL 110          1HG2      VAL 110 -40.727  -3.102  -6.182
  871   HG23  VAL 110          2HG2      VAL 110 -40.072  -4.694  -6.613
  872    H    ASP 111           H        ASP 111 -35.813  -4.333  -6.826
  873    HA   ASP 111           HA       ASP 111 -33.788  -3.953  -4.669
  874    HB2  ASP 111           2HB      ASP 111 -33.824  -5.824  -6.466
  875    HB3  ASP 111           3HB      ASP 111 -33.120  -4.607  -7.531
  876    H    VAL 112           H        VAL 112 -34.682  -1.714  -4.467
  877    HA   VAL 112           HA       VAL 112 -34.178   0.180  -6.598
  878    HB   VAL 112           HB       VAL 112 -34.990   0.759  -3.717
  879   HG11  VAL 112          1HG1      VAL 112 -36.154   2.689  -4.704
  880   HG12  VAL 112          2HG1      VAL 112 -34.442   2.776  -5.120
  881   HG13  VAL 112          3HG1      VAL 112 -35.624   2.207  -6.325
  882   HG21  VAL 112          3HG2      VAL 112 -36.739   0.029  -6.094
  883   HG22  VAL 112          1HG2      VAL 112 -36.524  -0.933  -4.620
  884   HG23  VAL 112          2HG2      VAL 112 -37.308   0.641  -4.520
  885    H    VAL 113           H        VAL 113 -31.825  -0.434  -6.697
  886    HA   VAL 113           HA       VAL 113 -30.213   1.153  -4.738
  887    HB   VAL 113           HB       VAL 113 -29.889  -1.249  -4.610
  888   HG11  VAL 113          1HG1      VAL 113 -30.096  -1.857  -7.022
  889   HG12  VAL 113          2HG1      VAL 113 -28.514  -1.104  -7.321
  890   HG13  VAL 113          3HG1      VAL 113 -28.646  -2.506  -6.247
  891   HG21  VAL 113          3HG2      VAL 113 -28.144   0.304  -3.875
  892   HG22  VAL 113          1HG2      VAL 113 -27.454  -1.195  -4.511
  893   HG23  VAL 113          2HG2      VAL 113 -27.416   0.278  -5.501
  894    HA   PRO 114           HA       PRO 114 -29.294   3.583  -8.410
  895    HB2  PRO 114           2HB      PRO 114 -27.877   5.589  -7.403
  896    HB3  PRO 114           3HB      PRO 114 -29.560   5.322  -6.922
  897    HG2  PRO 114           2HG      PRO 114 -27.055   4.446  -5.434
  898    HG3  PRO 114           3HG      PRO 114 -28.480   5.326  -4.784
  899    HD2  PRO 114           2HD      PRO 114 -28.208   2.602  -4.590
  900    HD3  PRO 114           3HD      PRO 114 -29.796   3.401  -4.777
  901    H    VAL 115           H        VAL 115 -26.931   4.901  -9.193
  902    HA   VAL 115           HA       VAL 115 -24.764   2.859  -9.034
  903    HB   VAL 115           HB       VAL 115 -24.167   3.315 -11.379
  904   HG11  VAL 115          1HG1      VAL 115 -26.852   1.969 -10.920
  905   HG12  VAL 115          2HG1      VAL 115 -25.769   1.720 -12.306
  906   HG13  VAL 115          3HG1      VAL 115 -25.253   1.234 -10.683
  907   HG21  VAL 115          3HG2      VAL 115 -25.492   5.354 -11.695
  908   HG22  VAL 115          1HG2      VAL 115 -25.796   4.139 -12.943
  909   HG23  VAL 115          2HG2      VAL 115 -26.985   4.398 -11.638
  910    H    LYS 116           H        LYS 116 -22.868   3.427  -8.668
  911    HA   LYS 116           HA       LYS 116 -22.124   6.282  -8.341
  912    HB2  LYS 116           2HB      LYS 116 -21.191   3.852  -6.767
  913    HB3  LYS 116           3HB      LYS 116 -20.621   5.477  -6.505
  914    HG2  LYS 116           2HG      LYS 116 -22.475   6.124  -5.370
  915    HG3  LYS 116           3HG      LYS 116 -23.575   5.149  -6.323
  916    HD2  LYS 116           2HD      LYS 116 -23.031   3.156  -5.098
  917    HD3  LYS 116           3HD      LYS 116 -21.638   3.911  -4.305
  918    HE2  LYS 116           2HE      LYS 116 -24.442   5.028  -3.978
  919    HE3  LYS 116           3HE      LYS 116 -23.900   3.674  -2.981
  920    HZ1  LYS 116           HZ1      LYS 116 -22.425   5.003  -1.857
  921    HZ2  LYS 116           HZ2      LYS 116 -22.131   6.006  -3.101
  922    HZ3  LYS 116           HZ3      LYS 116 -23.512   6.181  -2.241
  923    H    ASN 117           H        ASN 117 -19.914   6.738  -8.332
  924    HA   ASN 117           HA       ASN 117 -18.375   5.336 -10.493
  925    HB2  ASN 117           2HB      ASN 117 -17.208   7.289 -10.914
  926    HB3  ASN 117           3HB      ASN 117 -18.836   7.854 -10.631
  927   HD21  ASN 117          2HD2      ASN 117 -19.244   8.813  -8.325
  928   HD22  ASN 117          1HD2      ASN 117 -17.839   9.598  -7.618
  929    H    GLU 118           H        GLU 118 -15.826   5.633 -10.029
  930    HA   GLU 118           HA       GLU 118 -15.212   3.720  -8.026
  931    HB2  GLU 118           2HB      GLU 118 -12.903   4.069  -8.647
  932    HB3  GLU 118           3HB      GLU 118 -13.930   4.004 -10.077
  933    HG2  GLU 118           2HG      GLU 118 -13.860   6.501 -10.224
  934    HG3  GLU 118           3HG      GLU 118 -12.808   6.547  -8.808
  935    H    ASP 119           H        ASP 119 -15.373   7.213  -7.673
  936    HA   ASP 119           HA       ASP 119 -13.947   7.354  -5.158
  937    HB2  ASP 119           2HB      ASP 119 -14.511   9.249  -6.802
  938    HB3  ASP 119           3HB      ASP 119 -16.135   9.225  -6.114
  939    H    GLY 120           H        GLY 120 -17.050   6.109  -5.986
  940    HA2  GLY 120           HA2      GLY 120 -18.460   4.901  -4.550
  941    HA3  GLY 120           HA3      GLY 120 -17.856   5.787  -3.148
  942    H    ALA 121           H        ALA 121 -18.501   8.087  -5.500
  943    HA   ALA 121           HA       ALA 121 -21.036   8.801  -4.196
  944    HB1  ALA 121           3HB      ALA 121 -20.685  11.003  -5.202
  945    HB2  ALA 121           1HB      ALA 121 -19.179  10.465  -4.427
  946    HB3  ALA 121           2HB      ALA 121 -19.359  10.376  -6.197
  947    H    VAL 122           H        VAL 122 -22.974   9.072  -5.063
  948    HA   VAL 122           HA       VAL 122 -23.625   7.419  -7.340
  949    HB   VAL 122           HB       VAL 122 -24.943   7.347  -5.370
  950   HG11  VAL 122          1HG1      VAL 122 -26.495   9.025  -4.634
  951   HG12  VAL 122          2HG1      VAL 122 -24.860   9.692  -4.575
  952   HG13  VAL 122          3HG1      VAL 122 -25.972  10.157  -5.883
  953   HG21  VAL 122          3HG2      VAL 122 -25.985   6.786  -7.520
  954   HG22  VAL 122          1HG2      VAL 122 -27.154   7.382  -6.334
  955   HG23  VAL 122          2HG2      VAL 122 -26.614   8.437  -7.653
  956    H    ILE 123           H        ILE 123 -22.948   8.153  -9.238
  957    HA   ILE 123           HA       ILE 123 -23.390  10.960  -9.963
  958    HB   ILE 123           HB       ILE 123 -22.041  10.768 -11.738
  959   HG12  ILE 123          2HG1      ILE 123 -22.829   8.909 -12.994
  960   HG13  ILE 123          3HG1      ILE 123 -21.097   8.806 -12.785
  961   HG21  ILE 123          1HG2      ILE 123 -19.956   9.948 -10.890
  962   HG22  ILE 123          2HG2      ILE 123 -20.901  10.592  -9.535
  963   HG23  ILE 123          3HG2      ILE 123 -20.783   8.839  -9.773
  964   HD11  ILE 123          3HD1      ILE 123 -21.469   7.048 -11.004
  965   HD12  ILE 123          1HD1      ILE 123 -23.196   7.083 -11.437
  966   HD13  ILE 123          2HD1      ILE 123 -22.002   6.602 -12.633
  967    H    MET 124           H        MET 124 -24.871   7.804 -10.562
  968    HA   MET 124           HA       MET 124 -27.032   9.261 -11.983
  969    HB2  MET 124           2HB      MET 124 -25.510   6.892 -13.117
  970    HB3  MET 124           3HB      MET 124 -27.210   7.165 -13.516
  971    HG2  MET 124           2HG      MET 124 -24.861   8.964 -14.042
  972    HG3  MET 124           3HG      MET 124 -25.805   8.087 -15.229
  973    HE1  MET 124           3HE      MET 124 -25.971  12.296 -14.826
  974    HE2  MET 124           1HE      MET 124 -24.835  11.195 -14.007
  975    HE3  MET 124           2HE      MET 124 -25.076  11.067 -15.758
  976    H    PHE 125           H        PHE 125 -28.985   8.362 -11.925
  977    HA   PHE 125           HA       PHE 125 -29.520   6.578  -9.582
  978    HB2  PHE 125           2HB      PHE 125 -30.857   9.033 -10.725
  979    HB3  PHE 125           3HB      PHE 125 -31.842   7.829  -9.950
  980    HD1  PHE 125           HD2      PHE 125 -28.966   7.689  -7.942
  981    HD2  PHE 125           HD1      PHE 125 -32.288  10.249  -8.956
  982    HE1  PHE 125           HE2      PHE 125 -28.738   8.859  -5.775
  983    HE2  PHE 125           HE1      PHE 125 -32.009  11.435  -6.790
  984    HZ   PHE 125           HZ       PHE 125 -30.211  10.759  -5.221
  985    H    ILE 126           H        ILE 126 -29.016   4.752 -10.945
  986    HA   ILE 126           HA       ILE 126 -31.255   4.090 -12.823
  987    HB   ILE 126           HB       ILE 126 -28.658   2.609 -12.497
  988   HG12  ILE 126          2HG1      ILE 126 -29.636   4.639 -14.570
  989   HG13  ILE 126          3HG1      ILE 126 -28.307   4.877 -13.443
  990   HG21  ILE 126          1HG2      ILE 126 -29.381   1.219 -14.250
  991   HG22  ILE 126          2HG2      ILE 126 -30.914   1.445 -13.382
  992   HG23  ILE 126          3HG2      ILE 126 -30.596   2.374 -14.819
  993   HD11  ILE 126          3HD1      ILE 126 -27.142   2.927 -14.466
  994   HD12  ILE 126          1HD1      ILE 126 -28.406   2.902 -15.717
  995   HD13  ILE 126          2HD1      ILE 126 -27.379   4.346 -15.546
  996    H    LEU 127           H        LEU 127 -32.577   4.165 -10.923
  997    HA   LEU 127           HA       LEU 127 -32.339   2.005  -8.975
  998    HB2  LEU 127           2HB      LEU 127 -34.538   4.055  -9.326
  999    HB3  LEU 127           3HB      LEU 127 -34.393   2.896  -8.026
 1000    HG   LEU 127           HG       LEU 127 -33.574   5.035  -7.242
 1001   HD11  LEU 127          1HD1      LEU 127 -31.234   3.374  -7.654
 1002   HD12  LEU 127          2HD1      LEU 127 -31.515   4.596  -6.378
 1003   HD13  LEU 127          3HD1      LEU 127 -32.459   3.094  -6.392
 1004   HD21  LEU 127          3HD2      LEU 127 -31.995   6.385  -8.042
 1005   HD22  LEU 127          1HD2      LEU 127 -31.298   5.136  -9.082
 1006   HD23  LEU 127          2HD2      LEU 127 -32.859   5.901  -9.519
 1007    H    ASN 128           H        ASN 128 -32.199   0.396 -10.220
 1008    HA   ASN 128           HA       ASN 128 -33.980  -0.735 -12.127
 1009    HB2  ASN 128           2HB      ASN 128 -32.041  -1.977 -10.140
 1010    HB3  ASN 128           3HB      ASN 128 -32.992  -2.969 -11.226
 1011   HD21  ASN 128          2HD2      ASN 128 -30.618  -0.185 -11.430
 1012   HD22  ASN 128          1HD2      ASN 128 -29.934  -0.846 -12.899
 1013    H    PHE 129           H        PHE 129 -36.229  -0.844 -11.730
 1014    HA   PHE 129           HA       PHE 129 -37.125  -1.752  -9.101
 1015    HB2  PHE 129           2HB      PHE 129 -38.780  -0.974 -11.501
 1016    HB3  PHE 129           3HB      PHE 129 -39.301  -1.174  -9.818
 1017    HD1  PHE 129           HD2      PHE 129 -37.587   0.400  -8.179
 1018    HD2  PHE 129           HD1      PHE 129 -38.950   1.237 -12.184
 1019    HE1  PHE 129           HE2      PHE 129 -37.330   2.838  -7.767
 1020    HE2  PHE 129           HE1      PHE 129 -38.706   3.666 -11.758
 1021    HZ   PHE 129           HZ       PHE 129 -37.882   4.471  -9.552
 1022    H    GLU 130           H        GLU 130 -35.869  -3.832  -9.661
 1023    HA   GLU 130           HA       GLU 130 -37.474  -5.735 -11.270
 1024    HB2  GLU 130           2HB      GLU 130 -35.957  -7.467 -10.375
 1025    HB3  GLU 130           3HB      GLU 130 -35.175  -6.171 -11.313
 1026    HG2  GLU 130           2HG      GLU 130 -34.112  -5.263  -9.546
 1027    HG3  GLU 130           3HG      GLU 130 -35.248  -5.806  -8.341
 1028    H    VAL 131           H        VAL 131 -38.962  -7.034 -10.587
 1029    HA   VAL 131           HA       VAL 131 -39.997  -6.777  -7.799
 1030    HB   VAL 131           HB       VAL 131 -41.105  -7.778 -10.402
 1031   HG11  VAL 131          1HG1      VAL 131 -42.092  -9.167  -8.588
 1032   HG12  VAL 131          2HG1      VAL 131 -42.620  -7.668  -7.777
 1033   HG13  VAL 131          3HG1      VAL 131 -43.281  -8.112  -9.359
 1034   HG21  VAL 131          3HG2      VAL 131 -41.942  -5.449  -8.619
 1035   HG22  VAL 131          1HG2      VAL 131 -41.018  -5.310 -10.130
 1036   HG23  VAL 131          2HG2      VAL 131 -42.684  -5.903 -10.170
 1037    H    VAL 132           H        VAL 132 -39.344  -8.280  -6.336
 1038    HA   VAL 132           HA       VAL 132 -39.011 -11.073  -7.242
 1039    HB   VAL 132           HB       VAL 132 -36.827 -10.143  -7.586
 1040   HG11  VAL 132          1HG1      VAL 132 -36.773  -9.393  -4.640
 1041   HG12  VAL 132          2HG1      VAL 132 -35.411  -9.311  -5.770
 1042   HG13  VAL 132          3HG1      VAL 132 -36.810  -8.265  -6.016
 1043   HG21  VAL 132          3HG2      VAL 132 -36.769 -11.915  -5.115
 1044   HG22  VAL 132          1HG2      VAL 132 -37.021 -12.480  -6.785
 1045   HG23  VAL 132          2HG2      VAL 132 -35.493 -11.710  -6.329
 1046    H    MET 133           H        MET 133 -39.539 -12.571  -5.847
 1047    HA   MET 133           HA       MET 133 -39.953 -11.934  -2.979
 1048    HB2  MET 133           2HB      MET 133 -41.985 -13.250  -2.933
 1049    HB3  MET 133           3HB      MET 133 -42.155 -11.899  -4.049
 1050    HG2  MET 133           2HG      MET 133 -41.777 -13.386  -5.967
 1051    HG3  MET 133           3HG      MET 133 -41.524 -14.762  -4.891
 1052    HE1  MET 133           3HE      MET 133 -43.801 -14.669  -2.710
 1053    HE2  MET 133           1HE      MET 133 -45.037 -15.622  -3.552
 1054    HE3  MET 133           2HE      MET 133 -43.327 -16.089  -3.674
 1055    H    GLU 134           H        GLU 134 -40.070 -13.908  -1.652
 1056    HA   GLU 134           HA       GLU 134 -37.711 -15.488  -2.086
 1057    HB2  GLU 134           2HB      GLU 134 -38.177 -16.477   0.066
 1058    HB3  GLU 134           3HB      GLU 134 -38.375 -14.727   0.120
 1059    HG2  GLU 134           2HG      GLU 134 -40.866 -15.035  -0.053
 1060    HG3  GLU 134           3HG      GLU 134 -40.626 -16.783  -0.016
 1061    H    LYS 135           H        LYS 135 -37.450 -17.736  -2.102
 1062    HA   LYS 135           HA       LYS 135 -39.335 -19.234  -3.813
 1063    HB2  LYS 135           2HB      LYS 135 -36.503 -19.709  -2.820
 1064    HB3  LYS 135           3HB      LYS 135 -37.434 -20.962  -3.645
 1065    HG2  LYS 135           2HG      LYS 135 -37.635 -19.663  -5.653
 1066    HG3  LYS 135           3HG      LYS 135 -36.947 -18.221  -4.886
 1067    HD2  LYS 135           2HD      LYS 135 -34.788 -19.233  -4.659
 1068    HD3  LYS 135           3HD      LYS 135 -35.383 -20.824  -5.125
 1069    HE2  LYS 135           2HE      LYS 135 -35.537 -18.429  -7.005
 1070    HE3  LYS 135           3HE      LYS 135 -34.076 -19.407  -6.864
 1071    HZ1  LYS 135           HZ1      LYS 135 -36.723 -20.488  -7.647
 1072    HZ2  LYS 135           HZ2      LYS 135 -35.470 -20.208  -8.670
 1073    HZ3  LYS 135           HZ3      LYS 135 -35.331 -21.350  -7.495
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  -9.242 -18.231  -1.513
    2    H2   MET   1           2H       MET   1  -8.882 -18.805  -3.001
    3    H3   MET   1           3H       MET   1  -9.327 -19.836  -1.804
    4    HA   MET   1           HA       MET   1 -11.062 -17.781  -3.008
    5    HB2  MET   1           2HB      MET   1 -11.097 -20.815  -3.330
    6    HB3  MET   1           3HB      MET   1 -12.424 -19.755  -3.803
    7    HG2  MET   1           2HG      MET   1 -10.877 -18.512  -5.313
    8    HG3  MET   1           3HG      MET   1  -9.612 -19.689  -4.959
    9    HE1  MET   1           3HE      MET   1 -10.900 -22.953  -6.668
   10    HE2  MET   1           1HE      MET   1  -9.571 -22.165  -5.792
   11    HE3  MET   1           2HE      MET   1 -11.101 -22.531  -4.957
   12    HA   PRO   2           HA       PRO   2 -13.428 -18.158   0.737
   13    HB2  PRO   2           2HB      PRO   2 -15.902 -17.312  -0.053
   14    HB3  PRO   2           3HB      PRO   2 -14.491 -16.215   0.063
   15    HG2  PRO   2           2HG      PRO   2 -15.550 -17.623  -2.413
   16    HG3  PRO   2           3HG      PRO   2 -15.156 -15.885  -2.216
   17    HD2  PRO   2           2HD      PRO   2 -13.393 -17.624  -3.322
   18    HD3  PRO   2           3HD      PRO   2 -12.834 -16.309  -2.243
   19    H    VAL   3           H        VAL   3 -15.077 -19.398   1.756
   20    HA   VAL   3           HA       VAL   3 -16.238 -21.700   0.252
   21    HB   VAL   3           HB       VAL   3 -14.781 -21.959   2.914
   22   HG11  VAL   3          1HG1      VAL   3 -16.017 -24.056   1.067
   23   HG12  VAL   3          2HG1      VAL   3 -15.038 -24.403   2.507
   24   HG13  VAL   3          3HG1      VAL   3 -16.594 -23.607   2.690
   25   HG21  VAL   3          3HG2      VAL   3 -13.920 -22.875   0.134
   26   HG22  VAL   3          1HG2      VAL   3 -13.108 -21.657   1.145
   27   HG23  VAL   3          2HG2      VAL   3 -13.132 -23.342   1.657
   28    H    ARG   4           H        ARG   4 -18.241 -22.353   0.963
   29    HA   ARG   4           HA       ARG   4 -19.865 -20.489   2.461
   30    HB2  ARG   4           2HB      ARG   4 -20.417 -23.356   1.577
   31    HB3  ARG   4           3HB      ARG   4 -21.617 -22.268   2.279
   32    HG2  ARG   4           2HG      ARG   4 -21.304 -20.682   0.384
   33    HG3  ARG   4           3HG      ARG   4 -20.138 -21.804  -0.349
   34    HD2  ARG   4           2HD      ARG   4 -21.888 -23.570  -0.385
   35    HD3  ARG   4           3HD      ARG   4 -23.063 -22.430   0.268
   36    HE   ARG   4           HE       ARG   4 -21.929 -22.520  -2.465
   37   HH11  ARG   4          1HH1      ARG   4 -23.920 -20.599  -0.294
   38   HH12  ARG   4          2HH1      ARG   4 -24.656 -19.739  -1.621
   39   HH21  ARG   4          1HH2      ARG   4 -22.887 -21.342  -4.070
   40   HH22  ARG   4          2HH2      ARG   4 -24.071 -20.127  -3.669
   41    H    ARG   5           H        ARG   5 -20.816 -20.642   4.449
   42    HA   ARG   5           HA       ARG   5 -19.566 -22.452   6.477
   43    HB2  ARG   5           2HB      ARG   5 -21.176 -19.883   6.767
   44    HB3  ARG   5           3HB      ARG   5 -20.791 -20.952   8.105
   45    HG2  ARG   5           2HG      ARG   5 -19.185 -19.225   8.178
   46    HG3  ARG   5           3HG      ARG   5 -18.357 -20.682   7.651
   47    HD2  ARG   5           2HD      ARG   5 -17.542 -18.732   6.446
   48    HD3  ARG   5           3HD      ARG   5 -18.318 -19.843   5.330
   49    HE   ARG   5           HE       ARG   5 -19.995 -17.661   6.432
   50   HH11  ARG   5          1HH1      ARG   5 -18.079 -18.636   3.628
   51   HH12  ARG   5          2HH1      ARG   5 -18.762 -17.362   2.653
   52   HH21  ARG   5          1HH2      ARG   5 -20.828 -16.123   5.090
   53   HH22  ARG   5          2HH2      ARG   5 -20.284 -16.011   3.444
   54    H    GLY   6           H        GLY   6 -20.784 -23.818   7.749
   55    HA2  GLY   6           HA2      GLY   6 -22.497 -25.351   8.180
   56    HA3  GLY   6           HA3      GLY   6 -23.638 -24.283   7.364
   57    H    HIS   7           H        HIS   7 -24.642 -25.923   6.159
   58    HA   HIS   7           HA       HIS   7 -23.163 -27.749   4.426
   59    HB2  HIS   7           2HB      HIS   7 -25.349 -28.501   3.717
   60    HB3  HIS   7           3HB      HIS   7 -25.308 -28.370   5.469
   61    HD2  HIS   7           HD2      HIS   7 -27.161 -27.100   2.419
   62    HE1  HIS   7           HE1      HIS   7 -28.768 -24.899   5.703
   63    HE2  HIS   7           HE2      HIS   7 -29.059 -25.460   3.237
   64    H    VAL   8           H        VAL   8 -23.442 -27.868   2.098
   65    HA   VAL   8           HA       VAL   8 -23.165 -25.261   0.765
   66    HB   VAL   8           HB       VAL   8 -23.052 -28.087  -0.334
   67   HG11  VAL   8          1HG1      VAL   8 -23.664 -26.612  -2.161
   68   HG12  VAL   8          2HG1      VAL   8 -22.419 -25.430  -1.694
   69   HG13  VAL   8          3HG1      VAL   8 -21.964 -27.027  -2.323
   70   HG21  VAL   8          3HG2      VAL   8 -21.171 -27.551   1.188
   71   HG22  VAL   8          1HG2      VAL   8 -20.616 -27.645  -0.483
   72   HG23  VAL   8          2HG2      VAL   8 -20.852 -26.058   0.281
   73    H    ALA   9           H        ALA   9 -24.805 -24.138  -0.004
   74    HA   ALA   9           HA       ALA   9 -27.523 -25.124  -0.228
   75    HB1  ALA   9           3HB      ALA   9 -27.929 -22.817  -1.089
   76    HB2  ALA   9           1HB      ALA   9 -26.955 -22.796   0.389
   77    HB3  ALA   9           2HB      ALA   9 -26.182 -22.553  -1.196
   78    HA   PRO  10           HA       PRO  10 -27.465 -26.640  -4.394
   79    HB2  PRO  10           2HB      PRO  10 -29.832 -25.783  -5.524
   80    HB3  PRO  10           3HB      PRO  10 -29.656 -27.117  -4.357
   81    HG2  PRO  10           2HG      PRO  10 -30.416 -24.228  -3.790
   82    HG3  PRO  10           3HG      PRO  10 -31.199 -25.716  -3.170
   83    HD2  PRO  10           2HD      PRO  10 -29.420 -24.328  -1.682
   84    HD3  PRO  10           3HD      PRO  10 -29.419 -26.114  -1.656
   85    H    GLN  11           H        GLN  11 -25.833 -25.787  -5.422
   86    HA   GLN  11           HA       GLN  11 -25.435 -23.057  -5.915
   87    HB2  GLN  11           2HB      GLN  11 -23.417 -23.657  -6.972
   88    HB3  GLN  11           3HB      GLN  11 -23.670 -24.766  -5.637
   89    HG2  GLN  11           2HG      GLN  11 -24.063 -25.354  -8.606
   90    HG3  GLN  11           3HG      GLN  11 -22.739 -25.902  -7.589
   91   HE21  GLN  11          2HE2      GLN  11 -25.084 -27.291  -9.173
   92   HE22  GLN  11          1HE2      GLN  11 -25.599 -28.491  -7.986
   93    H    ASN  12           H        ASN  12 -27.132 -25.353  -7.945
   94    HA   ASN  12           HA       ASN  12 -26.744 -23.951 -10.462
   95    HB2  ASN  12           2HB      ASN  12 -28.643 -26.133  -9.485
   96    HB3  ASN  12           3HB      ASN  12 -28.804 -25.396 -11.075
   97   HD21  ASN  12          1HD2      ASN  12 -28.495 -27.820 -11.565
   98   HD22  ASN  12          2HD2      ASN  12 -26.831 -28.287 -11.882
   99    H    THR  13           H        THR  13 -29.480 -24.099  -8.136
  100    HA   THR  13           HA       THR  13 -30.979 -22.015  -9.491
  101    HB   THR  13           HB       THR  13 -31.872 -23.898  -8.045
  102    HG1  THR  13           HG1      THR  13 -33.311 -22.399  -8.695
  103   HG21  THR  13          1HG2      THR  13 -32.208 -23.496  -5.699
  104   HG22  THR  13          2HG2      THR  13 -30.472 -23.461  -6.077
  105   HG23  THR  13          3HG2      THR  13 -31.330 -21.947  -5.788
  106    H    PHE  14           H        PHE  14 -28.764 -22.098  -6.696
  107    HA   PHE  14           HA       PHE  14 -29.069 -19.431  -5.785
  108    HB2  PHE  14           2HB      PHE  14 -27.818 -21.272  -4.700
  109    HB3  PHE  14           3HB      PHE  14 -26.596 -21.190  -5.952
  110    HD1  PHE  14           HD2      PHE  14 -25.073 -19.188  -6.125
  111    HD2  PHE  14           HD1      PHE  14 -27.853 -19.684  -2.860
  112    HE1  PHE  14           HE2      PHE  14 -23.840 -17.477  -4.810
  113    HE2  PHE  14           HE1      PHE  14 -26.620 -17.968  -1.552
  114    HZ   PHE  14           HZ       PHE  14 -24.609 -16.867  -2.525
  115    H    LEU  15           H        LEU  15 -27.063 -20.802  -8.412
  116    HA   LEU  15           HA       LEU  15 -26.084 -18.164  -9.204
  117    HB2  LEU  15           2HB      LEU  15 -24.678 -20.083  -9.595
  118    HB3  LEU  15           3HB      LEU  15 -25.923 -20.854 -10.591
  119    HG   LEU  15           HG       LEU  15 -25.742 -19.111 -12.275
  120   HD11  LEU  15          1HD1      LEU  15 -23.511 -17.880 -10.588
  121   HD12  LEU  15          2HD1      LEU  15 -24.004 -17.373 -12.228
  122   HD13  LEU  15          3HD1      LEU  15 -25.094 -17.147 -10.873
  123   HD21  LEU  15          3HD2      LEU  15 -23.487 -19.614 -13.104
  124   HD22  LEU  15          1HD2      LEU  15 -23.008 -20.192 -11.490
  125   HD23  LEU  15          2HD2      LEU  15 -24.251 -21.060 -12.420
  126    H    ASP  16           H        ASP  16 -28.594 -20.357 -10.579
  127    HA   ASP  16           HA       ASP  16 -29.497 -18.922 -12.766
  128    HB2  ASP  16           2HB      ASP  16 -30.356 -21.111 -11.964
  129    HB3  ASP  16           3HB      ASP  16 -31.236 -20.272 -10.687
  130    H    THR  17           H        THR  17 -30.224 -18.262  -9.390
  131    HA   THR  17           HA       THR  17 -32.107 -16.100  -9.793
  132    HB   THR  17           HB       THR  17 -30.157 -16.474  -7.474
  133    HG1  THR  17           HG1      THR  17 -31.373 -18.301  -7.777
  134   HG21  THR  17          1HG2      THR  17 -31.911 -15.320  -6.155
  135   HG22  THR  17          2HG2      THR  17 -31.232 -14.277  -7.418
  136   HG23  THR  17          3HG2      THR  17 -32.833 -15.028  -7.649
  137    H    ILE  18           H        ILE  18 -28.553 -16.140  -9.504
  138    HA   ILE  18           HA       ILE  18 -28.260 -13.258  -9.736
  139    HB   ILE  18           HB       ILE  18 -26.218 -15.440 -10.247
  140   HG12  ILE  18          2HG1      ILE  18 -27.074 -15.701  -7.981
  141   HG13  ILE  18          3HG1      ILE  18 -25.390 -15.250  -8.036
  142   HG21  ILE  18          1HG2      ILE  18 -25.865 -12.472  -9.712
  143   HG22  ILE  18          2HG2      ILE  18 -24.542 -13.659  -9.631
  144   HG23  ILE  18          3HG2      ILE  18 -25.389 -13.394 -11.149
  145   HD11  ILE  18          3HD1      ILE  18 -27.740 -13.352  -7.458
  146   HD12  ILE  18          1HD1      ILE  18 -26.685 -14.080  -6.233
  147   HD13  ILE  18          2HD1      ILE  18 -26.018 -12.912  -7.386
  148    H    ILE  19           H        ILE  19 -28.232 -16.032 -12.006
  149    HA   ILE  19           HA       ILE  19 -27.523 -14.614 -14.326
  150    HB   ILE  19           HB       ILE  19 -29.621 -16.822 -14.135
  151   HG12  ILE  19          2HG1      ILE  19 -27.621 -17.832 -13.343
  152   HG13  ILE  19          3HG1      ILE  19 -27.795 -18.327 -15.005
  153   HG21  ILE  19          1HG2      ILE  19 -29.870 -15.662 -16.224
  154   HG22  ILE  19          2HG2      ILE  19 -28.119 -15.686 -16.514
  155   HG23  ILE  19          3HG2      ILE  19 -29.064 -17.194 -16.548
  156   HD11  ILE  19          3HD1      ILE  19 -25.902 -16.248 -13.869
  157   HD12  ILE  19          1HD1      ILE  19 -25.499 -17.808 -14.599
  158   HD13  ILE  19          2HD1      ILE  19 -26.145 -16.480 -15.620
  159    H    ARG  20           H        ARG  20 -30.824 -15.139 -12.988
  160    HA   ARG  20           HA       ARG  20 -32.140 -13.274 -14.756
  161    HB2  ARG  20           2HB      ARG  20 -32.863 -14.491 -12.081
  162    HB3  ARG  20           3HB      ARG  20 -33.888 -13.271 -12.854
  163    HG2  ARG  20           2HG      ARG  20 -34.079 -14.608 -14.891
  164    HG3  ARG  20           3HG      ARG  20 -33.027 -15.864 -14.217
  165    HD2  ARG  20           2HD      ARG  20 -35.641 -14.962 -12.942
  166    HD3  ARG  20           3HD      ARG  20 -35.519 -16.310 -14.084
  167    HE   ARG  20           HE       ARG  20 -33.628 -17.006 -12.266
  168   HH11  ARG  20          2HH1      ARG  20 -36.937 -16.002 -11.649
  169   HH12  ARG  20          1HH1      ARG  20 -37.147 -17.179 -10.384
  170   HH21  ARG  20          2HH2      ARG  20 -34.110 -18.668 -10.969
  171   HH22  ARG  20          1HH2      ARG  20 -35.534 -18.637  -9.950
  172    H    LYS  21           H        LYS  21 -30.354 -12.727 -11.814
  173    HA   LYS  21           HA       LYS  21 -31.153  -9.969 -11.418
  174    HB2  LYS  21           2HB      LYS  21 -29.698 -11.529  -9.861
  175    HB3  LYS  21           3HB      LYS  21 -28.347 -10.919 -10.836
  176    HG2  LYS  21           2HG      LYS  21 -28.383  -9.575  -8.936
  177    HG3  LYS  21           3HG      LYS  21 -29.063  -8.573 -10.221
  178    HD2  LYS  21           2HD      LYS  21 -31.360  -9.065  -9.353
  179    HD3  LYS  21           3HD      LYS  21 -30.655 -10.135  -8.133
  180    HE2  LYS  21           2HE      LYS  21 -31.204  -8.054  -7.078
  181    HE3  LYS  21           3HE      LYS  21 -29.446  -8.204  -7.131
  182    HZ1  LYS  21           HZ1      LYS  21 -31.081  -6.603  -9.036
  183    HZ2  LYS  21           HZ2      LYS  21 -30.293  -5.975  -7.760
  184    HZ3  LYS  21           HZ3      LYS  21 -29.434  -6.646  -8.997
  185    H    PHE  22           H        PHE  22 -28.476 -11.346 -13.392
  186    HA   PHE  22           HA       PHE  22 -28.098  -8.630 -14.558
  187    HB2  PHE  22           2HB      PHE  22 -25.928  -9.211 -15.206
  188    HB3  PHE  22           3HB      PHE  22 -26.148  -9.644 -13.531
  189    HD1  PHE  22           HD2      PHE  22 -26.034 -11.111 -17.011
  190    HD2  PHE  22           HD1      PHE  22 -25.515 -11.790 -12.789
  191    HE1  PHE  22           HE2      PHE  22 -25.068 -13.336 -17.492
  192    HE2  PHE  22           HE1      PHE  22 -24.516 -14.016 -13.277
  193    HZ   PHE  22           HZ       PHE  22 -24.292 -14.789 -15.629
  194    H    GLU  23           H        GLU  23 -29.813 -11.305 -15.445
  195    HA   GLU  23           HA       GLU  23 -29.150 -12.080 -17.920
  196    HB2  GLU  23           2HB      GLU  23 -30.937 -13.057 -16.545
  197    HB3  GLU  23           3HB      GLU  23 -31.950 -11.644 -16.816
  198    HG2  GLU  23           2HG      GLU  23 -32.085 -12.259 -19.239
  199    HG3  GLU  23           3HG      GLU  23 -31.053 -13.660 -18.918
  200    H    GLY  24           H        GLY  24 -30.829  -9.057 -17.193
  201    HA2  GLY  24           HA2      GLY  24 -31.315  -7.190 -18.469
  202    HA3  GLY  24           HA3      GLY  24 -30.614  -7.973 -19.882
  203    H    GLN  25           H        GLN  25 -32.924 -10.130 -18.785
  204    HA   GLN  25           HA       GLN  25 -35.055  -8.986 -20.548
  205    HB2  GLN  25           2HB      GLN  25 -34.338 -11.884 -20.020
  206    HB3  GLN  25           3HB      GLN  25 -35.689 -11.308 -20.995
  207    HG2  GLN  25           2HG      GLN  25 -34.088 -10.154 -22.523
  208    HG3  GLN  25           3HG      GLN  25 -32.739 -10.782 -21.575
  209   HE21  GLN  25          2HE2      GLN  25 -32.414 -11.472 -24.058
  210   HE22  GLN  25          1HE2      GLN  25 -32.961 -13.112 -24.383
  211    H    SER  26           H        SER  26 -34.719 -11.096 -17.646
  212    HA   SER  26           HA       SER  26 -37.457 -10.640 -16.822
  213    HB2  SER  26           2HB      SER  26 -35.126 -11.772 -15.230
  214    HB3  SER  26           3HB      SER  26 -36.841 -11.852 -14.784
  215    HG   SER  26           HG       SER  26 -35.483 -13.085 -16.932
  216    H    ARG  27           H        ARG  27 -35.108  -8.356 -16.786
  217    HA   ARG  27           HA       ARG  27 -35.978  -7.131 -14.209
  218    HB2  ARG  27           2HB      ARG  27 -33.252  -7.180 -15.549
  219    HB3  ARG  27           3HB      ARG  27 -33.636  -6.134 -14.180
  220    HG2  ARG  27           2HG      ARG  27 -33.959  -9.184 -14.086
  221    HG3  ARG  27           3HG      ARG  27 -32.509  -8.316 -13.576
  222    HD2  ARG  27           2HD      ARG  27 -33.810  -7.077 -11.934
  223    HD3  ARG  27           3HD      ARG  27 -35.310  -7.853 -12.447
  224    HE   ARG  27           HE       ARG  27 -33.514  -8.814 -10.519
  225   HH11  ARG  27          2HH1      ARG  27 -35.830  -9.991 -12.888
  226   HH12  ARG  27          1HH1      ARG  27 -36.033 -11.489 -12.028
  227   HH21  ARG  27          1HH2      ARG  27 -33.740 -10.757  -9.581
  228   HH22  ARG  27          2HH2      ARG  27 -34.856 -11.929 -10.217
  229    H    LYS  28           H        LYS  28 -36.001  -4.912 -13.966
  230    HA   LYS  28           HA       LYS  28 -36.852  -3.409 -16.408
  231    HB2  LYS  28           2HB      LYS  28 -38.450  -3.563 -13.813
  232    HB3  LYS  28           3HB      LYS  28 -38.914  -2.799 -15.300
  233    HG2  LYS  28           2HG      LYS  28 -40.136  -4.702 -15.562
  234    HG3  LYS  28           3HG      LYS  28 -38.665  -5.310 -16.275
  235    HD2  LYS  28           2HD      LYS  28 -38.109  -6.450 -14.153
  236    HD3  LYS  28           3HD      LYS  28 -39.479  -5.680 -13.340
  237    HE2  LYS  28           2HE      LYS  28 -41.077  -6.879 -14.640
  238    HE3  LYS  28           3HE      LYS  28 -39.876  -7.342 -15.839
  239    HZ1  LYS  28           HZ1      LYS  28 -38.831  -8.787 -14.151
  240    HZ2  LYS  28           HZ2      LYS  28 -39.962  -8.363 -13.040
  241    HZ3  LYS  28           HZ3      LYS  28 -40.397  -9.203 -14.368
  242    H    PHE  29           H        PHE  29 -36.675  -1.107 -16.278
  243    HA   PHE  29           HA       PHE  29 -35.703   0.188 -13.872
  244    HB2  PHE  29           2HB      PHE  29 -33.361   0.487 -14.511
  245    HB3  PHE  29           3HB      PHE  29 -33.727  -1.193 -14.302
  246    HD1  PHE  29           HD1      PHE  29 -33.834  -2.755 -16.245
  247    HD2  PHE  29           HD2      PHE  29 -32.638   1.368 -16.669
  248    HE1  PHE  29           HE1      PHE  29 -32.807  -3.281 -18.440
  249    HE2  PHE  29           HE2      PHE  29 -31.587   0.826 -18.860
  250    HZ   PHE  29           HZ       PHE  29 -31.667  -1.495 -19.741
  251    H    ILE  30           H        ILE  30 -34.826   2.222 -14.097
  252    HA   ILE  30           HA       ILE  30 -35.361   3.793 -16.549
  253    HB   ILE  30           HB       ILE  30 -35.817   5.725 -14.895
  254   HG12  ILE  30          2HG1      ILE  30 -36.939   5.224 -12.823
  255   HG13  ILE  30          3HG1      ILE  30 -36.687   3.492 -13.015
  256   HG21  ILE  30          1HG2      ILE  30 -37.853   3.518 -15.290
  257   HG22  ILE  30          2HG2      ILE  30 -38.195   5.238 -14.967
  258   HG23  ILE  30          3HG2      ILE  30 -37.377   4.762 -16.470
  259   HD11  ILE  30          3HD1      ILE  30 -35.165   4.648 -11.360
  260   HD12  ILE  30          1HD1      ILE  30 -34.303   3.719 -12.602
  261   HD13  ILE  30          2HD1      ILE  30 -34.409   5.494 -12.720
  262    H    ILE  31           H        ILE  31 -34.188   5.884 -16.503
  263    HA   ILE  31           HA       ILE  31 -31.523   5.728 -15.185
  264    HB   ILE  31           HB       ILE  31 -31.990   6.945 -17.910
  265   HG12  ILE  31          2HG1      ILE  31 -32.595   4.545 -18.145
  266   HG13  ILE  31          3HG1      ILE  31 -31.162   5.029 -19.073
  267   HG21  ILE  31          1HG2      ILE  31 -29.507   6.061 -16.391
  268   HG22  ILE  31          2HG2      ILE  31 -29.511   6.684 -18.062
  269   HG23  ILE  31          3HG2      ILE  31 -30.032   7.714 -16.720
  270   HD11  ILE  31          3HD1      ILE  31 -30.945   2.826 -17.873
  271   HD12  ILE  31          1HD1      ILE  31 -29.654   4.005 -17.572
  272   HD13  ILE  31          2HD1      ILE  31 -30.924   3.770 -16.357
  273    H    ALA  32           H        ALA  32 -31.217   7.390 -13.968
  274    HA   ALA  32           HA       ALA  32 -32.446  10.022 -14.684
  275    HB1  ALA  32           3HB      ALA  32 -32.708   8.562 -12.048
  276    HB2  ALA  32           1HB      ALA  32 -33.020  10.293 -12.219
  277    HB3  ALA  32           2HB      ALA  32 -33.981   9.120 -13.145
  278    H    ASN  33           H        ASN  33 -31.667  11.906 -13.743
  279    HA   ASN  33           HA       ASN  33 -28.741  11.810 -13.279
  280    HB2  ASN  33           2HB      ASN  33 -28.952  14.331 -13.134
  281    HB3  ASN  33           3HB      ASN  33 -29.216  13.569 -14.680
  282   HD21  ASN  33          2HD2      ASN  33 -30.102  15.762 -15.115
  283   HD22  ASN  33          1HD2      ASN  33 -31.817  15.962 -14.789
  284    H    ALA  34           H        ALA  34 -28.045  11.146 -11.377
  285    HA   ALA  34           HA       ALA  34 -29.516  11.349  -8.917
  286    HB1  ALA  34           3HB      ALA  34 -26.547  10.809  -9.393
  287    HB2  ALA  34           1HB      ALA  34 -27.446  10.452  -7.918
  288    HB3  ALA  34           2HB      ALA  34 -27.836   9.581  -9.411
  289    H    ARG  35           H        ARG  35 -27.506  13.615 -10.518
  290    HA   ARG  35           HA       ARG  35 -26.607  14.970  -8.037
  291    HB2  ARG  35           2HB      ARG  35 -25.839  15.636 -10.895
  292    HB3  ARG  35           3HB      ARG  35 -25.033  16.138  -9.417
  293    HG2  ARG  35           2HG      ARG  35 -25.045  13.407 -10.721
  294    HG3  ARG  35           3HG      ARG  35 -23.678  14.457 -10.386
  295    HD2  ARG  35           2HD      ARG  35 -25.290  12.833  -8.380
  296    HD3  ARG  35           3HD      ARG  35 -23.626  12.564  -8.903
  297    HE   ARG  35           HE       ARG  35 -23.693  15.148  -7.798
  298   HH11  ARG  35          1HH2      ARG  35 -24.064  11.837  -6.669
  299   HH12  ARG  35          2HH2      ARG  35 -23.621  12.264  -5.034
  300   HH21  ARG  35          2HH1      ARG  35 -23.107  15.597  -5.696
  301   HH22  ARG  35          1HH1      ARG  35 -23.059  14.324  -4.514
  302    H    VAL  36           H        VAL  36 -29.386  15.238  -9.657
  303    HA   VAL  36           HA       VAL  36 -29.556  18.207  -9.388
  304    HB   VAL  36           HB       VAL  36 -29.830  16.966 -11.696
  305   HG11  VAL  36          1HG1      VAL  36 -31.653  15.432 -11.000
  306   HG12  VAL  36          2HG1      VAL  36 -32.702  16.843 -10.708
  307   HG13  VAL  36          3HG1      VAL  36 -32.122  16.516 -12.330
  308   HG21  VAL  36          3HG2      VAL  36 -30.030  19.364 -11.361
  309   HG22  VAL  36          1HG2      VAL  36 -31.213  18.735 -12.515
  310   HG23  VAL  36          2HG2      VAL  36 -31.733  19.168 -10.862
  311    H    GLU  37           H        GLU  37 -31.182  19.099  -8.171
  312    HA   GLU  37           HA       GLU  37 -32.192  17.594  -6.012
  313    HB2  GLU  37           2HB      GLU  37 -33.409  19.592  -5.399
  314    HB3  GLU  37           3HB      GLU  37 -31.781  19.994  -5.947
  315    HG2  GLU  37           2HG      GLU  37 -32.723  20.671  -8.169
  316    HG3  GLU  37           3HG      GLU  37 -34.344  20.310  -7.574
  317    H    ASN  38           H        ASN  38 -33.656  18.077  -9.119
  318    HA   ASN  38           HA       ASN  38 -36.301  17.109  -8.305
  319    HB2  ASN  38           2HB      ASN  38 -35.837  18.945 -10.001
  320    HB3  ASN  38           3HB      ASN  38 -35.239  17.697 -11.098
  321   HD21  ASN  38          2HD2      ASN  38 -38.134  18.568  -9.115
  322   HD22  ASN  38          1HD2      ASN  38 -39.274  17.938 -10.292
  323    H    CYS  39           H        CYS  39 -33.431  15.462  -8.969
  324    HA   CYS  39           HA       CYS  39 -32.858  13.422  -9.777
  325    HB2  CYS  39           2HB      CYS  39 -33.726  11.666  -8.394
  326    HB3  CYS  39           3HB      CYS  39 -33.544  13.145  -7.447
  327    HG   CYS  39           HG       CYS  39 -36.203  13.799  -7.980
  328    H    ALA  40           H        ALA  40 -34.054  14.429 -11.958
  329    HA   ALA  40           HA       ALA  40 -36.400  12.940 -12.676
  330    HB1  ALA  40           3HB      ALA  40 -36.433  14.334 -14.667
  331    HB2  ALA  40           1HB      ALA  40 -36.154  15.300 -13.216
  332    HB3  ALA  40           2HB      ALA  40 -34.793  14.925 -14.304
  333    H    VAL  41           H        VAL  41 -36.844  11.664 -14.357
  334    HA   VAL  41           HA       VAL  41 -34.958   9.641 -15.142
  335    HB   VAL  41           HB       VAL  41 -37.894  10.114 -15.757
  336   HG11  VAL  41          1HG1      VAL  41 -36.939   8.634 -17.515
  337   HG12  VAL  41          2HG1      VAL  41 -36.210   7.626 -16.248
  338   HG13  VAL  41          3HG1      VAL  41 -37.973   7.720 -16.421
  339   HG21  VAL  41          3HG2      VAL  41 -37.350   9.596 -13.352
  340   HG22  VAL  41          1HG2      VAL  41 -38.320   8.352 -14.138
  341   HG23  VAL  41          2HG2      VAL  41 -36.577   8.095 -13.894
  342    H    ILE  42           H        ILE  42 -33.458  10.640 -16.401
  343    HA   ILE  42           HA       ILE  42 -34.037  12.158 -18.808
  344    HB   ILE  42           HB       ILE  42 -31.623  11.909 -19.247
  345   HG12  ILE  42          2HG1      ILE  42 -31.553  10.226 -16.702
  346   HG13  ILE  42          3HG1      ILE  42 -31.319   9.607 -18.338
  347   HG21  ILE  42          1HG2      ILE  42 -32.174  12.691 -16.347
  348   HG22  ILE  42          2HG2      ILE  42 -30.879  13.294 -17.400
  349   HG23  ILE  42          3HG2      ILE  42 -32.558  13.698 -17.757
  350   HD11  ILE  42          3HD1      ILE  42 -29.204   9.824 -17.300
  351   HD12  ILE  42          1HD1      ILE  42 -29.319  11.081 -18.550
  352   HD13  ILE  42          2HD1      ILE  42 -29.513  11.501 -16.820
  353    H    TYR  43           H        TYR  43 -33.823   8.756 -18.077
  354    HA   TYR  43           HA       TYR  43 -34.841   8.142 -20.743
  355    HB2  TYR  43           2HB      TYR  43 -32.311   8.122 -21.095
  356    HB3  TYR  43           3HB      TYR  43 -32.242   6.767 -20.020
  357    HD1  TYR  43           HD2      TYR  43 -34.178   7.873 -23.059
  358    HD2  TYR  43           HD1      TYR  43 -32.257   4.614 -20.976
  359    HE1  TYR  43           HE2      TYR  43 -34.757   6.324 -24.924
  360    HE2  TYR  43           HE1      TYR  43 -32.815   3.085 -22.843
  361    HH   TYR  43           HH       TYR  43 -33.735   2.890 -24.924
  362    H    CYS  44           H        CYS  44 -35.521   5.855 -21.035
  363    HA   CYS  44           HA       CYS  44 -35.951   4.425 -18.506
  364    HB2  CYS  44           2HB      CYS  44 -38.448   4.338 -18.962
  365    HB3  CYS  44           3HB      CYS  44 -37.812   5.904 -18.431
  366    HG   CYS  44           HG       CYS  44 -37.575   6.973 -20.787
  367    H    ASN  45           H        ASN  45 -36.319   2.203 -18.680
  368    HA   ASN  45           HA       ASN  45 -35.958   1.080 -21.392
  369    HB2  ASN  45           2HB      ASN  45 -34.592   0.371 -19.374
  370    HB3  ASN  45           3HB      ASN  45 -36.032  -0.453 -18.773
  371   HD21  ASN  45          2HD2      ASN  45 -33.716  -0.268 -21.527
  372   HD22  ASN  45          1HD2      ASN  45 -34.023  -1.913 -22.059
  373    H    ASP  46           H        ASP  46 -37.250  -0.633 -22.179
  374    HA   ASP  46           HA       ASP  46 -40.109  -0.233 -21.842
  375    HB2  ASP  46           2HB      ASP  46 -38.580  -2.412 -23.303
  376    HB3  ASP  46           3HB      ASP  46 -40.325  -2.135 -23.403
  377    H    GLY  47           H        GLY  47 -37.777  -2.305 -20.230
  378    HA2  GLY  47           HA2      GLY  47 -39.431  -4.235 -19.024
  379    HA3  GLY  47           HA3      GLY  47 -38.032  -3.462 -18.266
  380    H    PHE  48           H        PHE  48 -38.833  -0.833 -17.840
  381    HA   PHE  48           HA       PHE  48 -40.704  -0.912 -15.681
  382    HB2  PHE  48           2HB      PHE  48 -39.710   1.080 -15.394
  383    HB3  PHE  48           3HB      PHE  48 -39.122   1.126 -17.045
  384    HD1  PHE  48           HD1      PHE  48 -41.990   2.037 -14.840
  385    HD2  PHE  48           HD2      PHE  48 -40.281   2.401 -18.786
  386    HE1  PHE  48           HE1      PHE  48 -43.863   3.508 -15.525
  387    HE2  PHE  48           HE2      PHE  48 -42.161   3.852 -19.465
  388    HZ   PHE  48           HZ       PHE  48 -43.977   4.381 -17.852
  389    H    CYS  49           H        CYS  49 -41.151  -0.395 -19.155
  390    HA   CYS  49           HA       CYS  49 -43.847   0.622 -19.011
  391    HB2  CYS  49           2HB      CYS  49 -42.191   0.812 -20.962
  392    HB3  CYS  49           3HB      CYS  49 -42.668  -0.846 -21.392
  393    HG   CYS  49           HG       CYS  49 -45.277  -0.330 -21.433
  394    H    GLU  50           H        GLU  50 -42.497  -2.680 -19.318
  395    HA   GLU  50           HA       GLU  50 -45.137  -3.956 -19.410
  396    HB2  GLU  50           2HB      GLU  50 -42.379  -5.125 -18.860
  397    HB3  GLU  50           3HB      GLU  50 -43.857  -6.041 -19.184
  398    HG2  GLU  50           2HG      GLU  50 -44.033  -4.883 -21.416
  399    HG3  GLU  50           3HG      GLU  50 -42.464  -4.141 -21.116
  400    H    LEU  51           H        LEU  51 -42.835  -3.127 -16.877
  401    HA   LEU  51           HA       LEU  51 -43.865  -4.653 -14.726
  402    HB2  LEU  51           2HB      LEU  51 -41.691  -3.517 -14.808
  403    HB3  LEU  51           3HB      LEU  51 -42.467  -1.957 -14.857
  404    HG   LEU  51           HG       LEU  51 -43.426  -2.309 -12.606
  405   HD11  LEU  51          1HD1      LEU  51 -43.318  -4.766 -12.466
  406   HD12  LEU  51          2HD1      LEU  51 -41.538  -4.696 -12.526
  407   HD13  LEU  51          3HD1      LEU  51 -42.419  -3.999 -11.151
  408   HD21  LEU  51          3HD2      LEU  51 -41.333  -1.844 -11.424
  409   HD22  LEU  51          1HD2      LEU  51 -40.399  -2.428 -12.821
  410   HD23  LEU  51          2HD2      LEU  51 -41.413  -0.971 -12.962
  411    H    CYS  52           H        CYS  52 -44.461  -1.232 -15.550
  412    HA   CYS  52           HA       CYS  52 -46.719  -1.094 -13.632
  413    HB2  CYS  52           2HB      CYS  52 -45.167   1.063 -15.119
  414    HB3  CYS  52           3HB      CYS  52 -46.416   1.320 -13.880
  415    HG   CYS  52           HG       CYS  52 -44.075   1.789 -12.822
  416    H    GLY  53           H        GLY  53 -46.232  -1.257 -17.089
  417    HA2  GLY  53           HA2      GLY  53 -47.849  -1.563 -18.719
  418    HA3  GLY  53           HA3      GLY  53 -49.111  -1.342 -17.517
  419    H    TYR  54           H        TYR  54 -46.887   1.322 -17.638
  420    HA   TYR  54           HA       TYR  54 -48.976   3.005 -18.885
  421    HB2  TYR  54           2HB      TYR  54 -46.517   3.769 -17.291
  422    HB3  TYR  54           3HB      TYR  54 -47.758   4.876 -17.872
  423    HD1  TYR  54           HD1      TYR  54 -50.304   3.973 -17.255
  424    HD2  TYR  54           HD2      TYR  54 -46.688   3.307 -15.000
  425    HE1  TYR  54           HE1      TYR  54 -51.659   3.443 -15.232
  426    HE2  TYR  54           HE2      TYR  54 -48.052   2.755 -12.983
  427    HH   TYR  54           HH       TYR  54 -50.146   2.404 -12.158
  428    H    SER  55           H        SER  55 -46.126   4.668 -19.268
  429    HA   SER  55           HA       SER  55 -45.294   3.609 -21.867
  430    HB2  SER  55           2HB      SER  55 -47.362   4.793 -22.496
  431    HB3  SER  55           3HB      SER  55 -46.788   6.258 -21.674
  432    HG   SER  55           HG       SER  55 -46.424   6.140 -24.017
  433    H    ARG  56           H        ARG  56 -43.403   4.583 -22.620
  434    HA   ARG  56           HA       ARG  56 -41.474   5.805 -20.871
  435    HB2  ARG  56           2HB      ARG  56 -41.849   5.950 -23.909
  436    HB3  ARG  56           3HB      ARG  56 -40.396   6.470 -23.058
  437    HG2  ARG  56           2HG      ARG  56 -39.893   4.192 -22.365
  438    HG3  ARG  56           3HG      ARG  56 -41.430   3.590 -23.000
  439    HD2  ARG  56           2HD      ARG  56 -40.818   3.980 -25.249
  440    HD3  ARG  56           3HD      ARG  56 -39.506   5.062 -24.815
  441    HE   ARG  56           HE       ARG  56 -39.487   2.066 -24.587
  442   HH11  ARG  56          1HH2      ARG  56 -37.598   5.040 -24.476
  443   HH12  ARG  56          2HH2      ARG  56 -36.102   4.173 -24.745
  444   HH21  ARG  56          1HH1      ARG  56 -37.524   1.081 -24.957
  445   HH22  ARG  56          2HH1      ARG  56 -36.069   2.055 -24.996
  446    H    ALA  57           H        ALA  57 -43.823   7.290 -23.117
  447    HA   ALA  57           HA       ALA  57 -43.038  10.006 -22.703
  448    HB1  ALA  57           3HB      ALA  57 -45.717   8.821 -23.557
  449    HB2  ALA  57           1HB      ALA  57 -45.190  10.500 -23.798
  450    HB3  ALA  57           2HB      ALA  57 -44.346   9.184 -24.634
  451    H    GLU  58           H        GLU  58 -44.846   7.880 -20.604
  452    HA   GLU  58           HA       GLU  58 -45.996  10.080 -19.015
  453    HB2  GLU  58           2HB      GLU  58 -46.233   7.061 -18.774
  454    HB3  GLU  58           3HB      GLU  58 -46.913   8.220 -17.638
  455    HG2  GLU  58           2HG      GLU  58 -48.217   9.285 -19.453
  456    HG3  GLU  58           3HG      GLU  58 -47.563   8.137 -20.616
  457    H    VAL  59           H        VAL  59 -43.044   8.216 -19.081
  458    HA   VAL  59           HA       VAL  59 -42.400   9.153 -16.311
  459    HB   VAL  59           HB       VAL  59 -40.456   7.606 -16.420
  460   HG11  VAL  59          1HG1      VAL  59 -41.790   5.658 -15.807
  461   HG12  VAL  59          2HG1      VAL  59 -42.512   7.130 -15.147
  462   HG13  VAL  59          3HG1      VAL  59 -43.230   6.371 -16.581
  463   HG21  VAL  59          3HG2      VAL  59 -40.375   7.235 -18.854
  464   HG22  VAL  59          1HG2      VAL  59 -40.460   5.736 -17.914
  465   HG23  VAL  59          2HG2      VAL  59 -41.909   6.338 -18.739
  466    H    MET  60           H        MET  60 -41.548   9.739 -19.641
  467    HA   MET  60           HA       MET  60 -39.025  10.666 -19.593
  468    HB2  MET  60           2HB      MET  60 -41.521  11.448 -21.071
  469    HB3  MET  60           3HB      MET  60 -40.200  12.603 -21.157
  470    HG2  MET  60           2HG      MET  60 -39.910   9.685 -21.894
  471    HG3  MET  60           3HG      MET  60 -40.227  10.997 -23.022
  472    HE1  MET  60           3HE      MET  60 -37.639   8.694 -22.254
  473    HE2  MET  60           1HE      MET  60 -36.214   9.562 -21.641
  474    HE3  MET  60           2HE      MET  60 -37.636   9.336 -20.595
  475    H    GLN  61           H        GLN  61 -38.075  11.714 -18.035
  476    HA   GLN  61           HA       GLN  61 -37.253  13.426 -16.913
  477    HB2  GLN  61           2HB      GLN  61 -39.071  15.235 -18.506
  478    HB3  GLN  61           3HB      GLN  61 -37.568  15.679 -17.715
  479    HG2  GLN  61           2HG      GLN  61 -36.238  14.752 -19.374
  480    HG3  GLN  61           3HG      GLN  61 -37.348  13.443 -19.735
  481   HE21  GLN  61          2HE2      GLN  61 -37.845  13.533 -21.854
  482   HE22  GLN  61          1HE2      GLN  61 -38.432  14.975 -22.654
  483    H    ARG  62           H        ARG  62 -39.860  12.068 -15.954
  484    HA   ARG  62           HA       ARG  62 -40.746  13.994 -13.898
  485    HB2  ARG  62           2HB      ARG  62 -41.344  11.077 -14.567
  486    HB3  ARG  62           3HB      ARG  62 -41.682  11.688 -12.965
  487    HG2  ARG  62           2HG      ARG  62 -43.693  11.983 -13.869
  488    HG3  ARG  62           3HG      ARG  62 -43.010  13.586 -14.134
  489    HD2  ARG  62           2HD      ARG  62 -42.925  11.411 -16.249
  490    HD3  ARG  62           3HD      ARG  62 -44.376  12.378 -16.022
  491    HE   ARG  62           HE       ARG  62 -41.943  13.167 -17.350
  492   HH11  ARG  62          1HH1      ARG  62 -44.630  14.621 -15.617
  493   HH12  ARG  62          2HH1      ARG  62 -44.412  16.142 -16.438
  494   HH21  ARG  62          1HH2      ARG  62 -41.753  15.007 -18.331
  495   HH22  ARG  62          2HH2      ARG  62 -42.788  16.373 -17.958
  496    HA   PRO  63           HA       PRO  63 -37.717  12.831 -10.764
  497    HB2  PRO  63           2HB      PRO  63 -40.086  12.581  -8.921
  498    HB3  PRO  63           3HB      PRO  63 -38.546  13.446  -8.655
  499    HG2  PRO  63           2HG      PRO  63 -40.781  14.829  -9.292
  500    HG3  PRO  63           3HG      PRO  63 -39.225  15.240 -10.086
  501    HD2  PRO  63           2HD      PRO  63 -41.485  13.529 -11.164
  502    HD3  PRO  63           3HD      PRO  63 -40.579  14.850 -11.966
  503    H    CYS  64           H        CYS  64 -36.822  10.886 -10.111
  504    HA   CYS  64           HA       CYS  64 -38.040   8.332 -10.617
  505    HB2  CYS  64           2HB      CYS  64 -35.552   9.368  -9.292
  506    HB3  CYS  64           3HB      CYS  64 -36.076   7.725  -8.882
  507    HG   CYS  64           HG       CYS  64 -35.642   9.029 -11.873
  508    H    THR  65           H        THR  65 -38.582  10.431  -7.899
  509    HA   THR  65           HA       THR  65 -38.856   8.590  -5.840
  510    HB   THR  65           HB       THR  65 -40.513  11.111  -5.923
  511    HG1  THR  65           HG1      THR  65 -38.684  12.211  -5.254
  512   HG21  THR  65          1HG2      THR  65 -38.893   9.674  -3.783
  513   HG22  THR  65          2HG2      THR  65 -39.860  11.151  -3.537
  514   HG23  THR  65          3HG2      THR  65 -40.662   9.624  -3.934
  515    H    CYS  66           H        CYS  66 -39.931   6.871  -6.268
  516    HA   CYS  66           HA       CYS  66 -42.260   6.371  -7.591
  517    HB2  CYS  66           2HB      CYS  66 -42.388   4.262  -6.334
  518    HB3  CYS  66           3HB      CYS  66 -40.703   4.649  -6.742
  519    HG   CYS  66           HG       CYS  66 -40.802   3.624  -4.327
  520    H    ASP  67           H        ASP  67 -42.221   7.963  -4.548
  521    HA   ASP  67           HA       ASP  67 -44.814   7.640  -3.510
  522    HB2  ASP  67           2HB      ASP  67 -43.017   9.041  -2.527
  523    HB3  ASP  67           3HB      ASP  67 -43.186  10.191  -3.850
  524    H    PHE  68           H        PHE  68 -43.755   9.646  -6.317
  525    HA   PHE  68           HA       PHE  68 -46.298  10.873  -6.825
  526    HB2  PHE  68           2HB      PHE  68 -43.873  10.343  -8.593
  527    HB3  PHE  68           3HB      PHE  68 -45.258  11.293  -9.104
  528    HD1  PHE  68           HD2      PHE  68 -46.006  13.223  -7.360
  529    HD2  PHE  68           HD1      PHE  68 -42.038  11.595  -7.787
  530    HE1  PHE  68           HE2      PHE  68 -45.049  15.285  -6.360
  531    HE2  PHE  68           HE1      PHE  68 -41.085  13.650  -6.768
  532    HZ   PHE  68           HZ       PHE  68 -42.589  15.500  -6.059
  533    H    LEU  69           H        LEU  69 -45.312   7.636  -7.377
  534    HA   LEU  69           HA       LEU  69 -47.780   7.119  -8.924
  535    HB2  LEU  69           2HB      LEU  69 -46.666   5.372 -10.231
  536    HB3  LEU  69           3HB      LEU  69 -46.100   6.998 -10.540
  537    HG   LEU  69           HG       LEU  69 -44.060   6.506  -9.098
  538   HD11  LEU  69          1HD1      LEU  69 -45.040   3.633  -9.415
  539   HD12  LEU  69          2HD1      LEU  69 -43.413   4.116  -8.887
  540   HD13  LEU  69          3HD1      LEU  69 -44.810   4.492  -7.879
  541   HD21  LEU  69          3HD2      LEU  69 -42.936   5.281 -10.905
  542   HD22  LEU  69          1HD2      LEU  69 -44.510   4.811 -11.584
  543   HD23  LEU  69          2HD2      LEU  69 -44.018   6.518 -11.555
  544    H    HIS  70           H        HIS  70 -47.096   7.013  -5.954
  545    HA   HIS  70           HA       HIS  70 -47.080   4.253  -5.247
  546    HB2  HIS  70           2HB      HIS  70 -47.308   4.879  -3.074
  547    HB3  HIS  70           3HB      HIS  70 -46.555   6.291  -3.770
  548    HD2  HIS  70           HD2      HIS  70 -48.926   8.071  -4.710
  549    HE1  HIS  70           HE1      HIS  70 -50.785   7.392  -0.934
  550    HE2  HIS  70           HE2      HIS  70 -50.753   8.887  -2.997
  551    H    GLY  71           H        GLY  71 -48.651   2.826  -4.522
  552    HA2  GLY  71           HA2      GLY  71 -51.377   3.210  -5.691
  553    HA3  GLY  71           HA3      GLY  71 -50.569   1.670  -5.416
  554    HA   PRO  72           HA       PRO  72 -53.435   2.847  -1.809
  555    HB2  PRO  72           2HB      PRO  72 -55.358   0.911  -2.109
  556    HB3  PRO  72           3HB      PRO  72 -55.402   2.482  -2.962
  557    HG2  PRO  72           2HG      PRO  72 -54.339  -0.167  -4.007
  558    HG3  PRO  72           3HG      PRO  72 -55.511   0.941  -4.797
  559    HD2  PRO  72           2HD      PRO  72 -52.879   1.015  -5.424
  560    HD3  PRO  72           3HD      PRO  72 -53.817   2.531  -5.281
  561    H    ARG  73           H        ARG  73 -51.635   0.135  -2.875
  562    HA   ARG  73           HA       ARG  73 -51.636  -1.158  -0.191
  563    HB2  ARG  73           2HB      ARG  73 -52.165  -2.444  -2.300
  564    HB3  ARG  73           3HB      ARG  73 -50.496  -2.222  -2.810
  565    HG2  ARG  73           2HG      ARG  73 -50.900  -3.347  -0.055
  566    HG3  ARG  73           3HG      ARG  73 -51.491  -4.353  -1.372
  567    HD2  ARG  73           2HD      ARG  73 -49.353  -4.503  -2.410
  568    HD3  ARG  73           3HD      ARG  73 -48.660  -3.251  -1.389
  569    HE   ARG  73           HE       ARG  73 -49.149  -6.064  -0.675
  570   HH11  ARG  73          2HH1      ARG  73 -48.463  -2.889   0.690
  571   HH12  ARG  73          1HH1      ARG  73 -47.756  -3.584   2.127
  572   HH21  ARG  73          1HH2      ARG  73 -48.265  -6.850   1.201
  573   HH22  ARG  73          2HH2      ARG  73 -47.670  -5.757   2.412
  574    H    THR  74           H        THR  74 -49.849   1.241  -1.721
  575    HA   THR  74           HA       THR  74 -47.196   0.353  -0.843
  576    HB   THR  74           HB       THR  74 -47.938   3.149  -1.735
  577    HG1  THR  74           HG1      THR  74 -46.859   1.436  -3.596
  578   HG21  THR  74          1HG2      THR  74 -45.655   2.988  -0.918
  579   HG22  THR  74          2HG2      THR  74 -45.378   1.483  -1.819
  580   HG23  THR  74          3HG2      THR  74 -45.579   3.028  -2.681
  581    H    GLN  75           H        GLN  75 -45.966   1.105   0.842
  582    HA   GLN  75           HA       GLN  75 -47.446   2.502   2.987
  583    HB2  GLN  75           2HB      GLN  75 -44.894   0.869   3.030
  584    HB3  GLN  75           3HB      GLN  75 -45.430   1.828   4.407
  585    HG2  GLN  75           2HG      GLN  75 -47.104  -0.366   3.118
  586    HG3  GLN  75           3HG      GLN  75 -46.065  -0.591   4.519
  587   HE21  GLN  75          2HE2      GLN  75 -48.417  -1.336   5.240
  588   HE22  GLN  75          1HE2      GLN  75 -49.310  -0.082   6.088
  589    H    ARG  76           H        ARG  76 -46.801   4.138   4.107
  590    HA   ARG  76           HA       ARG  76 -45.728   6.327   2.547
  591    HB2  ARG  76           2HB      ARG  76 -46.352   6.303   5.504
  592    HB3  ARG  76           3HB      ARG  76 -46.311   7.692   4.424
  593    HG2  ARG  76           2HG      ARG  76 -48.569   7.444   4.453
  594    HG3  ARG  76           3HG      ARG  76 -48.241   6.293   3.149
  595    HD2  ARG  76           2HD      ARG  76 -48.321   4.430   4.792
  596    HD3  ARG  76           3HD      ARG  76 -48.620   5.590   6.095
  597    HE   ARG  76           HE       ARG  76 -50.672   6.225   4.563
  598   HH11  ARG  76          2HH2      ARG  76 -49.608   2.894   5.168
  599   HH12  ARG  76          1HH2      ARG  76 -51.235   2.303   4.982
  600   HH21  ARG  76          1HH1      ARG  76 -52.668   5.340   4.327
  601   HH22  ARG  76          2HH1      ARG  76 -52.897   3.627   4.518
  602    H    ARG  77           H        ARG  77 -44.556   4.544   5.398
  603    HA   ARG  77           HA       ARG  77 -42.057   5.877   5.709
  604    HB2  ARG  77           2HB      ARG  77 -41.342   4.001   6.981
  605    HB3  ARG  77           3HB      ARG  77 -43.001   4.475   7.396
  606    HG2  ARG  77           2HG      ARG  77 -43.871   2.529   6.104
  607    HG3  ARG  77           3HG      ARG  77 -42.208   2.077   5.690
  608    HD2  ARG  77           2HD      ARG  77 -42.879   0.716   7.487
  609    HD3  ARG  77           3HD      ARG  77 -41.681   1.857   8.113
  610    HE   ARG  77           HE       ARG  77 -44.351   2.877   8.513
  611   HH11  ARG  77          1HH1      ARG  77 -42.225   0.440   9.859
  612   HH12  ARG  77          2HH1      ARG  77 -43.001   0.495  11.419
  613   HH21  ARG  77          1HH2      ARG  77 -45.289   2.903  10.529
  614   HH22  ARG  77          2HH2      ARG  77 -44.690   1.853  11.778
  615    H    ALA  78           H        ALA  78 -42.900   3.186   3.593
  616    HA   ALA  78           HA       ALA  78 -40.267   2.658   2.584
  617    HB1  ALA  78           3HB      ALA  78 -42.120   1.056   2.370
  618    HB2  ALA  78           1HB      ALA  78 -43.033   2.185   1.342
  619    HB3  ALA  78           2HB      ALA  78 -41.539   1.505   0.775
  620    H    ALA  79           H        ALA  79 -43.001   4.646   1.318
  621    HA   ALA  79           HA       ALA  79 -41.542   5.660  -0.954
  622    HB1  ALA  79           3HB      ALA  79 -43.489   7.182  -1.128
  623    HB2  ALA  79           1HB      ALA  79 -44.019   5.523  -0.788
  624    HB3  ALA  79           2HB      ALA  79 -44.001   6.737   0.513
  625    H    ALA  80           H        ALA  80 -41.961   6.915   2.347
  626    HA   ALA  80           HA       ALA  80 -40.762   9.460   1.912
  627    HB1  ALA  80           3HB      ALA  80 -41.095   7.791   4.437
  628    HB2  ALA  80           1HB      ALA  80 -40.664   9.517   4.393
  629    HB3  ALA  80           2HB      ALA  80 -42.248   8.985   3.791
  630    H    GLN  81           H        GLN  81 -39.323   6.477   3.431
  631    HA   GLN  81           HA       GLN  81 -36.639   7.339   3.593
  632    HB2  GLN  81           2HB      GLN  81 -37.866   4.625   3.036
  633    HB3  GLN  81           3HB      GLN  81 -36.122   4.863   3.201
  634    HG2  GLN  81           2HG      GLN  81 -36.336   5.702   5.458
  635    HG3  GLN  81           3HG      GLN  81 -38.098   5.711   5.356
  636   HE21  GLN  81          2HE2      GLN  81 -39.154   3.566   4.945
  637   HE22  GLN  81          1HE2      GLN  81 -38.419   2.138   5.696
  638    H    ILE  82           H        ILE  82 -38.359   5.997   0.695
  639    HA   ILE  82           HA       ILE  82 -36.024   6.164  -0.983
  640    HB   ILE  82           HB       ILE  82 -38.984   6.050  -1.523
  641   HG12  ILE  82          2HG1      ILE  82 -36.683   4.150  -2.211
  642   HG13  ILE  82          3HG1      ILE  82 -37.516   4.115  -0.654
  643   HG21  ILE  82          1HG2      ILE  82 -38.357   5.788  -3.966
  644   HG22  ILE  82          2HG2      ILE  82 -38.152   7.422  -3.320
  645   HG23  ILE  82          3HG2      ILE  82 -36.730   6.378  -3.545
  646   HD11  ILE  82          3HD1      ILE  82 -39.682   3.837  -1.847
  647   HD12  ILE  82          1HD1      ILE  82 -38.747   3.566  -3.348
  648   HD13  ILE  82          2HD1      ILE  82 -38.544   2.477  -1.956
  649    H    ALA  83           H        ALA  83 -38.717   8.521  -0.527
  650    HA   ALA  83           HA       ALA  83 -37.715  10.570  -2.153
  651    HB1  ALA  83           3HB      ALA  83 -39.933  10.509  -1.031
  652    HB2  ALA  83           1HB      ALA  83 -39.138  10.881   0.516
  653    HB3  ALA  83           2HB      ALA  83 -39.075  12.057  -0.807
  654    H    GLN  84           H        GLN  84 -36.674   9.697   1.137
  655    HA   GLN  84           HA       GLN  84 -34.905  11.984   1.460
  656    HB2  GLN  84           2HB      GLN  84 -34.548   9.323   2.862
  657    HB3  GLN  84           3HB      GLN  84 -33.952  10.903   3.325
  658    HG2  GLN  84           2HG      GLN  84 -36.695   9.770   3.609
  659    HG3  GLN  84           3HG      GLN  84 -35.691  10.460   4.818
  660   HE21  GLN  84          1HE2      GLN  84 -38.242  11.057   2.623
  661   HE22  GLN  84          2HE2      GLN  84 -38.372  12.801   2.898
  662    H    ALA  85           H        ALA  85 -34.511   8.650   0.175
  663    HA   ALA  85           HA       ALA  85 -31.635   8.823  -0.073
  664    HB1  ALA  85           3HB      ALA  85 -31.897   6.722  -1.324
  665    HB2  ALA  85           1HB      ALA  85 -32.862   6.686   0.163
  666    HB3  ALA  85           2HB      ALA  85 -33.652   6.961  -1.407
  667    H    LEU  86           H        LEU  86 -34.333   9.828  -2.110
  668    HA   LEU  86           HA       LEU  86 -32.567  10.256  -4.436
  669    HB2  LEU  86           2HB      LEU  86 -35.484  11.010  -4.187
  670    HB3  LEU  86           3HB      LEU  86 -34.491  10.910  -5.629
  671    HG   LEU  86           HG       LEU  86 -35.839   8.745  -4.063
  672   HD11  LEU  86          1HD1      LEU  86 -36.412   7.966  -6.278
  673   HD12  LEU  86          2HD1      LEU  86 -36.655   9.726  -6.199
  674   HD13  LEU  86          3HD1      LEU  86 -35.228   9.080  -7.015
  675   HD21  LEU  86          3HD2      LEU  86 -34.492   6.980  -5.283
  676   HD22  LEU  86          1HD2      LEU  86 -33.315   8.233  -5.736
  677   HD23  LEU  86          2HD2      LEU  86 -33.559   7.784  -4.035
  678    H    LEU  87           H        LEU  87 -34.190  12.201  -1.932
  679    HA   LEU  87           HA       LEU  87 -33.385  14.797  -2.693
  680    HB2  LEU  87           2HB      LEU  87 -35.017  14.515  -0.985
  681    HB3  LEU  87           3HB      LEU  87 -34.100  13.239  -0.247
  682    HG   LEU  87           HG       LEU  87 -32.377  15.167   0.427
  683   HD11  LEU  87          1HD1      LEU  87 -35.202  16.318   0.371
  684   HD12  LEU  87          2HD1      LEU  87 -33.750  17.135   1.027
  685   HD13  LEU  87          3HD1      LEU  87 -33.893  16.800  -0.722
  686   HD21  LEU  87          3HD2      LEU  87 -33.529  15.253   2.598
  687   HD22  LEU  87          1HD2      LEU  87 -34.929  14.417   1.890
  688   HD23  LEU  87          2HD2      LEU  87 -33.351  13.598   2.004
  689    H    GLY  88           H        GLY  88 -31.674  12.175  -0.988
  690    HA2  GLY  88           HA2      GLY  88 -29.342  11.829  -1.611
  691    HA3  GLY  88           HA3      GLY  88 -29.062  13.566  -1.538
  692    H    ALA  89           H        ALA  89 -30.970  12.023   1.010
  693    HA   ALA  89           HA       ALA  89 -29.178  12.799   3.114
  694    HB1  ALA  89           3HB      ALA  89 -30.680  11.440   4.524
  695    HB2  ALA  89           1HB      ALA  89 -31.603  12.484   3.427
  696    HB3  ALA  89           2HB      ALA  89 -31.437  10.746   3.076
  697    H    GLU  90           H        GLU  90 -29.827   9.589   1.627
  698    HA   GLU  90           HA       GLU  90 -27.035   8.882   1.677
  699    HB2  GLU  90           2HB      GLU  90 -27.280   6.786   2.966
  700    HB3  GLU  90           3HB      GLU  90 -27.436   8.227   3.957
  701    HG2  GLU  90           2HG      GLU  90 -29.911   7.963   3.977
  702    HG3  GLU  90           3HG      GLU  90 -29.764   6.518   2.973
  703    H    GLU  91           H        GLU  91 -26.536   7.157   0.305
  704    HA   GLU  91           HA       GLU  91 -28.512   6.213  -1.684
  705    HB2  GLU  91           2HB      GLU  91 -26.250   6.632  -2.341
  706    HB3  GLU  91           3HB      GLU  91 -25.581   5.628  -1.063
  707    HG2  GLU  91           2HG      GLU  91 -27.476   4.312  -2.984
  708    HG3  GLU  91           3HG      GLU  91 -25.918   4.833  -3.629
  709    H    ARG  92           H        ARG  92 -30.049   4.820  -0.963
  710    HA   ARG  92           HA       ARG  92 -29.286   2.430   0.612
  711    HB2  ARG  92           2HB      ARG  92 -29.914   4.267   2.207
  712    HB3  ARG  92           3HB      ARG  92 -31.477   4.400   1.416
  713    HG2  ARG  92           2HG      ARG  92 -31.752   3.145   3.448
  714    HG3  ARG  92           3HG      ARG  92 -32.008   2.056   2.091
  715    HD2  ARG  92           2HD      ARG  92 -30.736   0.940   3.827
  716    HD3  ARG  92           3HD      ARG  92 -29.718   1.132   2.394
  717    HE   ARG  92           HE       ARG  92 -29.304   3.381   4.135
  718   HH11  ARG  92          1HH2      ARG  92 -28.479  -0.042   4.126
  719   HH12  ARG  92          2HH2      ARG  92 -27.086   0.240   5.137
  720   HH21  ARG  92          2HH1      ARG  92 -27.677   3.650   5.329
  721   HH22  ARG  92          1HH1      ARG  92 -26.608   2.334   5.836
  722    H    LYS  93           H        LYS  93 -30.393   0.673   0.100
  723    HA   LYS  93           HA       LYS  93 -32.522   0.696  -1.949
  724    HB2  LYS  93           2HB      LYS  93 -30.663  -0.865  -2.109
  725    HB3  LYS  93           3HB      LYS  93 -31.143  -1.595  -0.554
  726    HG2  LYS  93           2HG      LYS  93 -33.421  -2.033  -1.779
  727    HG3  LYS  93           3HG      LYS  93 -32.510  -1.657  -3.247
  728    HD2  LYS  93           2HD      LYS  93 -31.809  -3.798  -1.208
  729    HD3  LYS  93           3HD      LYS  93 -32.592  -4.082  -2.766
  730    HE2  LYS  93           2HE      LYS  93 -30.591  -3.107  -3.918
  731    HE3  LYS  93           3HE      LYS  93 -29.792  -2.925  -2.345
  732    HZ1  LYS  93           HZ1      LYS  93 -30.654  -5.456  -3.613
  733    HZ2  LYS  93           HZ2      LYS  93 -29.103  -4.981  -3.409
  734    HZ3  LYS  93           HZ3      LYS  93 -30.004  -5.382  -2.099
  735    H    VAL  94           H        VAL  94 -34.604   0.398  -1.580
  736    HA   VAL  94           HA       VAL  94 -35.640  -0.412   1.095
  737    HB   VAL  94           HB       VAL  94 -36.830   1.923  -0.408
  738   HG11  VAL  94          1HG1      VAL  94 -36.925   1.145   2.541
  739   HG12  VAL  94          2HG1      VAL  94 -37.767   2.520   1.795
  740   HG13  VAL  94          3HG1      VAL  94 -38.222   0.882   1.357
  741   HG21  VAL  94          3HG2      VAL  94 -34.574   2.739   0.100
  742   HG22  VAL  94          1HG2      VAL  94 -35.737   3.510   1.169
  743   HG23  VAL  94          2HG2      VAL  94 -34.730   2.180   1.786
  744    H    GLU  95           H        GLU  95 -37.697  -1.320   1.037
  745    HA   GLU  95           HA       GLU  95 -38.525  -2.475  -1.546
  746    HB2  GLU  95           2HB      GLU  95 -39.994  -3.859  -0.203
  747    HB3  GLU  95           3HB      GLU  95 -38.350  -3.888   0.462
  748    HG2  GLU  95           2HG      GLU  95 -39.048  -2.210   2.195
  749    HG3  GLU  95           3HG      GLU  95 -40.694  -2.260   1.569
  750    H    ILE  96           H        ILE  96 -40.792  -2.252  -2.283
  751    HA   ILE  96           HA       ILE  96 -42.518  -0.326  -1.132
  752    HB   ILE  96           HB       ILE  96 -42.483   0.966  -3.577
  753   HG12  ILE  96          2HG1      ILE  96 -40.266   1.841  -4.044
  754   HG13  ILE  96          3HG1      ILE  96 -39.540   0.742  -2.863
  755   HG21  ILE  96          1HG2      ILE  96 -40.981   2.039  -1.221
  756   HG22  ILE  96          2HG2      ILE  96 -41.870   2.920  -2.466
  757   HG23  ILE  96          3HG2      ILE  96 -42.761   1.936  -1.309
  758   HD11  ILE  96          3HD1      ILE  96 -39.254  -0.068  -5.166
  759   HD12  ILE  96          1HD1      ILE  96 -40.226  -1.173  -4.206
  760   HD13  ILE  96          2HD1      ILE  96 -41.032  -0.104  -5.361
  761    H    ALA  97           H        ALA  97 -44.551  -0.220  -2.120
  762    HA   ALA  97           HA       ALA  97 -45.090  -2.460  -3.963
  763    HB1  ALA  97           3HB      ALA  97 -47.213  -0.735  -2.704
  764    HB2  ALA  97           1HB      ALA  97 -47.355  -2.363  -3.340
  765    HB3  ALA  97           2HB      ALA  97 -46.475  -2.087  -1.824
  766    H    PHE  98           H        PHE  98 -46.109  -2.233  -5.936
  767    HA   PHE  98           HA       PHE  98 -46.431   0.530  -7.062
  768    HB2  PHE  98           2HB      PHE  98 -45.624  -2.000  -8.529
  769    HB3  PHE  98           3HB      PHE  98 -45.913  -0.437  -9.271
  770    HD1  PHE  98           HD1      PHE  98 -44.483   1.571  -8.032
  771    HD2  PHE  98           HD2      PHE  98 -43.354  -2.587  -8.341
  772    HE1  PHE  98           HE1      PHE  98 -42.088   2.197  -7.825
  773    HE2  PHE  98           HE2      PHE  98 -40.977  -1.953  -8.158
  774    HZ   PHE  98           HZ       PHE  98 -40.338   0.442  -7.882
  775    H    TYR  99           H        TYR  99 -48.066   0.699  -8.744
  776    HA   TYR  99           HA       TYR  99 -50.025  -1.495  -8.803
  777    HB2  TYR  99           2HB      TYR  99 -51.920  -0.239  -8.655
  778    HB3  TYR  99           3HB      TYR  99 -50.930   0.328  -7.329
  779    HD1  TYR  99           HD2      TYR  99 -49.559   2.581  -7.789
  780    HD2  TYR  99           HD1      TYR  99 -52.936   1.243 -10.123
  781    HE1  TYR  99           HE2      TYR  99 -49.971   4.915  -8.556
  782    HE2  TYR  99           HE1      TYR  99 -53.332   3.572 -10.890
  783    HH   TYR  99           HH       TYR  99 -52.645   5.758 -10.783
  784    H    ARG 100           H        ARG 100 -50.801  -2.003 -10.699
  785    HA   ARG 100           HA       ARG 100 -49.425  -0.928 -13.077
  786    HB2  ARG 100           2HB      ARG 100 -49.355  -3.317 -12.401
  787    HB3  ARG 100           3HB      ARG 100 -51.093  -3.443 -12.667
  788    HG2  ARG 100           2HG      ARG 100 -50.803  -3.087 -15.060
  789    HG3  ARG 100           3HG      ARG 100 -49.086  -2.702 -14.850
  790    HD2  ARG 100           2HD      ARG 100 -50.315  -5.374 -14.098
  791    HD3  ARG 100           3HD      ARG 100 -49.594  -5.038 -15.682
  792    HE   ARG 100           HE       ARG 100 -47.538  -4.311 -14.099
  793   HH11  ARG 100          1HH2      ARG 100 -49.420  -7.268 -13.953
  794   HH12  ARG 100          2HH2      ARG 100 -48.091  -8.163 -13.262
  795   HH21  ARG 100          1HH1      ARG 100 -45.974  -5.428 -13.247
  796   HH22  ARG 100          2HH1      ARG 100 -46.145  -7.129 -12.856
  797    H    LYS 101           H        LYS 101 -50.507  -0.557 -15.059
  798    HA   LYS 101           HA       LYS 101 -52.714   1.163 -15.045
  799    HB2  LYS 101           2HB      LYS 101 -51.007   1.117 -16.729
  800    HB3  LYS 101           3HB      LYS 101 -51.387  -0.527 -17.201
  801    HG2  LYS 101           2HG      LYS 101 -53.562   1.554 -17.471
  802    HG3  LYS 101           3HG      LYS 101 -52.197   1.613 -18.591
  803    HD2  LYS 101           2HD      LYS 101 -52.535  -0.692 -19.273
  804    HD3  LYS 101           3HD      LYS 101 -53.857  -0.899 -18.120
  805    HE2  LYS 101           2HE      LYS 101 -55.168   0.861 -19.262
  806    HE3  LYS 101           3HE      LYS 101 -53.844   1.124 -20.406
  807    HZ1  LYS 101           HZ1      LYS 101 -55.543  -0.332 -21.345
  808    HZ2  LYS 101           HZ2      LYS 101 -54.152  -1.167 -21.185
  809    HZ3  LYS 101           HZ3      LYS 101 -55.380  -1.408 -20.132
  810    H    ASP 102           H        ASP 102 -52.769  -2.346 -15.305
  811    HA   ASP 102           HA       ASP 102 -55.597  -2.486 -15.992
  812    HB2  ASP 102           2HB      ASP 102 -55.344  -4.884 -15.813
  813    HB3  ASP 102           3HB      ASP 102 -54.099  -4.162 -16.820
  814    H    GLY 103           H        GLY 103 -54.063  -1.796 -13.073
  815    HA2  GLY 103           HA2      GLY 103 -55.286  -1.179 -11.143
  816    HA3  GLY 103           HA3      GLY 103 -56.503  -2.406 -11.483
  817    H    SER 104           H        SER 104 -53.557  -3.967 -11.941
  818    HA   SER 104           HA       SER 104 -53.791  -5.466  -9.479
  819    HB2  SER 104           2HB      SER 104 -51.427  -5.410 -11.391
  820    HB3  SER 104           3HB      SER 104 -51.815  -6.659 -10.199
  821    HG   SER 104           HG       SER 104 -53.167  -5.945 -12.581
  822    H    CYS 105           H        CYS 105 -52.827  -5.180  -7.507
  823    HA   CYS 105           HA       CYS 105 -50.679  -3.104  -7.217
  824    HB2  CYS 105           2HB      CYS 105 -52.916  -3.830  -5.281
  825    HB3  CYS 105           3HB      CYS 105 -51.623  -2.657  -4.985
  826    HG   CYS 105           HG       CYS 105 -53.879  -2.604  -7.431
  827    H    PHE 106           H        PHE 106 -48.784  -3.770  -6.316
  828    HA   PHE 106           HA       PHE 106 -48.682  -6.256  -4.683
  829    HB2  PHE 106           2HB      PHE 106 -46.852  -7.104  -6.280
  830    HB3  PHE 106           3HB      PHE 106 -48.528  -7.279  -6.751
  831    HD1  PHE 106           HD2      PHE 106 -45.405  -5.354  -7.446
  832    HD2  PHE 106           HD1      PHE 106 -49.456  -6.173  -8.676
  833    HE1  PHE 106           HE2      PHE 106 -45.009  -4.150  -9.586
  834    HE2  PHE 106           HE1      PHE 106 -49.058  -4.962 -10.800
  835    HZ   PHE 106           HZ       PHE 106 -46.837  -3.928 -11.251
  836    H    LEU 107           H        LEU 107 -47.068  -6.411  -3.274
  837    HA   LEU 107           HA       LEU 107 -44.767  -4.512  -3.308
  838    HB2  LEU 107           2HB      LEU 107 -46.339  -4.333  -1.363
  839    HB3  LEU 107           3HB      LEU 107 -46.068  -6.021  -1.004
  840    HG   LEU 107           HG       LEU 107 -44.937  -4.604   0.550
  841   HD11  LEU 107          1HD1      LEU 107 -42.762  -5.490   0.635
  842   HD12  LEU 107          2HD1      LEU 107 -43.690  -6.744  -0.229
  843   HD13  LEU 107          3HD1      LEU 107 -42.623  -5.618  -1.104
  844   HD21  LEU 107          3HD2      LEU 107 -44.569  -2.620  -0.748
  845   HD22  LEU 107          1HD2      LEU 107 -43.083  -3.152   0.041
  846   HD23  LEU 107          2HD2      LEU 107 -43.304  -3.484  -1.686
  847    H    CYS 108           H        CYS 108 -42.822  -5.428  -3.577
  848    HA   CYS 108           HA       CYS 108 -42.298  -8.237  -2.826
  849    HB2  CYS 108           2HB      CYS 108 -42.119  -7.081  -5.612
  850    HB3  CYS 108           3HB      CYS 108 -40.936  -8.296  -5.109
  851    HG   CYS 108           HG       CYS 108 -44.168  -8.645  -4.566
  852    H    LEU 109           H        LEU 109 -39.750  -8.574  -3.247
  853    HA   LEU 109           HA       LEU 109 -38.440  -6.543  -1.577
  854    HB2  LEU 109           2HB      LEU 109 -37.359  -9.101  -2.817
  855    HB3  LEU 109           3HB      LEU 109 -36.565  -8.122  -1.587
  856    HG   LEU 109           HG       LEU 109 -39.171  -9.672  -1.222
  857   HD11  LEU 109          1HD1      LEU 109 -37.832 -11.115   0.236
  858   HD12  LEU 109          2HD1      LEU 109 -37.172 -11.099  -1.408
  859   HD13  LEU 109          3HD1      LEU 109 -36.374 -10.162  -0.125
  860   HD21  LEU 109          3HD2      LEU 109 -39.173  -7.694   0.235
  861   HD22  LEU 109          1HD2      LEU 109 -38.881  -9.149   1.190
  862   HD23  LEU 109          2HD2      LEU 109 -37.525  -8.073   0.789
  863    H    VAL 110           H        VAL 110 -39.064  -5.029  -3.465
  864    HA   VAL 110           HA       VAL 110 -37.724  -5.079  -5.927
  865    HB   VAL 110           HB       VAL 110 -38.683  -2.599  -4.522
  866   HG11  VAL 110          1HG1      VAL 110 -38.338  -3.261  -7.478
  867   HG12  VAL 110          2HG1      VAL 110 -39.054  -1.765  -6.850
  868   HG13  VAL 110          3HG1      VAL 110 -37.356  -2.097  -6.556
  869   HG21  VAL 110          3HG2      VAL 110 -40.554  -4.197  -4.635
  870   HG22  VAL 110          1HG2      VAL 110 -40.803  -2.960  -5.849
  871   HG23  VAL 110          2HG2      VAL 110 -40.188  -4.551  -6.338
  872    H    ASP 111           H        ASP 111 -35.903  -3.973  -6.791
  873    HA   ASP 111           HA       ASP 111 -33.796  -3.778  -4.656
  874    HB2  ASP 111           2HB      ASP 111 -33.885  -5.604  -6.510
  875    HB3  ASP 111           3HB      ASP 111 -33.223  -4.347  -7.555
  876    H    VAL 112           H        VAL 112 -34.676  -1.524  -4.363
  877    HA   VAL 112           HA       VAL 112 -34.250   0.382  -6.515
  878    HB   VAL 112           HB       VAL 112 -35.031   0.905  -3.617
  879   HG11  VAL 112          1HG1      VAL 112 -36.158   2.883  -4.492
  880   HG12  VAL 112          2HG1      VAL 112 -34.465   2.960  -4.985
  881   HG13  VAL 112          3HG1      VAL 112 -35.710   2.463  -6.152
  882   HG21  VAL 112          3HG2      VAL 112 -36.765   0.215  -6.024
  883   HG22  VAL 112          1HG2      VAL 112 -36.574  -0.754  -4.552
  884   HG23  VAL 112          2HG2      VAL 112 -37.356   0.822  -4.451
  885    H    VAL 113           H        VAL 113 -31.946  -0.271  -6.642
  886    HA   VAL 113           HA       VAL 113 -30.235   1.338  -4.795
  887    HB   VAL 113           HB       VAL 113 -30.038  -1.082  -4.517
  888   HG11  VAL 113          1HG1      VAL 113 -30.334  -1.831  -6.877
  889   HG12  VAL 113          2HG1      VAL 113 -28.728  -1.177  -7.261
  890   HG13  VAL 113          3HG1      VAL 113 -28.898  -2.505  -6.101
  891   HG21  VAL 113          3HG2      VAL 113 -28.181   0.385  -3.906
  892   HG22  VAL 113          1HG2      VAL 113 -27.607  -1.189  -4.469
  893   HG23  VAL 113          2HG2      VAL 113 -27.492   0.218  -5.542
  894    HA   PRO 114           HA       PRO 114 -29.279   3.457  -8.588
  895    HB2  PRO 114           2HB      PRO 114 -27.730   5.427  -7.737
  896    HB3  PRO 114           3HB      PRO 114 -29.331   5.236  -7.023
  897    HG2  PRO 114           2HG      PRO 114 -26.744   4.191  -5.862
  898    HG3  PRO 114           3HG      PRO 114 -27.987   5.235  -5.080
  899    HD2  PRO 114           2HD      PRO 114 -28.008   2.511  -4.815
  900    HD3  PRO 114           3HD      PRO 114 -29.521   3.462  -4.914
  901    H    VAL 115           H        VAL 115 -26.870   4.672  -9.396
  902    HA   VAL 115           HA       VAL 115 -24.781   2.555  -9.317
  903    HB   VAL 115           HB       VAL 115 -24.179   3.108 -11.655
  904   HG11  VAL 115          1HG1      VAL 115 -25.844   1.615 -12.650
  905   HG12  VAL 115          2HG1      VAL 115 -25.333   1.028 -11.059
  906   HG13  VAL 115          3HG1      VAL 115 -26.907   1.826 -11.241
  907   HG21  VAL 115          3HG2      VAL 115 -25.776   4.085 -13.155
  908   HG22  VAL 115          1HG2      VAL 115 -26.971   4.273 -11.841
  909   HG23  VAL 115          2HG2      VAL 115 -25.463   5.202 -11.817
  910    H    LYS 116           H        LYS 116 -22.822   3.088  -9.011
  911    HA   LYS 116           HA       LYS 116 -22.120   5.926  -8.455
  912    HB2  LYS 116           2HB      LYS 116 -21.193   3.441  -6.964
  913    HB3  LYS 116           3HB      LYS 116 -20.765   5.081  -6.578
  914    HG2  LYS 116           2HG      LYS 116 -22.571   5.300  -5.254
  915    HG3  LYS 116           3HG      LYS 116 -23.640   4.979  -6.599
  916    HD2  LYS 116           2HD      LYS 116 -24.154   3.395  -4.870
  917    HD3  LYS 116           3HD      LYS 116 -23.425   2.538  -6.221
  918    HE2  LYS 116           2HE      LYS 116 -22.499   1.605  -4.237
  919    HE3  LYS 116           3HE      LYS 116 -21.215   2.556  -4.986
  920    HZ1  LYS 116           HZ1      LYS 116 -21.691   4.332  -3.369
  921    HZ2  LYS 116           HZ2      LYS 116 -22.930   3.446  -2.718
  922    HZ3  LYS 116           HZ3      LYS 116 -21.387   2.934  -2.578
  923    H    ASN 117           H        ASN 117 -19.875   6.384  -8.409
  924    HA   ASN 117           HA       ASN 117 -18.352   5.054 -10.613
  925    HB2  ASN 117           2HB      ASN 117 -17.120   6.995 -10.883
  926    HB3  ASN 117           3HB      ASN 117 -18.735   7.586 -10.572
  927   HD21  ASN 117          2HD2      ASN 117 -19.141   8.412  -8.229
  928   HD22  ASN 117          1HD2      ASN 117 -17.724   9.091  -7.445
  929    H    GLU 118           H        GLU 118 -15.795   5.232 -10.108
  930    HA   GLU 118           HA       GLU 118 -15.261   3.159  -8.249
  931    HB2  GLU 118           2HB      GLU 118 -12.933   3.494  -8.808
  932    HB3  GLU 118           3HB      GLU 118 -13.938   3.568 -10.253
  933    HG2  GLU 118           2HG      GLU 118 -13.803   6.067 -10.203
  934    HG3  GLU 118           3HG      GLU 118 -12.772   5.973  -8.774
  935    H    ASP 119           H        ASP 119 -15.341   6.617  -7.632
  936    HA   ASP 119           HA       ASP 119 -13.954   6.524  -5.093
  937    HB2  ASP 119           2HB      ASP 119 -14.423   8.552  -6.600
  938    HB3  ASP 119           3HB      ASP 119 -16.060   8.534  -5.945
  939    H    GLY 120           H        GLY 120 -17.102   5.450  -6.051
  940    HA2  GLY 120           HA2      GLY 120 -18.553   4.189  -4.707
  941    HA3  GLY 120           HA3      GLY 120 -17.936   4.961  -3.245
  942    H    ALA 121           H        ALA 121 -18.448   7.468  -5.368
  943    HA   ALA 121           HA       ALA 121 -20.986   8.187  -4.093
  944    HB1  ALA 121           3HB      ALA 121 -19.266   9.792  -6.031
  945    HB2  ALA 121           1HB      ALA 121 -20.562  10.409  -4.998
  946    HB3  ALA 121           2HB      ALA 121 -19.067   9.797  -4.259
  947    H    VAL 122           H        VAL 122 -22.902   8.573  -4.978
  948    HA   VAL 122           HA       VAL 122 -23.592   7.064  -7.346
  949    HB   VAL 122           HB       VAL 122 -24.957   6.886  -5.430
  950   HG11  VAL 122          1HG1      VAL 122 -25.766   9.805  -5.647
  951   HG12  VAL 122          2HG1      VAL 122 -26.380   8.591  -4.516
  952   HG13  VAL 122          3HG1      VAL 122 -24.702   9.127  -4.393
  953   HG21  VAL 122          3HG2      VAL 122 -27.135   7.186  -6.416
  954   HG22  VAL 122          1HG2      VAL 122 -26.504   8.357  -7.586
  955   HG23  VAL 122          2HG2      VAL 122 -25.974   6.672  -7.661
  956    H    ILE 123           H        ILE 123 -22.892   7.862  -9.178
  957    HA   ILE 123           HA       ILE 123 -23.310  10.702  -9.808
  958    HB   ILE 123           HB       ILE 123 -21.939  10.573 -11.563
  959   HG12  ILE 123          2HG1      ILE 123 -22.739   8.787 -12.911
  960   HG13  ILE 123          3HG1      ILE 123 -21.010   8.650 -12.694
  961   HG21  ILE 123          1HG2      ILE 123 -19.868   9.695 -10.740
  962   HG22  ILE 123          2HG2      ILE 123 -20.816  10.286  -9.363
  963   HG23  ILE 123          3HG2      ILE 123 -20.712   8.547  -9.678
  964   HD11  ILE 123          3HD1      ILE 123 -23.145   6.894 -11.449
  965   HD12  ILE 123          1HD1      ILE 123 -21.946   6.453 -12.653
  966   HD13  ILE 123          2HD1      ILE 123 -21.424   6.816 -10.999
  967    H    MET 124           H        MET 124 -24.806   7.571 -10.558
  968    HA   MET 124           HA       MET 124 -26.939   9.136 -11.940
  969    HB2  MET 124           2HB      MET 124 -25.438   6.787 -13.135
  970    HB3  MET 124           3HB      MET 124 -27.125   7.105 -13.552
  971    HG2  MET 124           2HG      MET 124 -24.721   8.854 -13.979
  972    HG3  MET 124           3HG      MET 124 -25.673   8.049 -15.207
  973    HE1  MET 124           3HE      MET 124 -24.625  11.101 -13.859
  974    HE2  MET 124           1HE      MET 124 -24.803  10.994 -15.620
  975    HE3  MET 124           2HE      MET 124 -25.691  12.245 -14.713
  976    H    PHE 125           H        PHE 125 -28.909   8.314 -11.905
  977    HA   PHE 125           HA       PHE 125 -29.541   6.440  -9.648
  978    HB2  PHE 125           2HB      PHE 125 -30.829   8.940 -10.745
  979    HB3  PHE 125           3HB      PHE 125 -31.845   7.707 -10.042
  980    HD1  PHE 125           HD1      PHE 125 -28.965   7.547  -7.991
  981    HD2  PHE 125           HD2      PHE 125 -32.334  10.056  -8.953
  982    HE1  PHE 125           HE1      PHE 125 -28.801   8.624  -5.772
  983    HE2  PHE 125           HE2      PHE 125 -32.123  11.167  -6.731
  984    HZ   PHE 125           HZ       PHE 125 -30.350  10.449  -5.148
  985    H    ILE 126           H        ILE 126 -29.165   4.623 -10.935
  986    HA   ILE 126           HA       ILE 126 -31.426   4.040 -12.810
  987    HB   ILE 126           HB       ILE 126 -28.841   2.506 -12.502
  988   HG12  ILE 126          2HG1      ILE 126 -29.749   4.513 -14.618
  989   HG13  ILE 126          3HG1      ILE 126 -28.437   4.751 -13.480
  990   HG21  ILE 126          1HG2      ILE 126 -31.088   1.343 -13.339
  991   HG22  ILE 126          2HG2      ILE 126 -30.839   2.279 -14.781
  992   HG23  ILE 126          3HG2      ILE 126 -29.594   1.127 -14.272
  993   HD11  ILE 126          3HD1      ILE 126 -27.469   4.151 -15.547
  994   HD12  ILE 126          1HD1      ILE 126 -27.286   2.757 -14.434
  995   HD13  ILE 126          2HD1      ILE 126 -28.520   2.721 -15.713
  996    H    LEU 127           H        LEU 127 -32.651   4.171 -10.790
  997    HA   LEU 127           HA       LEU 127 -32.328   1.998  -8.882
  998    HB2  LEU 127           2HB      LEU 127 -34.731   3.810  -9.163
  999    HB3  LEU 127           3HB      LEU 127 -34.255   2.818  -7.812
 1000    HG   LEU 127           HG       LEU 127 -33.389   4.641  -6.918
 1001   HD11  LEU 127          1HD1      LEU 127 -31.328   3.670  -7.385
 1002   HD12  LEU 127          2HD1      LEU 127 -31.146   4.784  -8.782
 1003   HD13  LEU 127          3HD1      LEU 127 -31.367   5.412  -7.126
 1004   HD21  LEU 127          3HD2      LEU 127 -34.639   6.065  -8.466
 1005   HD22  LEU 127          1HD2      LEU 127 -33.075   6.784  -8.061
 1006   HD23  LEU 127          2HD2      LEU 127 -33.305   5.973  -9.633
 1007    H    ASN 128           H        ASN 128 -32.283   0.259 -10.182
 1008    HA   ASN 128           HA       ASN 128 -34.186  -0.712 -12.021
 1009    HB2  ASN 128           2HB      ASN 128 -32.284  -2.110 -10.091
 1010    HB3  ASN 128           3HB      ASN 128 -33.328  -3.019 -11.169
 1011   HD21  ASN 128          2HD2      ASN 128 -30.810  -0.362 -11.383
 1012   HD22  ASN 128          1HD2      ASN 128 -30.202  -1.020 -12.886
 1013    H    PHE 129           H        PHE 129 -36.392  -0.777 -11.647
 1014    HA   PHE 129           HA       PHE 129 -37.367  -1.392  -8.954
 1015    HB2  PHE 129           2HB      PHE 129 -38.930  -0.678 -11.438
 1016    HB3  PHE 129           3HB      PHE 129 -39.519  -0.851  -9.781
 1017    HD1  PHE 129           HD1      PHE 129 -37.705   0.675  -8.104
 1018    HD2  PHE 129           HD2      PHE 129 -39.163   1.568 -12.063
 1019    HE1  PHE 129           HE1      PHE 129 -37.423   3.100  -7.663
 1020    HE2  PHE 129           HE2      PHE 129 -38.882   3.992 -11.613
 1021    HZ   PHE 129           HZ       PHE 129 -38.003   4.762  -9.417
 1022    H    GLU 130           H        GLU 130 -36.126  -3.548  -9.563
 1023    HA   GLU 130           HA       GLU 130 -37.811  -5.456 -11.022
 1024    HB2  GLU 130           2HB      GLU 130 -36.098  -7.108 -10.312
 1025    HB3  GLU 130           3HB      GLU 130 -35.550  -5.742 -11.323
 1026    HG2  GLU 130           2HG      GLU 130 -34.547  -4.626  -9.516
 1027    HG3  GLU 130           3HG      GLU 130 -35.318  -5.644  -8.322
 1028    H    VAL 131           H        VAL 131 -39.564  -5.950 -10.191
 1029    HA   VAL 131           HA       VAL 131 -40.286  -6.642  -7.467
 1030    HB   VAL 131           HB       VAL 131 -41.435  -7.205 -10.200
 1031   HG11  VAL 131          1HG1      VAL 131 -42.136  -9.146  -8.848
 1032   HG12  VAL 131          2HG1      VAL 131 -42.765  -8.034  -7.610
 1033   HG13  VAL 131          3HG1      VAL 131 -43.488  -8.074  -9.223
 1034   HG21  VAL 131          3HG2      VAL 131 -41.609  -4.902  -9.202
 1035   HG22  VAL 131          1HG2      VAL 131 -43.189  -5.666  -9.462
 1036   HG23  VAL 131          2HG2      VAL 131 -42.491  -5.590  -7.828
 1037    H    VAL 132           H        VAL 132 -39.335  -8.250  -6.344
 1038    HA   VAL 132           HA       VAL 132 -39.128 -10.881  -7.638
 1039    HB   VAL 132           HB       VAL 132 -36.952  -9.974  -8.112
 1040   HG11  VAL 132          1HG1      VAL 132 -36.536  -9.612  -5.122
 1041   HG12  VAL 132          2HG1      VAL 132 -35.314  -9.402  -6.393
 1042   HG13  VAL 132          3HG1      VAL 132 -36.700  -8.314  -6.323
 1043   HG21  VAL 132          3HG2      VAL 132 -37.146 -12.386  -7.593
 1044   HG22  VAL 132          1HG2      VAL 132 -35.551 -11.721  -7.204
 1045   HG23  VAL 132          2HG2      VAL 132 -36.706 -12.047  -5.901
 1046    H    MET 133           H        MET 133 -39.424 -12.588  -6.311
 1047    HA   MET 133           HA       MET 133 -39.748 -12.163  -3.393
 1048    HB2  MET 133           2HB      MET 133 -41.900 -13.286  -3.400
 1049    HB3  MET 133           3HB      MET 133 -41.960 -11.837  -4.390
 1050    HG2  MET 133           2HG      MET 133 -41.782 -13.165  -6.438
 1051    HG3  MET 133           3HG      MET 133 -41.607 -14.651  -5.506
 1052    HE1  MET 133           3HE      MET 133 -43.473 -15.957  -4.366
 1053    HE2  MET 133           1HE      MET 133 -43.784 -14.614  -3.242
 1054    HE3  MET 133           2HE      MET 133 -45.130 -15.368  -4.118
 1055    H    GLU 134           H        GLU 134 -40.259 -14.331  -2.330
 1056    HA   GLU 134           HA       GLU 134 -38.052 -16.107  -2.740
 1057    HB2  GLU 134           2HB      GLU 134 -38.971 -17.395  -0.912
 1058    HB3  GLU 134           3HB      GLU 134 -39.002 -15.672  -0.545
 1059    HG2  GLU 134           2HG      GLU 134 -41.443 -15.615  -1.130
 1060    HG3  GLU 134           3HG      GLU 134 -41.393 -17.354  -1.429
 1061    H    LYS 135           H        LYS 135 -38.067 -18.379  -3.101
 1062    HA   LYS 135           HA       LYS 135 -39.755 -19.142  -5.422
 1063    HB2  LYS 135           2HB      LYS 135 -37.084 -20.177  -4.409
 1064    HB3  LYS 135           3HB      LYS 135 -37.939 -20.794  -5.826
 1065    HG2  LYS 135           2HG      LYS 135 -37.828 -18.574  -6.907
 1066    HG3  LYS 135           3HG      LYS 135 -36.965 -17.913  -5.515
 1067    HD2  LYS 135           2HD      LYS 135 -35.941 -20.142  -7.326
 1068    HD3  LYS 135           3HD      LYS 135 -35.458 -18.437  -7.384
 1069    HE2  LYS 135           2HE      LYS 135 -34.682 -18.634  -4.992
 1070    HE3  LYS 135           3HE      LYS 135 -35.008 -20.372  -5.070
 1071    HZ1  LYS 135           HZ1      LYS 135 -33.093 -18.899  -6.799
 1072    HZ2  LYS 135           HZ2      LYS 135 -32.691 -19.875  -5.558
 1073    HZ3  LYS 135           HZ3      LYS 135 -33.384 -20.523  -6.893
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1 -47.590  -2.950 -47.141
    2    H2   MET   1           2H       MET   1 -47.836  -2.540 -45.578
    3    H3   MET   1           3H       MET   1 -48.861  -3.576 -46.330
    4    HA   MET   1           HA       MET   1 -46.022  -4.120 -45.752
    5    HB2  MET   1           2HB      MET   1 -48.554  -5.197 -44.428
    6    HB3  MET   1           3HB      MET   1 -46.974  -5.960 -44.274
    7    HG2  MET   1           2HG      MET   1 -46.050  -3.857 -43.317
    8    HG3  MET   1           3HG      MET   1 -47.675  -3.156 -43.350
    9    HE1  MET   1           3HE      MET   1 -47.474  -2.577 -40.776
   10    HE2  MET   1           1HE      MET   1 -47.039  -3.763 -39.526
   11    HE3  MET   1           2HE      MET   1 -45.841  -3.283 -40.748
   12    HA   PRO   2           HA       PRO   2 -46.464  -7.434 -48.787
   13    HB2  PRO   2           2HB      PRO   2 -44.465  -9.115 -48.021
   14    HB3  PRO   2           3HB      PRO   2 -44.132  -7.512 -48.743
   15    HG2  PRO   2           2HG      PRO   2 -44.215  -8.236 -45.792
   16    HG3  PRO   2           3HG      PRO   2 -42.915  -7.375 -46.678
   17    HD2  PRO   2           2HD      PRO   2 -44.827  -6.037 -45.292
   18    HD3  PRO   2           3HD      PRO   2 -44.200  -5.405 -46.843
   19    H    VAL   3           H        VAL   3 -46.802  -9.882 -48.758
   20    HA   VAL   3           HA       VAL   3 -48.872 -10.620 -46.900
   21    HB   VAL   3           HB       VAL   3 -47.283 -12.401 -48.792
   22   HG11  VAL   3          1HG1      VAL   3 -48.471 -13.763 -47.123
   23   HG12  VAL   3          2HG1      VAL   3 -49.967 -12.835 -47.398
   24   HG13  VAL   3          3HG1      VAL   3 -49.295 -13.873 -48.672
   25   HG21  VAL   3          3HG2      VAL   3 -49.251 -12.147 -50.288
   26   HG22  VAL   3          1HG2      VAL   3 -49.956 -10.971 -49.159
   27   HG23  VAL   3          2HG2      VAL   3 -48.447 -10.601 -50.021
   28    H    ARG   4           H        ARG   4 -48.796 -11.585 -44.976
   29    HA   ARG   4           HA       ARG   4 -46.159 -12.005 -43.712
   30    HB2  ARG   4           2HB      ARG   4 -48.929 -11.760 -42.484
   31    HB3  ARG   4           3HB      ARG   4 -47.399 -11.839 -41.600
   32    HG2  ARG   4           2HG      ARG   4 -46.642  -9.740 -42.728
   33    HG3  ARG   4           3HG      ARG   4 -48.207  -9.636 -43.545
   34    HD2  ARG   4           2HD      ARG   4 -48.292  -8.165 -41.659
   35    HD3  ARG   4           3HD      ARG   4 -49.353  -9.529 -41.345
   36    HE   ARG   4           HE       ARG   4 -47.966 -10.260 -39.613
   37   HH11  ARG   4          2HH2      ARG   4 -46.358  -7.572 -41.191
   38   HH12  ARG   4          1HH2      ARG   4 -45.153  -7.446 -39.939
   39   HH21  ARG   4          1HH1      ARG   4 -46.409 -10.032 -38.055
   40   HH22  ARG   4          2HH1      ARG   4 -45.194  -8.798 -38.211
   41    H    ARG   5           H        ARG   5 -47.333 -14.095 -45.476
   42    HA   ARG   5           HA       ARG   5 -47.158 -16.458 -43.656
   43    HB2  ARG   5           2HB      ARG   5 -49.223 -16.074 -45.877
   44    HB3  ARG   5           3HB      ARG   5 -48.887 -17.584 -45.052
   45    HG2  ARG   5           2HG      ARG   5 -50.719 -16.945 -43.880
   46    HG3  ARG   5           3HG      ARG   5 -49.452 -16.302 -42.849
   47    HD2  ARG   5           2HD      ARG   5 -51.244 -14.704 -43.027
   48    HD3  ARG   5           3HD      ARG   5 -49.841 -14.032 -43.861
   49    HE   ARG   5           HE       ARG   5 -51.428 -15.425 -45.770
   50   HH11  ARG   5          1HH1      ARG   5 -51.787 -12.558 -43.789
   51   HH12  ARG   5          2HH1      ARG   5 -52.832 -11.781 -44.945
   52   HH21  ARG   5          1HH2      ARG   5 -52.781 -14.384 -47.192
   53   HH22  ARG   5          2HH2      ARG   5 -53.384 -12.798 -46.813
   54    H    GLY   6           H        GLY   6 -46.482 -18.396 -44.641
   55    HA2  GLY   6           HA2      GLY   6 -45.485 -19.760 -46.239
   56    HA3  GLY   6           HA3      GLY   6 -45.444 -18.424 -47.386
   57    H    HIS   7           H        HIS   7 -44.034 -17.345 -44.524
   58    HA   HIS   7           HA       HIS   7 -41.331 -18.445 -44.975
   59    HB2  HIS   7           2HB      HIS   7 -40.275 -16.326 -45.238
   60    HB3  HIS   7           3HB      HIS   7 -41.552 -16.407 -46.437
   61    HD2  HIS   7           HD2      HIS   7 -40.299 -14.334 -43.546
   62    HE1  HIS   7           HE1      HIS   7 -44.044 -12.598 -44.620
   63    HE2  HIS   7           HE2      HIS   7 -41.931 -12.287 -43.231
   64    H    VAL   8           H        VAL   8 -39.782 -17.461 -43.295
   65    HA   VAL   8           HA       VAL   8 -41.092 -16.915 -40.683
   66    HB   VAL   8           HB       VAL   8 -40.514 -19.324 -40.850
   67   HG11  VAL   8          1HG1      VAL   8 -38.212 -20.086 -40.701
   68   HG12  VAL   8          2HG1      VAL   8 -38.446 -19.184 -42.204
   69   HG13  VAL   8          3HG1      VAL   8 -37.604 -18.426 -40.833
   70   HG21  VAL   8          3HG2      VAL   8 -38.899 -17.893 -38.714
   71   HG22  VAL   8          1HG2      VAL   8 -40.659 -18.164 -38.669
   72   HG23  VAL   8          2HG2      VAL   8 -39.545 -19.538 -38.668
   73    H    ALA   9           H        ALA   9 -39.850 -15.682 -39.210
   74    HA   ALA   9           HA       ALA   9 -38.030 -13.730 -40.312
   75    HB1  ALA   9           3HB      ALA   9 -37.860 -13.044 -37.909
   76    HB2  ALA   9           1HB      ALA   9 -39.542 -13.279 -38.411
   77    HB3  ALA   9           2HB      ALA   9 -38.718 -14.520 -37.438
   78    HA   PRO  10           HA       PRO  10 -34.057 -15.785 -39.781
   79    HB2  PRO  10           2HB      PRO  10 -32.497 -13.833 -38.540
   80    HB3  PRO  10           3HB      PRO  10 -32.846 -13.946 -40.282
   81    HG2  PRO  10           2HG      PRO  10 -34.262 -12.257 -38.198
   82    HG3  PRO  10           3HG      PRO  10 -33.721 -11.773 -39.835
   83    HD2  PRO  10           2HD      PRO  10 -36.287 -12.419 -39.342
   84    HD3  PRO  10           3HD      PRO  10 -35.506 -12.961 -40.854
   85    H    GLN  11           H        GLN  11 -34.203 -17.416 -38.421
   86    HA   GLN  11           HA       GLN  11 -35.326 -17.276 -35.874
   87    HB2  GLN  11           2HB      GLN  11 -34.987 -19.592 -35.706
   88    HB3  GLN  11           3HB      GLN  11 -35.339 -19.234 -37.387
   89    HG2  GLN  11           2HG      GLN  11 -32.607 -19.884 -36.187
   90    HG3  GLN  11           3HG      GLN  11 -33.609 -20.952 -37.158
   91   HE21  GLN  11          2HE2      GLN  11 -30.788 -19.580 -37.499
   92   HE22  GLN  11          1HE2      GLN  11 -30.891 -19.056 -39.180
   93    H    ASN  12           H        ASN  12 -31.936 -16.865 -36.669
   94    HA   ASN  12           HA       ASN  12 -30.881 -17.638 -34.075
   95    HB2  ASN  12           2HB      ASN  12 -29.778 -16.091 -36.468
   96    HB3  ASN  12           3HB      ASN  12 -28.878 -16.245 -34.963
   97   HD21  ASN  12          2HD2      ASN  12 -27.366 -17.244 -36.671
   98   HD22  ASN  12          1HD2      ASN  12 -27.515 -18.987 -36.838
   99    H    THR  13           H        THR  13 -31.572 -14.452 -35.560
  100    HA   THR  13           HA       THR  13 -31.020 -12.985 -33.104
  101    HB   THR  13           HB       THR  13 -30.725 -12.219 -35.512
  102    HG1  THR  13           HG1      THR  13 -30.454 -10.746 -33.897
  103   HG21  THR  13          1HG2      THR  13 -32.537 -11.101 -36.613
  104   HG22  THR  13          2HG2      THR  13 -33.004 -12.779 -36.267
  105   HG23  THR  13          3HG2      THR  13 -33.651 -11.466 -35.271
  106    H    PHE  14           H        PHE  14 -33.950 -14.167 -34.757
  107    HA   PHE  14           HA       PHE  14 -35.911 -12.977 -33.074
  108    HB2  PHE  14           2HB      PHE  14 -36.270 -14.175 -35.213
  109    HB3  PHE  14           3HB      PHE  14 -35.849 -15.690 -34.441
  110    HD1  PHE  14           HD2      PHE  14 -38.405 -13.009 -34.662
  111    HD2  PHE  14           HD1      PHE  14 -37.421 -16.849 -32.957
  112    HE1  PHE  14           HE2      PHE  14 -40.775 -13.315 -33.976
  113    HE2  PHE  14           HE1      PHE  14 -39.790 -17.148 -32.271
  114    HZ   PHE  14           HZ       PHE  14 -41.468 -15.383 -32.779
  115    H    LEU  15           H        LEU  15 -33.995 -15.978 -32.728
  116    HA   LEU  15           HA       LEU  15 -35.098 -16.611 -30.112
  117    HB2  LEU  15           2HB      LEU  15 -34.193 -18.398 -31.444
  118    HB3  LEU  15           3HB      LEU  15 -32.614 -17.605 -31.536
  119    HG   LEU  15           HG       LEU  15 -32.255 -17.891 -29.152
  120   HD11  LEU  15          1HD1      LEU  15 -34.583 -17.804 -28.289
  121   HD12  LEU  15          2HD1      LEU  15 -34.937 -19.353 -29.063
  122   HD13  LEU  15          3HD1      LEU  15 -33.749 -19.240 -27.731
  123   HD21  LEU  15          3HD2      LEU  15 -32.029 -20.335 -29.098
  124   HD22  LEU  15          1HD2      LEU  15 -33.150 -20.483 -30.471
  125   HD23  LEU  15          2HD2      LEU  15 -31.573 -19.690 -30.685
  126    H    ASP  16           H        ASP  16 -31.992 -15.026 -31.087
  127    HA   ASP  16           HA       ASP  16 -30.890 -14.407 -28.629
  128    HB2  ASP  16           2HB      ASP  16 -29.990 -13.839 -30.878
  129    HB3  ASP  16           3HB      ASP  16 -31.123 -12.497 -30.966
  130    H    THR  17           H        THR  17 -33.618 -12.757 -30.136
  131    HA   THR  17           HA       THR  17 -33.984 -10.699 -28.115
  132    HB   THR  17           HB       THR  17 -36.071 -11.957 -29.940
  133    HG1  THR  17           HG1      THR  17 -34.404 -11.003 -31.098
  134   HG21  THR  17          1HG2      THR  17 -37.250  -9.784 -29.652
  135   HG22  THR  17          2HG2      THR  17 -37.161 -10.705 -28.143
  136   HG23  THR  17          3HG2      THR  17 -36.067  -9.324 -28.404
  137    H    ILE  18           H        ILE  18 -35.221 -14.032 -28.361
  138    HA   ILE  18           HA       ILE  18 -36.818 -13.879 -25.926
  139    HB   ILE  18           HB       ILE  18 -35.740 -16.309 -27.366
  140   HG12  ILE  18          2HG1      ILE  18 -37.092 -15.050 -28.938
  141   HG13  ILE  18          3HG1      ILE  18 -37.803 -16.585 -28.516
  142   HG21  ILE  18          1HG2      ILE  18 -37.954 -16.033 -25.308
  143   HG22  ILE  18          2HG2      ILE  18 -37.697 -17.486 -26.304
  144   HG23  ILE  18          3HG2      ILE  18 -36.448 -16.961 -25.183
  145   HD11  ILE  18          3HD1      ILE  18 -38.631 -13.846 -27.389
  146   HD12  ILE  18          1HD1      ILE  18 -39.475 -14.727 -28.677
  147   HD13  ILE  18          2HD1      ILE  18 -39.440 -15.392 -27.035
  148    H    ILE  19           H        ILE  19 -33.474 -14.899 -26.754
  149    HA   ILE  19           HA       ILE  19 -32.739 -15.842 -24.209
  150    HB   ILE  19           HB       ILE  19 -30.984 -14.182 -26.066
  151   HG12  ILE  19          2HG1      ILE  19 -31.593 -16.086 -27.366
  152   HG13  ILE  19          3HG1      ILE  19 -29.981 -16.376 -26.764
  153   HG21  ILE  19          1HG2      ILE  19 -30.027 -14.238 -23.859
  154   HG22  ILE  19          2HG2      ILE  19 -30.300 -15.985 -23.726
  155   HG23  ILE  19          3HG2      ILE  19 -29.110 -15.341 -24.883
  156   HD11  ILE  19          3HD1      ILE  19 -31.020 -17.811 -24.941
  157   HD12  ILE  19          1HD1      ILE  19 -32.581 -17.593 -25.779
  158   HD13  ILE  19          2HD1      ILE  19 -31.250 -18.402 -26.619
  159    H    ARG  20           H        ARG  20 -32.531 -12.474 -25.499
  160    HA   ARG  20           HA       ARG  20 -31.858 -11.232 -22.983
  161    HB2  ARG  20           2HB      ARG  20 -33.105 -10.235 -25.552
  162    HB3  ARG  20           3HB      ARG  20 -32.891  -9.172 -24.151
  163    HG2  ARG  20           2HG      ARG  20 -30.511  -9.539 -24.081
  164    HG3  ARG  20           3HG      ARG  20 -30.588 -10.782 -25.344
  165    HD2  ARG  20           2HD      ARG  20 -31.468  -7.901 -25.743
  166    HD3  ARG  20           3HD      ARG  20 -29.842  -8.502 -26.110
  167    HE   ARG  20           HE       ARG  20 -31.108 -10.257 -27.556
  168   HH11  ARG  20          2HH2      ARG  20 -32.444  -7.019 -27.286
  169   HH12  ARG  20          1HH2      ARG  20 -32.955  -7.027 -28.954
  170   HH21  ARG  20          2HH1      ARG  20 -31.413 -10.023 -29.636
  171   HH22  ARG  20          1HH1      ARG  20 -32.543  -8.815 -30.248
  172    H    LYS  21           H        LYS  21 -34.936 -12.250 -24.261
  173    HA   LYS  21           HA       LYS  21 -36.550 -10.931 -22.242
  174    HB2  LYS  21           2HB      LYS  21 -37.282 -12.256 -24.450
  175    HB3  LYS  21           3HB      LYS  21 -37.384 -13.614 -23.309
  176    HG2  LYS  21           2HG      LYS  21 -39.555 -12.715 -23.405
  177    HG3  LYS  21           3HG      LYS  21 -38.892 -12.140 -21.872
  178    HD2  LYS  21           2HD      LYS  21 -38.326  -9.947 -23.046
  179    HD3  LYS  21           3HD      LYS  21 -39.153 -10.577 -24.485
  180    HE2  LYS  21           2HE      LYS  21 -41.255 -10.785 -23.199
  181    HE3  LYS  21           3HE      LYS  21 -40.425 -10.270 -21.725
  182    HZ1  LYS  21           HZ1      LYS  21 -41.583  -8.393 -22.697
  183    HZ2  LYS  21           HZ2      LYS  21 -39.998  -8.117 -22.794
  184    HZ3  LYS  21           HZ3      LYS  21 -40.819  -8.582 -24.137
  185    H    PHE  22           H        PHE  22 -34.979 -14.155 -22.196
  186    HA   PHE  22           HA       PHE  22 -35.729 -14.348 -19.320
  187    HB2  PHE  22           2HB      PHE  22 -35.515 -16.671 -19.403
  188    HB3  PHE  22           3HB      PHE  22 -36.512 -16.147 -20.734
  189    HD1  PHE  22           HD2      PHE  22 -33.027 -17.328 -19.884
  190    HD2  PHE  22           HD1      PHE  22 -36.069 -16.941 -22.909
  191    HE1  PHE  22           HE2      PHE  22 -31.700 -18.766 -21.394
  192    HE2  PHE  22           HE1      PHE  22 -34.745 -18.415 -24.415
  193    HZ   PHE  22           HZ       PHE  22 -32.564 -19.330 -23.657
  194    H    GLU  23           H        GLU  23 -33.081 -13.264 -20.883
  195    HA   GLU  23           HA       GLU  23 -30.875 -14.559 -20.136
  196    HB2  GLU  23           2HB      GLU  23 -30.937 -12.629 -21.652
  197    HB3  GLU  23           3HB      GLU  23 -31.258 -11.542 -20.313
  198    HG2  GLU  23           2HG      GLU  23 -29.022 -11.950 -19.391
  199    HG3  GLU  23           3HG      GLU  23 -28.720 -13.192 -20.616
  200    H    GLY  24           H        GLY  24 -32.684 -12.512 -17.904
  201    HA2  GLY  24           HA2      GLY  24 -32.797 -12.819 -15.604
  202    HA3  GLY  24           HA3      GLY  24 -31.265 -13.683 -15.619
  203    H    GLN  25           H        GLN  25 -30.497 -10.920 -17.191
  204    HA   GLN  25           HA       GLN  25 -30.233  -9.164 -14.769
  205    HB2  GLN  25           2HB      GLN  25 -28.351  -9.602 -17.103
  206    HB3  GLN  25           3HB      GLN  25 -28.235  -8.186 -16.072
  207    HG2  GLN  25           2HG      GLN  25 -28.155 -11.019 -14.929
  208    HG3  GLN  25           3HG      GLN  25 -26.726 -10.199 -15.536
  209   HE21  GLN  25          2HE2      GLN  25 -26.292 -10.827 -13.068
  210   HE22  GLN  25          1HE2      GLN  25 -26.577  -9.485 -11.967
  211    H    SER  26           H        SER  26 -31.645  -9.518 -17.834
  212    HA   SER  26           HA       SER  26 -31.805  -6.785 -18.717
  213    HB2  SER  26           2HB      SER  26 -33.380  -7.872 -20.380
  214    HB3  SER  26           3HB      SER  26 -31.768  -8.598 -20.288
  215    HG   SER  26           HG       SER  26 -33.563 -10.095 -20.257
  216    H    ARG  27           H        ARG  27 -33.198  -7.903 -16.042
  217    HA   ARG  27           HA       ARG  27 -35.968  -7.301 -16.294
  218    HB2  ARG  27           2HB      ARG  27 -35.940  -7.192 -13.775
  219    HB3  ARG  27           3HB      ARG  27 -35.434  -8.684 -14.540
  220    HG2  ARG  27           2HG      ARG  27 -34.089  -8.091 -12.581
  221    HG3  ARG  27           3HG      ARG  27 -33.115  -8.293 -14.033
  222    HD2  ARG  27           2HD      ARG  27 -32.784  -5.925 -14.268
  223    HD3  ARG  27           3HD      ARG  27 -34.055  -5.562 -13.098
  224    HE   ARG  27           HE       ARG  27 -32.678  -6.344 -11.287
  225   HH11  ARG  27          1HH1      ARG  27 -30.735  -6.450 -14.259
  226   HH12  ARG  27          2HH1      ARG  27 -29.351  -6.975 -13.332
  227   HH21  ARG  27          1HH2      ARG  27 -30.982  -6.820 -10.306
  228   HH22  ARG  27          2HH2      ARG  27 -29.419  -7.018 -11.115
  229    H    LYS  28           H        LYS  28 -37.115  -5.694 -15.019
  230    HA   LYS  28           HA       LYS  28 -37.022  -3.381 -16.530
  231    HB2  LYS  28           2HB      LYS  28 -38.448  -3.460 -13.859
  232    HB3  LYS  28           3HB      LYS  28 -38.931  -2.662 -15.319
  233    HG2  LYS  28           2HG      LYS  28 -40.329  -4.412 -15.589
  234    HG3  LYS  28           3HG      LYS  28 -38.959  -5.271 -16.221
  235    HD2  LYS  28           2HD      LYS  28 -38.632  -6.374 -14.024
  236    HD3  LYS  28           3HD      LYS  28 -39.766  -5.253 -13.271
  237    HE2  LYS  28           2HE      LYS  28 -40.973  -7.260 -13.538
  238    HE3  LYS  28           3HE      LYS  28 -41.600  -6.134 -14.734
  239    HZ1  LYS  28           HZ1      LYS  28 -40.247  -7.282 -16.425
  240    HZ2  LYS  28           HZ2      LYS  28 -39.661  -8.326 -15.301
  241    HZ3  LYS  28           HZ3      LYS  28 -41.241  -8.339 -15.685
  242    H    PHE  29           H        PHE  29 -36.704  -1.171 -16.232
  243    HA   PHE  29           HA       PHE  29 -35.657  -0.043 -13.822
  244    HB2  PHE  29           2HB      PHE  29 -33.343   0.388 -14.397
  245    HB3  PHE  29           3HB      PHE  29 -33.626  -1.321 -14.363
  246    HD1  PHE  29           HD1      PHE  29 -33.132   1.563 -16.725
  247    HD2  PHE  29           HD2      PHE  29 -32.971  -2.696 -16.121
  248    HE1  PHE  29           HE1      PHE  29 -32.002   1.282 -18.921
  249    HE2  PHE  29           HE2      PHE  29 -31.843  -2.973 -18.309
  250    HZ   PHE  29           HZ       PHE  29 -31.345  -0.977 -19.709
  251    H    ILE  30           H        ILE  30 -34.831   2.085 -13.948
  252    HA   ILE  30           HA       ILE  30 -35.451   3.616 -16.418
  253    HB   ILE  30           HB       ILE  30 -35.945   5.563 -14.800
  254   HG12  ILE  30          2HG1      ILE  30 -36.994   5.078 -12.695
  255   HG13  ILE  30          3HG1      ILE  30 -36.737   3.344 -12.877
  256   HG21  ILE  30          1HG2      ILE  30 -37.487   4.517 -16.343
  257   HG22  ILE  30          2HG2      ILE  30 -37.922   3.293 -15.130
  258   HG23  ILE  30          3HG2      ILE  30 -38.308   5.011 -14.847
  259   HD11  ILE  30          3HD1      ILE  30 -34.332   3.598 -12.585
  260   HD12  ILE  30          1HD1      ILE  30 -34.471   5.378 -12.648
  261   HD13  ILE  30          2HD1      ILE  30 -35.158   4.461 -11.296
  262    H    ILE  31           H        ILE  31 -34.350   5.737 -16.402
  263    HA   ILE  31           HA       ILE  31 -31.669   5.664 -15.112
  264    HB   ILE  31           HB       ILE  31 -32.254   6.951 -17.790
  265   HG12  ILE  31          2HG1      ILE  31 -32.711   4.523 -18.080
  266   HG13  ILE  31          3HG1      ILE  31 -31.333   5.116 -19.024
  267   HG21  ILE  31          1HG2      ILE  31 -29.667   6.160 -16.387
  268   HG22  ILE  31          2HG2      ILE  31 -29.787   6.911 -17.997
  269   HG23  ILE  31          3HG2      ILE  31 -30.326   7.785 -16.554
  270   HD11  ILE  31          3HD1      ILE  31 -30.969   3.800 -16.337
  271   HD12  ILE  31          1HD1      ILE  31 -30.931   2.910 -17.882
  272   HD13  ILE  31          2HD1      ILE  31 -29.731   4.164 -17.557
  273    H    ALA  32           H        ALA  32 -31.657   7.115 -13.665
  274    HA   ALA  32           HA       ALA  32 -32.885   9.775 -14.268
  275    HB1  ALA  32           3HB      ALA  32 -33.358  10.021 -11.815
  276    HB2  ALA  32           1HB      ALA  32 -34.333   8.773 -12.647
  277    HB3  ALA  32           2HB      ALA  32 -32.971   8.305 -11.624
  278    H    ASN  33           H        ASN  33 -31.892  11.652 -13.380
  279    HA   ASN  33           HA       ASN  33 -28.973  11.297 -13.245
  280    HB2  ASN  33           2HB      ASN  33 -30.059  12.824 -14.767
  281    HB3  ASN  33           3HB      ASN  33 -30.876  13.652 -13.467
  282   HD21  ASN  33          2HD2      ASN  33 -29.541  15.067 -15.203
  283   HD22  ASN  33          1HD2      ASN  33 -28.002  15.640 -14.581
  284    H    ALA  34           H        ALA  34 -27.941  11.046 -11.357
  285    HA   ALA  34           HA       ALA  34 -29.346  11.330  -8.809
  286    HB1  ALA  34           3HB      ALA  34 -27.323  10.357  -7.864
  287    HB2  ALA  34           1HB      ALA  34 -27.764   9.457  -9.327
  288    HB3  ALA  34           2HB      ALA  34 -26.432  10.640  -9.358
  289    H    ARG  35           H        ARG  35 -27.742  13.523 -10.762
  290    HA   ARG  35           HA       ARG  35 -26.527  15.125  -8.552
  291    HB2  ARG  35           2HB      ARG  35 -26.135  15.482 -11.539
  292    HB3  ARG  35           3HB      ARG  35 -25.188  16.193 -10.244
  293    HG2  ARG  35           2HG      ARG  35 -25.264  13.258 -11.055
  294    HG3  ARG  35           3HG      ARG  35 -23.948  14.394 -11.295
  295    HD2  ARG  35           2HD      ARG  35 -24.953  13.360  -8.606
  296    HD3  ARG  35           3HD      ARG  35 -23.499  12.830  -9.429
  297    HE   ARG  35           HE       ARG  35 -23.874  15.280  -7.878
  298   HH11  ARG  35          1HH1      ARG  35 -21.792  13.831 -10.303
  299   HH12  ARG  35          2HH1      ARG  35 -20.467  14.896  -9.921
  300   HH21  ARG  35          1HH2      ARG  35 -22.153  16.606  -7.463
  301   HH22  ARG  35          2HH2      ARG  35 -20.672  16.421  -8.357
  302    H    VAL  36           H        VAL  36 -29.478  15.069  -9.716
  303    HA   VAL  36           HA       VAL  36 -29.854  18.036  -9.866
  304    HB   VAL  36           HB       VAL  36 -31.908  17.467 -11.280
  305   HG11  VAL  36          1HG1      VAL  36 -29.166  16.780 -12.405
  306   HG12  VAL  36          2HG1      VAL  36 -30.597  17.258 -13.345
  307   HG13  VAL  36          3HG1      VAL  36 -29.837  18.416 -12.240
  308   HG21  VAL  36          3HG2      VAL  36 -32.090  15.120 -10.735
  309   HG22  VAL  36          1HG2      VAL  36 -32.006  15.438 -12.476
  310   HG23  VAL  36          2HG2      VAL  36 -30.575  14.826 -11.603
  311    H    GLU  37           H        GLU  37 -31.408  18.981  -8.725
  312    HA   GLU  37           HA       GLU  37 -32.307  17.679  -6.325
  313    HB2  GLU  37           2HB      GLU  37 -33.366  19.784  -5.789
  314    HB3  GLU  37           3HB      GLU  37 -31.740  20.047  -6.420
  315    HG2  GLU  37           2HG      GLU  37 -32.727  20.657  -8.641
  316    HG3  GLU  37           3HG      GLU  37 -34.342  20.435  -7.968
  317    H    ASN  38           H        ASN  38 -33.821  18.099  -9.414
  318    HA   ASN  38           HA       ASN  38 -36.508  17.329  -8.591
  319    HB2  ASN  38           2HB      ASN  38 -35.627  18.757 -10.635
  320    HB3  ASN  38           3HB      ASN  38 -35.405  17.196 -11.417
  321   HD21  ASN  38          2HD2      ASN  38 -37.653  15.757 -10.914
  322   HD22  ASN  38          1HD2      ASN  38 -39.053  16.669 -11.486
  323    H    CYS  39           H        CYS  39 -33.609  15.528  -8.927
  324    HA   CYS  39           HA       CYS  39 -33.043  13.378  -9.427
  325    HB2  CYS  39           2HB      CYS  39 -35.625  12.796  -7.930
  326    HB3  CYS  39           3HB      CYS  39 -34.215  11.733  -8.083
  327    HG   CYS  39           HG       CYS  39 -34.349  14.780  -6.739
  328    H    ALA  40           H        ALA  40 -34.271  14.502 -11.693
  329    HA   ALA  40           HA       ALA  40 -36.559  13.020 -12.462
  330    HB1  ALA  40           3HB      ALA  40 -36.469  14.333 -14.514
  331    HB2  ALA  40           1HB      ALA  40 -36.198  15.344 -13.098
  332    HB3  ALA  40           2HB      ALA  40 -34.812  14.865 -14.122
  333    H    VAL  41           H        VAL  41 -37.002  11.660 -14.096
  334    HA   VAL  41           HA       VAL  41 -35.117   9.602 -14.830
  335    HB   VAL  41           HB       VAL  41 -38.055  10.046 -15.465
  336   HG11  VAL  41          1HG1      VAL  41 -36.316   7.581 -15.886
  337   HG12  VAL  41          2HG1      VAL  41 -38.085   7.623 -16.049
  338   HG13  VAL  41          3HG1      VAL  41 -37.080   8.542 -17.168
  339   HG21  VAL  41          3HG2      VAL  41 -36.722   8.140 -13.488
  340   HG22  VAL  41          1HG2      VAL  41 -37.575   9.631 -13.051
  341   HG23  VAL  41          2HG2      VAL  41 -38.467   8.313 -13.798
  342    H    ILE  42           H        ILE  42 -33.626  10.573 -16.106
  343    HA   ILE  42           HA       ILE  42 -34.198  12.180 -18.449
  344    HB   ILE  42           HB       ILE  42 -31.788  11.951 -18.882
  345   HG12  ILE  42          2HG1      ILE  42 -31.727  10.106 -16.447
  346   HG13  ILE  42          3HG1      ILE  42 -31.493   9.594 -18.126
  347   HG21  ILE  42          1HG2      ILE  42 -32.284  12.517 -15.926
  348   HG22  ILE  42          2HG2      ILE  42 -31.023  13.214 -16.962
  349   HG23  ILE  42          3HG2      ILE  42 -32.713  13.633 -17.240
  350   HD11  ILE  42          3HD1      ILE  42 -29.365   9.741 -17.125
  351   HD12  ILE  42          1HD1      ILE  42 -29.501  11.134 -18.217
  352   HD13  ILE  42          2HD1      ILE  42 -29.692  11.339 -16.447
  353    H    TYR  43           H        TYR  43 -34.017   8.759 -17.854
  354    HA   TYR  43           HA       TYR  43 -35.117   8.218 -20.486
  355    HB2  TYR  43           2HB      TYR  43 -32.603   8.207 -20.967
  356    HB3  TYR  43           3HB      TYR  43 -32.486   6.818 -19.937
  357    HD1  TYR  43           HD2      TYR  43 -34.593   8.035 -22.820
  358    HD2  TYR  43           HD1      TYR  43 -32.590   4.690 -20.961
  359    HE1  TYR  43           HE2      TYR  43 -35.340   6.544 -24.673
  360    HE2  TYR  43           HE1      TYR  43 -33.313   3.220 -22.825
  361    HH   TYR  43           HH       TYR  43 -34.441   3.079 -24.819
  362    H    CYS  44           H        CYS  44 -35.807   5.943 -20.818
  363    HA   CYS  44           HA       CYS  44 -36.140   4.444 -18.303
  364    HB2  CYS  44           2HB      CYS  44 -38.661   4.399 -18.729
  365    HB3  CYS  44           3HB      CYS  44 -37.981   5.926 -18.147
  366    HG   CYS  44           HG       CYS  44 -38.551   5.092 -21.291
  367    H    ASN  45           H        ASN  45 -36.423   2.205 -18.511
  368    HA   ASN  45           HA       ASN  45 -35.927   1.168 -21.210
  369    HB2  ASN  45           2HB      ASN  45 -34.757   0.430 -19.079
  370    HB3  ASN  45           3HB      ASN  45 -36.229  -0.443 -18.657
  371   HD21  ASN  45          2HD2      ASN  45 -33.651  -0.144 -21.156
  372   HD22  ASN  45          1HD2      ASN  45 -33.868  -1.781 -21.749
  373    H    ASP  46           H        ASP  46 -37.076  -0.609 -22.130
  374    HA   ASP  46           HA       ASP  46 -39.948  -0.381 -22.191
  375    HB2  ASP  46           2HB      ASP  46 -38.096  -2.614 -23.123
  376    HB3  ASP  46           3HB      ASP  46 -39.811  -2.473 -23.524
  377    H    GLY  47           H        GLY  47 -37.719  -2.348 -20.241
  378    HA2  GLY  47           HA2      GLY  47 -39.494  -4.156 -19.029
  379    HA3  GLY  47           HA3      GLY  47 -38.086  -3.422 -18.261
  380    H    PHE  48           H        PHE  48 -38.820  -0.732 -17.893
  381    HA   PHE  48           HA       PHE  48 -40.748  -0.712 -15.785
  382    HB2  PHE  48           2HB      PHE  48 -39.752   1.297 -15.571
  383    HB3  PHE  48           3HB      PHE  48 -39.145   1.273 -17.215
  384    HD1  PHE  48           HD2      PHE  48 -42.116   2.190 -15.126
  385    HD2  PHE  48           HD1      PHE  48 -40.218   2.559 -18.982
  386    HE1  PHE  48           HE2      PHE  48 -43.964   3.641 -15.905
  387    HE2  PHE  48           HE1      PHE  48 -42.065   4.009 -19.752
  388    HZ   PHE  48           HZ       PHE  48 -43.960   4.531 -18.229
  389    H    CYS  49           H        CYS  49 -41.095  -0.270 -19.264
  390    HA   CYS  49           HA       CYS  49 -43.814   0.703 -19.220
  391    HB2  CYS  49           2HB      CYS  49 -42.102   0.882 -21.124
  392    HB3  CYS  49           3HB      CYS  49 -42.549  -0.789 -21.541
  393    HG   CYS  49           HG       CYS  49 -43.804   0.855 -23.137
  394    H    GLU  50           H        GLU  50 -42.397  -2.575 -19.395
  395    HA   GLU  50           HA       GLU  50 -44.995  -3.927 -19.557
  396    HB2  GLU  50           2HB      GLU  50 -42.238  -5.013 -18.862
  397    HB3  GLU  50           3HB      GLU  50 -43.681  -5.972 -19.211
  398    HG2  GLU  50           2HG      GLU  50 -43.806  -4.929 -21.485
  399    HG3  GLU  50           3HG      GLU  50 -42.290  -4.095 -21.166
  400    H    LEU  51           H        LEU  51 -42.831  -2.938 -16.946
  401    HA   LEU  51           HA       LEU  51 -43.953  -4.440 -14.813
  402    HB2  LEU  51           2HB      LEU  51 -41.815  -3.199 -14.792
  403    HB3  LEU  51           3HB      LEU  51 -42.658  -1.684 -14.871
  404    HG   LEU  51           HG       LEU  51 -43.736  -2.070 -12.710
  405   HD11  LEU  51          1HD1      LEU  51 -41.881  -4.475 -12.491
  406   HD12  LEU  51          2HD1      LEU  51 -42.851  -3.775 -11.180
  407   HD13  LEU  51          3HD1      LEU  51 -43.662  -4.526 -12.557
  408   HD21  LEU  51          3HD2      LEU  51 -41.728  -1.641 -11.369
  409   HD22  LEU  51          1HD2      LEU  51 -40.710  -2.227 -12.711
  410   HD23  LEU  51          2HD2      LEU  51 -41.697  -0.753 -12.902
  411    H    CYS  52           H        CYS  52 -44.566  -1.026 -15.739
  412    HA   CYS  52           HA       CYS  52 -46.933  -0.953 -13.959
  413    HB2  CYS  52           2HB      CYS  52 -45.441   1.266 -15.409
  414    HB3  CYS  52           3HB      CYS  52 -46.722   1.453 -14.186
  415    HG   CYS  52           HG       CYS  52 -44.391   2.038 -13.123
  416    H    GLY  53           H        GLY  53 -46.292  -1.153 -17.381
  417    HA2  GLY  53           HA2      GLY  53 -47.813  -1.452 -19.106
  418    HA3  GLY  53           HA3      GLY  53 -49.143  -1.298 -17.963
  419    H    TYR  54           H        TYR  54 -46.944   1.405 -17.988
  420    HA   TYR  54           HA       TYR  54 -48.995   3.095 -19.299
  421    HB2  TYR  54           2HB      TYR  54 -46.572   3.824 -17.629
  422    HB3  TYR  54           3HB      TYR  54 -47.711   4.973 -18.323
  423    HD1  TYR  54           HD2      TYR  54 -50.298   4.456 -17.807
  424    HD2  TYR  54           HD1      TYR  54 -46.928   3.344 -15.359
  425    HE1  TYR  54           HE2      TYR  54 -51.797   4.260 -15.826
  426    HE2  TYR  54           HE1      TYR  54 -48.439   3.100 -13.386
  427    HH   TYR  54           HH       TYR  54 -50.591   3.233 -12.619
  428    H    SER  55           H        SER  55 -46.278   4.836 -19.654
  429    HA   SER  55           HA       SER  55 -45.238   3.849 -22.188
  430    HB2  SER  55           2HB      SER  55 -47.375   4.782 -22.961
  431    HB3  SER  55           3HB      SER  55 -47.046   6.305 -22.117
  432    HG   SER  55           HG       SER  55 -46.505   6.297 -24.402
  433    H    ARG  56           H        ARG  56 -43.449   5.126 -22.874
  434    HA   ARG  56           HA       ARG  56 -41.730   6.226 -20.844
  435    HB2  ARG  56           2HB      ARG  56 -41.727   6.692 -23.874
  436    HB3  ARG  56           3HB      ARG  56 -40.440   7.148 -22.755
  437    HG2  ARG  56           2HG      ARG  56 -40.318   4.656 -22.101
  438    HG3  ARG  56           3HG      ARG  56 -41.327   4.330 -23.506
  439    HD2  ARG  56           2HD      ARG  56 -39.668   5.064 -25.037
  440    HD3  ARG  56           3HD      ARG  56 -38.855   6.049 -23.828
  441    HE   ARG  56           HE       ARG  56 -37.633   4.261 -23.062
  442   HH11  ARG  56          1HH1      ARG  56 -40.052   2.874 -25.214
  443   HH12  ARG  56          2HH1      ARG  56 -39.271   1.306 -25.155
  444   HH21  ARG  56          1HH2      ARG  56 -36.682   2.394 -23.175
  445   HH22  ARG  56          2HH2      ARG  56 -37.313   1.082 -24.184
  446    H    ALA  57           H        ALA  57 -43.983   7.879 -23.040
  447    HA   ALA  57           HA       ALA  57 -43.258  10.559 -22.421
  448    HB1  ALA  57           3HB      ALA  57 -44.610   9.860 -24.365
  449    HB2  ALA  57           1HB      ALA  57 -45.936   9.374 -23.281
  450    HB3  ALA  57           2HB      ALA  57 -45.464  11.083 -23.404
  451    H    GLU  58           H        GLU  58 -45.036   8.245 -20.497
  452    HA   GLU  58           HA       GLU  58 -46.286  10.231 -18.730
  453    HB2  GLU  58           2HB      GLU  58 -46.099   7.212 -18.449
  454    HB3  GLU  58           3HB      GLU  58 -47.175   8.283 -17.582
  455    HG2  GLU  58           2HG      GLU  58 -47.300   7.949 -20.618
  456    HG3  GLU  58           3HG      GLU  58 -48.164   6.921 -19.518
  457    H    VAL  59           H        VAL  59 -43.239   8.520 -18.917
  458    HA   VAL  59           HA       VAL  59 -42.602   9.258 -16.082
  459    HB   VAL  59           HB       VAL  59 -40.673   7.696 -16.294
  460   HG11  VAL  59          1HG1      VAL  59 -42.002   5.729 -15.795
  461   HG12  VAL  59          2HG1      VAL  59 -42.763   7.151 -15.073
  462   HG13  VAL  59          3HG1      VAL  59 -43.437   6.453 -16.562
  463   HG21  VAL  59          3HG2      VAL  59 -40.692   5.937 -17.915
  464   HG22  VAL  59          1HG2      VAL  59 -42.143   6.595 -18.692
  465   HG23  VAL  59          2HG2      VAL  59 -40.605   7.494 -18.754
  466    H    MET  60           H        MET  60 -41.742   9.998 -19.374
  467    HA   MET  60           HA       MET  60 -39.190  10.832 -19.303
  468    HB2  MET  60           2HB      MET  60 -41.652  11.756 -20.755
  469    HB3  MET  60           3HB      MET  60 -40.281  12.852 -20.811
  470    HG2  MET  60           2HG      MET  60 -40.126   9.947 -21.635
  471    HG3  MET  60           3HG      MET  60 -40.375  11.306 -22.722
  472    HE1  MET  60           3HE      MET  60 -37.935   8.838 -22.005
  473    HE2  MET  60           1HE      MET  60 -36.445   9.610 -21.420
  474    HE3  MET  60           2HE      MET  60 -37.847   9.444 -20.337
  475    H    GLN  61           H        GLN  61 -38.201  11.799 -17.711
  476    HA   GLN  61           HA       GLN  61 -37.331  13.464 -16.545
  477    HB2  GLN  61           2HB      GLN  61 -39.075  15.358 -18.125
  478    HB3  GLN  61           3HB      GLN  61 -37.566  15.743 -17.311
  479    HG2  GLN  61           2HG      GLN  61 -36.247  14.796 -18.969
  480    HG3  GLN  61           3HG      GLN  61 -37.403  13.538 -19.373
  481   HE21  GLN  61          2HE2      GLN  61 -37.895  13.693 -21.488
  482   HE22  GLN  61          1HE2      GLN  61 -38.403  15.178 -22.264
  483    H    ARG  62           H        ARG  62 -39.957  12.161 -15.633
  484    HA   ARG  62           HA       ARG  62 -40.808  14.094 -13.548
  485    HB2  ARG  62           2HB      ARG  62 -41.569  11.231 -14.317
  486    HB3  ARG  62           3HB      ARG  62 -41.912  11.814 -12.710
  487    HG2  ARG  62           2HG      ARG  62 -43.864  12.388 -13.530
  488    HG3  ARG  62           3HG      ARG  62 -43.039  13.861 -14.013
  489    HD2  ARG  62           2HD      ARG  62 -43.144  11.491 -15.895
  490    HD3  ARG  62           3HD      ARG  62 -44.590  12.461 -15.680
  491    HE   ARG  62           HE       ARG  62 -42.137  13.229 -17.078
  492   HH11  ARG  62          2HH2      ARG  62 -45.037  14.592 -15.637
  493   HH12  ARG  62          1HH2      ARG  62 -44.902  16.045 -16.589
  494   HH21  ARG  62          1HH1      ARG  62 -42.035  14.998 -18.208
  495   HH22  ARG  62          2HH1      ARG  62 -43.216  16.287 -18.034
  496    HA   PRO  63           HA       PRO  63 -37.903  12.745 -10.449
  497    HB2  PRO  63           2HB      PRO  63 -40.234  12.184  -8.626
  498    HB3  PRO  63           3HB      PRO  63 -38.745  13.128  -8.306
  499    HG2  PRO  63           2HG      PRO  63 -41.102  14.381  -8.809
  500    HG3  PRO  63           3HG      PRO  63 -39.579  14.995  -9.523
  501    HD2  PRO  63           2HD      PRO  63 -41.703  13.268 -10.819
  502    HD3  PRO  63           3HD      PRO  63 -40.863  14.704 -11.475
  503    H    CYS  64           H        CYS  64 -36.891  10.858 -10.007
  504    HA   CYS  64           HA       CYS  64 -37.951   8.249 -10.609
  505    HB2  CYS  64           2HB      CYS  64 -35.578   9.042 -10.742
  506    HB3  CYS  64           3HB      CYS  64 -35.521   9.110  -8.982
  507    HG   CYS  64           HG       CYS  64 -36.354   6.514  -8.764
  508    H    THR  65           H        THR  65 -38.485  10.223  -7.889
  509    HA   THR  65           HA       THR  65 -38.619   8.498  -5.716
  510    HB   THR  65           HB       THR  65 -40.513  10.834  -6.056
  511    HG1  THR  65           HG1      THR  65 -38.821  12.174  -5.445
  512   HG21  THR  65          1HG2      THR  65 -39.935  11.173  -3.674
  513   HG22  THR  65          2HG2      THR  65 -40.564   9.540  -3.933
  514   HG23  THR  65          3HG2      THR  65 -38.815   9.793  -3.748
  515    H    CYS  66           H        CYS  66 -39.550   6.623  -6.139
  516    HA   CYS  66           HA       CYS  66 -41.778   5.837  -7.413
  517    HB2  CYS  66           2HB      CYS  66 -41.023   4.681  -4.701
  518    HB3  CYS  66           3HB      CYS  66 -41.863   3.854  -6.027
  519    HG   CYS  66           HG       CYS  66 -39.889   4.060  -7.773
  520    H    ASP  67           H        ASP  67 -42.105   7.856  -4.680
  521    HA   ASP  67           HA       ASP  67 -44.756   7.350  -3.758
  522    HB2  ASP  67           2HB      ASP  67 -43.141   8.997  -2.799
  523    HB3  ASP  67           3HB      ASP  67 -43.279   9.974  -4.254
  524    H    PHE  68           H        PHE  68 -43.550   8.995  -6.705
  525    HA   PHE  68           HA       PHE  68 -45.977   9.955  -7.831
  526    HB2  PHE  68           2HB      PHE  68 -43.736  10.533  -8.626
  527    HB3  PHE  68           3HB      PHE  68 -43.409   8.858  -9.046
  528    HD1  PHE  68           HD1      PHE  68 -45.833  11.634  -9.862
  529    HD2  PHE  68           HD2      PHE  68 -43.680   8.171 -11.274
  530    HE1  PHE  68           HE1      PHE  68 -46.690  12.032 -12.161
  531    HE2  PHE  68           HE2      PHE  68 -44.533   8.580 -13.572
  532    HZ   PHE  68           HZ       PHE  68 -46.044  10.501 -14.016
  533    H    LEU  69           H        LEU  69 -44.901   6.702  -7.399
  534    HA   LEU  69           HA       LEU  69 -46.992   5.581  -9.180
  535    HB2  LEU  69           2HB      LEU  69 -44.266   5.301  -9.439
  536    HB3  LEU  69           3HB      LEU  69 -44.604   3.951  -8.393
  537    HG   LEU  69           HG       LEU  69 -44.479   3.305 -10.718
  538   HD11  LEU  69          1HD1      LEU  69 -46.075   2.069  -9.304
  539   HD12  LEU  69          2HD1      LEU  69 -47.392   3.109  -9.895
  540   HD13  LEU  69          3HD1      LEU  69 -46.512   2.053 -11.021
  541   HD21  LEU  69          3HD2      LEU  69 -46.870   5.090 -11.315
  542   HD22  LEU  69          1HD2      LEU  69 -45.185   5.454 -11.740
  543   HD23  LEU  69          2HD2      LEU  69 -45.994   4.046 -12.445
  544    H    HIS  70           H        HIS  70 -47.043   6.411  -6.123
  545    HA   HIS  70           HA       HIS  70 -47.341   3.852  -4.806
  546    HB2  HIS  70           2HB      HIS  70 -47.794   4.957  -2.888
  547    HB3  HIS  70           3HB      HIS  70 -46.867   6.176  -3.720
  548    HD2  HIS  70           HD2      HIS  70 -50.277   5.404  -2.252
  549    HE1  HIS  70           HE1      HIS  70 -50.629   9.368  -3.785
  550    HE2  HIS  70           HE2      HIS  70 -51.764   7.578  -2.374
  551    H    GLY  71           H        GLY  71 -49.135   2.688  -4.271
  552    HA2  GLY  71           HA2      GLY  71 -51.806   3.452  -5.375
  553    HA3  GLY  71           HA3      GLY  71 -51.094   1.881  -5.740
  554    HA   PRO  72           HA       PRO  72 -53.873   1.910  -1.997
  555    HB2  PRO  72           2HB      PRO  72 -54.794  -0.682  -3.248
  556    HB3  PRO  72           3HB      PRO  72 -55.766   0.588  -2.442
  557    HG2  PRO  72           2HG      PRO  72 -55.709   0.457  -5.136
  558    HG3  PRO  72           3HG      PRO  72 -55.540   2.053  -4.331
  559    HD2  PRO  72           2HD      PRO  72 -53.351   0.265  -5.435
  560    HD3  PRO  72           3HD      PRO  72 -53.596   2.022  -5.659
  561    H    ARG  73           H        ARG  73 -51.487  -0.357  -2.963
  562    HA   ARG  73           HA       ARG  73 -51.408  -1.627  -0.247
  563    HB2  ARG  73           2HB      ARG  73 -50.487  -2.639  -2.961
  564    HB3  ARG  73           3HB      ARG  73 -49.982  -3.382  -1.436
  565    HG2  ARG  73           2HG      ARG  73 -52.310  -3.794  -0.793
  566    HG3  ARG  73           3HG      ARG  73 -52.891  -3.032  -2.285
  567    HD2  ARG  73           2HD      ARG  73 -51.794  -4.739  -3.632
  568    HD3  ARG  73           3HD      ARG  73 -51.104  -5.496  -2.188
  569    HE   ARG  73           HE       ARG  73 -53.620  -5.698  -1.483
  570   HH11  ARG  73          1HH1      ARG  73 -52.507  -6.235  -4.795
  571   HH12  ARG  73          2HH1      ARG  73 -53.786  -7.383  -5.092
  572   HH21  ARG  73          2HH2      ARG  73 -55.215  -7.125  -1.987
  573   HH22  ARG  73          1HH2      ARG  73 -55.276  -7.847  -3.567
  574    H    THR  74           H        THR  74 -49.922   0.932  -1.781
  575    HA   THR  74           HA       THR  74 -47.179   0.247  -1.063
  576    HB   THR  74           HB       THR  74 -48.146   3.019  -1.737
  577    HG1  THR  74           HG1      THR  74 -47.056   1.399  -3.705
  578   HG21  THR  74          1HG2      THR  74 -45.487   1.551  -2.043
  579   HG22  THR  74          2HG2      THR  74 -45.838   3.129  -2.789
  580   HG23  THR  74          3HG2      THR  74 -45.822   2.971  -1.030
  581    H    GLN  75           H        GLN  75 -45.964   0.825   0.578
  582    HA   GLN  75           HA       GLN  75 -47.206   1.951   3.003
  583    HB2  GLN  75           2HB      GLN  75 -44.463   0.888   2.382
  584    HB3  GLN  75           3HB      GLN  75 -44.900   1.539   3.944
  585    HG2  GLN  75           2HG      GLN  75 -46.386  -0.217   4.446
  586    HG3  GLN  75           3HG      GLN  75 -46.459  -0.779   2.766
  587   HE21  GLN  75          2HE2      GLN  75 -44.733  -2.129   1.955
  588   HE22  GLN  75          1HE2      GLN  75 -43.463  -2.738   3.009
  589    H    ARG  76           H        ARG  76 -46.970   3.914   3.682
  590    HA   ARG  76           HA       ARG  76 -45.797   6.010   2.004
  591    HB2  ARG  76           2HB      ARG  76 -46.812   6.306   4.832
  592    HB3  ARG  76           3HB      ARG  76 -46.606   7.583   3.634
  593    HG2  ARG  76           2HG      ARG  76 -48.695   5.363   3.631
  594    HG3  ARG  76           3HG      ARG  76 -48.960   7.093   3.822
  595    HD2  ARG  76           2HD      ARG  76 -48.173   7.459   1.472
  596    HD3  ARG  76           3HD      ARG  76 -47.932   5.723   1.297
  597    HE   ARG  76           HE       ARG  76 -50.227   5.336   1.220
  598   HH11  ARG  76          1HH1      ARG  76 -49.730   8.764   1.775
  599   HH12  ARG  76          2HH1      ARG  76 -51.387   9.153   1.402
  600   HH21  ARG  76          1HH2      ARG  76 -52.321   5.905   0.773
  601   HH22  ARG  76          2HH2      ARG  76 -52.811   7.570   0.864
  602    H    ARG  77           H        ARG  77 -44.859   4.530   5.086
  603    HA   ARG  77           HA       ARG  77 -42.386   5.885   5.486
  604    HB2  ARG  77           2HB      ARG  77 -41.730   3.970   6.806
  605    HB3  ARG  77           3HB      ARG  77 -43.403   4.437   7.146
  606    HG2  ARG  77           2HG      ARG  77 -44.197   2.539   5.744
  607    HG3  ARG  77           3HG      ARG  77 -42.508   2.046   5.480
  608    HD2  ARG  77           2HD      ARG  77 -42.288   1.838   7.990
  609    HD3  ARG  77           3HD      ARG  77 -44.045   2.120   8.095
  610    HE   ARG  77           HE       ARG  77 -43.611   0.008   6.239
  611   HH11  ARG  77          1HH1      ARG  77 -43.255   0.445   9.705
  612   HH12  ARG  77          2HH1      ARG  77 -43.478  -1.257  10.011
  613   HH21  ARG  77          1HH2      ARG  77 -43.883  -2.037   6.667
  614   HH22  ARG  77          2HH2      ARG  77 -43.831  -2.664   8.308
  615    H    ALA  78           H        ALA  78 -43.109   3.210   3.312
  616    HA   ALA  78           HA       ALA  78 -40.370   2.721   2.492
  617    HB1  ALA  78           3HB      ALA  78 -41.408   1.474   0.661
  618    HB2  ALA  78           1HB      ALA  78 -42.145   1.029   2.195
  619    HB3  ALA  78           2HB      ALA  78 -42.984   2.080   1.015
  620    H    ALA  79           H        ALA  79 -43.088   4.591   1.046
  621    HA   ALA  79           HA       ALA  79 -41.541   5.609  -1.169
  622    HB1  ALA  79           3HB      ALA  79 -44.013   6.764   0.208
  623    HB2  ALA  79           1HB      ALA  79 -43.433   7.171  -1.415
  624    HB3  ALA  79           2HB      ALA  79 -44.031   5.533  -1.080
  625    H    ALA  80           H        ALA  80 -42.071   6.854   2.119
  626    HA   ALA  80           HA       ALA  80 -40.746   9.342   1.793
  627    HB1  ALA  80           3HB      ALA  80 -42.309   8.844   3.613
  628    HB2  ALA  80           1HB      ALA  80 -41.198   7.616   4.261
  629    HB3  ALA  80           2HB      ALA  80 -40.733   9.333   4.272
  630    H    GLN  81           H        GLN  81 -39.460   6.250   3.237
  631    HA   GLN  81           HA       GLN  81 -36.750   7.007   3.525
  632    HB2  GLN  81           2HB      GLN  81 -38.090   4.370   2.891
  633    HB3  GLN  81           3HB      GLN  81 -36.334   4.509   3.050
  634    HG2  GLN  81           2HG      GLN  81 -36.480   5.302   5.320
  635    HG3  GLN  81           3HG      GLN  81 -38.237   5.445   5.232
  636   HE21  GLN  81          2HE2      GLN  81 -39.480   3.428   4.899
  637   HE22  GLN  81          1HE2      GLN  81 -38.836   1.922   5.577
  638    H    ILE  82           H        ILE  82 -38.414   5.865   0.533
  639    HA   ILE  82           HA       ILE  82 -36.017   5.941  -1.068
  640    HB   ILE  82           HB       ILE  82 -38.964   5.960  -1.670
  641   HG12  ILE  82          2HG1      ILE  82 -36.722   4.044  -2.487
  642   HG13  ILE  82          3HG1      ILE  82 -37.515   3.938  -0.913
  643   HG21  ILE  82          1HG2      ILE  82 -38.343   5.818  -4.115
  644   HG22  ILE  82          2HG2      ILE  82 -38.071   7.408  -3.387
  645   HG23  ILE  82          3HG2      ILE  82 -36.693   6.323  -3.665
  646   HD11  ILE  82          3HD1      ILE  82 -38.572   2.395  -2.354
  647   HD12  ILE  82          1HD1      ILE  82 -39.706   3.733  -2.010
  648   HD13  ILE  82          2HD1      ILE  82 -38.884   3.633  -3.590
  649    H    ALA  83           H        ALA  83 -38.599   8.427  -0.622
  650    HA   ALA  83           HA       ALA  83 -37.384  10.480  -2.114
  651    HB1  ALA  83           3HB      ALA  83 -39.647  10.565  -1.076
  652    HB2  ALA  83           1HB      ALA  83 -38.888  10.779   0.516
  653    HB3  ALA  83           2HB      ALA  83 -38.664  12.015  -0.726
  654    H    GLN  84           H        GLN  84 -36.607   9.410   1.189
  655    HA   GLN  84           HA       GLN  84 -34.708  11.510   1.769
  656    HB2  GLN  84           2HB      GLN  84 -34.605   8.756   2.993
  657    HB3  GLN  84           3HB      GLN  84 -33.922  10.252   3.580
  658    HG2  GLN  84           2HG      GLN  84 -36.745   9.330   3.714
  659    HG3  GLN  84           3HG      GLN  84 -35.721   9.908   4.979
  660   HE21  GLN  84          1HE2      GLN  84 -38.132  10.786   2.693
  661   HE22  GLN  84          2HE2      GLN  84 -38.136  12.519   3.052
  662    H    ALA  85           H        ALA  85 -34.416   8.293   0.211
  663    HA   ALA  85           HA       ALA  85 -31.532   8.448   0.012
  664    HB1  ALA  85           3HB      ALA  85 -32.773   6.293   0.039
  665    HB2  ALA  85           1HB      ALA  85 -33.549   6.720  -1.503
  666    HB3  ALA  85           2HB      ALA  85 -31.798   6.460  -1.436
  667    H    LEU  86           H        LEU  86 -34.165   9.591  -2.011
  668    HA   LEU  86           HA       LEU  86 -32.373  10.132  -4.240
  669    HB2  LEU  86           2HB      LEU  86 -35.214  11.108  -3.899
  670    HB3  LEU  86           3HB      LEU  86 -34.245  11.042  -5.360
  671    HG   LEU  86           HG       LEU  86 -35.765   8.893  -3.969
  672   HD11  LEU  86          1HD1      LEU  86 -36.440  10.019  -6.083
  673   HD12  LEU  86          2HD1      LEU  86 -34.998   9.362  -6.871
  674   HD13  LEU  86          3HD1      LEU  86 -36.258   8.259  -6.269
  675   HD21  LEU  86          3HD2      LEU  86 -34.552   7.083  -5.176
  676   HD22  LEU  86          1HD2      LEU  86 -33.254   8.228  -5.591
  677   HD23  LEU  86          2HD2      LEU  86 -33.566   7.761  -3.905
  678    H    LEU  87           H        LEU  87 -33.898  12.178  -1.713
  679    HA   LEU  87           HA       LEU  87 -32.552  14.591  -2.637
  680    HB2  LEU  87           2HB      LEU  87 -32.971  15.537  -0.423
  681    HB3  LEU  87           3HB      LEU  87 -34.404  14.945  -1.262
  682    HG   LEU  87           HG       LEU  87 -33.793  12.816   0.358
  683   HD11  LEU  87          1HD1      LEU  87 -33.174  15.308   1.979
  684   HD12  LEU  87          2HD1      LEU  87 -33.367  13.655   2.598
  685   HD13  LEU  87          3HD1      LEU  87 -31.995  14.055   1.540
  686   HD21  LEU  87          3HD2      LEU  87 -36.012  13.906   0.108
  687   HD22  LEU  87          1HD2      LEU  87 -35.626  13.657   1.815
  688   HD23  LEU  87          2HD2      LEU  87 -35.453  15.270   1.095
  689    H    GLY  88           H        GLY  88 -31.520  11.881  -0.611
  690    HA2  GLY  88           HA2      GLY  88 -29.207  11.276  -0.894
  691    HA3  GLY  88           HA3      GLY  88 -28.733  12.973  -0.907
  692    H    ALA  89           H        ALA  89 -31.081  11.999   1.515
  693    HA   ALA  89           HA       ALA  89 -29.443  12.552   3.774
  694    HB1  ALA  89           3HB      ALA  89 -31.786  10.634   3.545
  695    HB2  ALA  89           1HB      ALA  89 -31.135  11.304   5.050
  696    HB3  ALA  89           2HB      ALA  89 -31.903  12.383   3.872
  697    H    GLU  90           H        GLU  90 -30.242   9.428   2.214
  698    HA   GLU  90           HA       GLU  90 -27.540   8.499   2.298
  699    HB2  GLU  90           2HB      GLU  90 -27.975   6.372   3.492
  700    HB3  GLU  90           3HB      GLU  90 -27.857   7.793   4.521
  701    HG2  GLU  90           2HG      GLU  90 -30.375   7.881   4.656
  702    HG3  GLU  90           3HG      GLU  90 -30.445   6.375   3.743
  703    H    GLU  91           H        GLU  91 -27.197   7.217   0.627
  704    HA   GLU  91           HA       GLU  91 -29.302   6.348  -1.277
  705    HB2  GLU  91           2HB      GLU  91 -27.265   7.130  -2.147
  706    HB3  GLU  91           3HB      GLU  91 -26.270   6.144  -1.086
  707    HG2  GLU  91           2HG      GLU  91 -28.209   4.771  -2.936
  708    HG3  GLU  91           3HG      GLU  91 -26.816   5.566  -3.659
  709    H    ARG  92           H        ARG  92 -30.481   4.664  -0.890
  710    HA   ARG  92           HA       ARG  92 -29.483   2.211   0.442
  711    HB2  ARG  92           2HB      ARG  92 -30.136   3.705   2.286
  712    HB3  ARG  92           3HB      ARG  92 -31.670   4.063   1.501
  713    HG2  ARG  92           2HG      ARG  92 -32.085   2.568   3.327
  714    HG3  ARG  92           3HG      ARG  92 -32.397   1.729   1.821
  715    HD2  ARG  92           2HD      ARG  92 -29.880   0.871   2.140
  716    HD3  ARG  92           3HD      ARG  92 -30.170   1.345   3.818
  717    HE   ARG  92           HE       ARG  92 -32.186  -0.385   2.467
  718   HH11  ARG  92          2HH2      ARG  92 -29.492  -0.389   4.722
  719   HH12  ARG  92          1HH2      ARG  92 -29.905  -1.969   5.333
  720   HH21  ARG  92          2HH1      ARG  92 -32.653  -2.344   3.289
  721   HH22  ARG  92          1HH1      ARG  92 -31.660  -3.051   4.534
  722    H    LYS  93           H        LYS  93 -30.586   0.401  -0.037
  723    HA   LYS  93           HA       LYS  93 -32.721   0.402  -2.088
  724    HB2  LYS  93           2HB      LYS  93 -30.840  -1.124  -2.280
  725    HB3  LYS  93           3HB      LYS  93 -31.279  -1.869  -0.722
  726    HG2  LYS  93           2HG      LYS  93 -33.576  -2.330  -1.930
  727    HG3  LYS  93           3HG      LYS  93 -32.663  -1.967  -3.400
  728    HD2  LYS  93           2HD      LYS  93 -31.964  -4.082  -1.333
  729    HD3  LYS  93           3HD      LYS  93 -32.736  -4.385  -2.892
  730    HE2  LYS  93           2HE      LYS  93 -30.721  -3.394  -4.032
  731    HE3  LYS  93           3HE      LYS  93 -29.933  -3.246  -2.451
  732    HZ1  LYS  93           HZ1      LYS  93 -29.270  -5.292  -3.563
  733    HZ2  LYS  93           HZ2      LYS  93 -30.155  -5.699  -2.242
  734    HZ3  LYS  93           HZ3      LYS  93 -30.823  -5.760  -3.748
  735    H    VAL  94           H        VAL  94 -34.792   0.142  -1.685
  736    HA   VAL  94           HA       VAL  94 -35.799  -0.738   0.991
  737    HB   VAL  94           HB       VAL  94 -37.053   1.605  -0.468
  738   HG11  VAL  94          1HG1      VAL  94 -37.900   2.189   1.773
  739   HG12  VAL  94          2HG1      VAL  94 -38.366   0.551   1.358
  740   HG13  VAL  94          3HG1      VAL  94 -37.019   0.819   2.483
  741   HG21  VAL  94          3HG2      VAL  94 -34.879   1.891   1.647
  742   HG22  VAL  94          1HG2      VAL  94 -34.783   2.434  -0.049
  743   HG23  VAL  94          2HG2      VAL  94 -35.919   3.201   1.047
  744    H    GLU  95           H        GLU  95 -37.952  -1.524   0.951
  745    HA   GLU  95           HA       GLU  95 -38.790  -2.747  -1.605
  746    HB2  GLU  95           2HB      GLU  95 -40.395  -3.923  -0.253
  747    HB3  GLU  95           3HB      GLU  95 -38.803  -4.009   0.532
  748    HG2  GLU  95           2HG      GLU  95 -39.485  -2.233   2.125
  749    HG3  GLU  95           3HG      GLU  95 -41.056  -2.105   1.332
  750    H    ILE  96           H        ILE  96 -41.072  -2.391  -2.337
  751    HA   ILE  96           HA       ILE  96 -42.682  -0.349  -1.279
  752    HB   ILE  96           HB       ILE  96 -42.607   0.884  -3.746
  753   HG12  ILE  96          2HG1      ILE  96 -40.373   1.685  -4.259
  754   HG13  ILE  96          3HG1      ILE  96 -39.666   0.608  -3.049
  755   HG21  ILE  96          1HG2      ILE  96 -41.076   1.979  -1.420
  756   HG22  ILE  96          2HG2      ILE  96 -41.900   2.853  -2.717
  757   HG23  ILE  96          3HG2      ILE  96 -42.854   1.950  -1.536
  758   HD11  ILE  96          3HD1      ILE  96 -41.203  -0.303  -5.499
  759   HD12  ILE  96          1HD1      ILE  96 -39.422  -0.280  -5.341
  760   HD13  ILE  96          2HD1      ILE  96 -40.390  -1.339  -4.322
  761    H    ALA  97           H        ALA  97 -44.707  -0.209  -2.300
  762    HA   ALA  97           HA       ALA  97 -45.236  -2.471  -4.141
  763    HB1  ALA  97           3HB      ALA  97 -47.410  -0.753  -2.986
  764    HB2  ALA  97           1HB      ALA  97 -47.504  -2.396  -3.573
  765    HB3  ALA  97           2HB      ALA  97 -46.684  -2.067  -2.037
  766    H    PHE  98           H        PHE  98 -46.193  -2.227  -6.147
  767    HA   PHE  98           HA       PHE  98 -46.371   0.542  -7.299
  768    HB2  PHE  98           2HB      PHE  98 -45.679  -2.057  -8.714
  769    HB3  PHE  98           3HB      PHE  98 -45.853  -0.490  -9.482
  770    HD1  PHE  98           HD2      PHE  98 -44.336   1.428  -8.019
  771    HD2  PHE  98           HD1      PHE  98 -43.442  -2.749  -8.661
  772    HE1  PHE  98           HE2      PHE  98 -41.915   1.911  -7.814
  773    HE2  PHE  98           HE1      PHE  98 -41.035  -2.260  -8.444
  774    HZ   PHE  98           HZ       PHE  98 -40.262   0.077  -8.025
  775    H    TYR  99           H        TYR  99 -47.969   0.790  -9.020
  776    HA   TYR  99           HA       TYR  99 -50.032  -1.297  -9.150
  777    HB2  TYR  99           2HB      TYR  99 -51.876   0.059  -8.897
  778    HB3  TYR  99           3HB      TYR  99 -50.826   0.515  -7.570
  779    HD1  TYR  99           HD2      TYR  99 -49.342   2.665  -7.936
  780    HD2  TYR  99           HD1      TYR  99 -52.774   1.670 -10.350
  781    HE1  TYR  99           HE2      TYR  99 -49.501   5.033  -8.687
  782    HE2  TYR  99           HE1      TYR  99 -52.952   4.047 -11.071
  783    HH   TYR  99           HH       TYR  99 -50.655   6.560  -9.947
  784    H    ARG 100           H        ARG 100 -50.880  -1.665 -11.095
  785    HA   ARG 100           HA       ARG 100 -49.522  -0.478 -13.403
  786    HB2  ARG 100           2HB      ARG 100 -51.551  -2.740 -13.300
  787    HB3  ARG 100           3HB      ARG 100 -50.483  -2.315 -14.646
  788    HG2  ARG 100           2HG      ARG 100 -48.531  -2.786 -12.964
  789    HG3  ARG 100           3HG      ARG 100 -49.777  -3.571 -11.982
  790    HD2  ARG 100           2HD      ARG 100 -48.867  -5.315 -13.281
  791    HD3  ARG 100           3HD      ARG 100 -50.386  -4.933 -14.086
  792    HE   ARG 100           HE       ARG 100 -47.630  -4.059 -14.915
  793   HH11  ARG 100          1HH2      ARG 100 -51.012  -4.398 -15.971
  794   HH12  ARG 100          2HH2      ARG 100 -50.535  -4.489 -17.641
  795   HH21  ARG 100          1HH1      ARG 100 -47.171  -4.345 -17.105
  796   HH22  ARG 100          2HH1      ARG 100 -48.475  -4.350 -18.258
  797    H    LYS 101           H        LYS 101 -50.677  -0.141 -15.380
  798    HA   LYS 101           HA       LYS 101 -52.632   1.918 -15.365
  799    HB2  LYS 101           2HB      LYS 101 -50.967   1.585 -17.087
  800    HB3  LYS 101           3HB      LYS 101 -51.584  -0.003 -17.491
  801    HG2  LYS 101           2HG      LYS 101 -53.472   2.341 -17.749
  802    HG3  LYS 101           3HG      LYS 101 -52.151   2.198 -18.916
  803    HD2  LYS 101           2HD      LYS 101 -52.819  -0.036 -19.553
  804    HD3  LYS 101           3HD      LYS 101 -54.095  -0.075 -18.332
  805    HE2  LYS 101           2HE      LYS 101 -55.249   1.813 -19.422
  806    HE3  LYS 101           3HE      LYS 101 -53.962   1.924 -20.633
  807    HZ1  LYS 101           HZ1      LYS 101 -55.758  -0.419 -20.267
  808    HZ2  LYS 101           HZ2      LYS 101 -55.861   0.670 -21.476
  809    HZ3  LYS 101           HZ3      LYS 101 -54.567  -0.317 -21.384
  810    H    ASP 102           H        ASP 102 -53.026  -1.587 -15.615
  811    HA   ASP 102           HA       ASP 102 -55.886  -1.489 -16.134
  812    HB2  ASP 102           2HB      ASP 102 -55.779  -3.905 -15.894
  813    HB3  ASP 102           3HB      ASP 102 -54.469  -3.326 -16.918
  814    H    GLY 103           H        GLY 103 -54.140  -0.883 -13.288
  815    HA2  GLY 103           HA2      GLY 103 -55.114  -0.186 -11.286
  816    HA3  GLY 103           HA3      GLY 103 -56.552  -1.150 -11.599
  817    H    SER 104           H        SER 104 -53.970  -3.258 -12.135
  818    HA   SER 104           HA       SER 104 -54.335  -4.603  -9.562
  819    HB2  SER 104           2HB      SER 104 -52.269  -5.129 -11.735
  820    HB3  SER 104           3HB      SER 104 -52.633  -6.177 -10.352
  821    HG   SER 104           HG       SER 104 -54.228  -5.504 -12.584
  822    H    CYS 105           H        CYS 105 -52.952  -4.665  -7.762
  823    HA   CYS 105           HA       CYS 105 -50.444  -3.104  -7.893
  824    HB2  CYS 105           2HB      CYS 105 -50.969  -1.894  -5.837
  825    HB3  CYS 105           3HB      CYS 105 -52.126  -1.530  -7.123
  826    HG   CYS 105           HG       CYS 105 -54.033  -3.085  -6.332
  827    H    PHE 106           H        PHE 106 -48.773  -3.687  -6.617
  828    HA   PHE 106           HA       PHE 106 -49.038  -5.995  -4.776
  829    HB2  PHE 106           2HB      PHE 106 -47.223  -7.202  -6.161
  830    HB3  PHE 106           3HB      PHE 106 -48.890  -7.276  -6.690
  831    HD1  PHE 106           HD1      PHE 106 -45.616  -5.564  -7.395
  832    HD2  PHE 106           HD2      PHE 106 -49.577  -6.503  -8.819
  833    HE1  PHE 106           HE1      PHE 106 -45.031  -4.660  -9.632
  834    HE2  PHE 106           HE2      PHE 106 -48.980  -5.631 -11.054
  835    HZ   PHE 106           HZ       PHE 106 -46.707  -4.688 -11.469
  836    H    LEU 107           H        LEU 107 -47.453  -6.215  -3.312
  837    HA   LEU 107           HA       LEU 107 -45.103  -4.381  -3.329
  838    HB2  LEU 107           2HB      LEU 107 -46.703  -4.256  -1.396
  839    HB3  LEU 107           3HB      LEU 107 -46.418  -5.944  -1.070
  840    HG   LEU 107           HG       LEU 107 -45.321  -4.499   0.516
  841   HD11  LEU 107          1HD1      LEU 107 -43.244  -5.517   0.716
  842   HD12  LEU 107          2HD1      LEU 107 -44.132  -6.697  -0.282
  843   HD13  LEU 107          3HD1      LEU 107 -42.964  -5.565  -1.011
  844   HD21  LEU 107          3HD2      LEU 107 -43.595  -3.459  -1.694
  845   HD22  LEU 107          1HD2      LEU 107 -44.854  -2.542  -0.804
  846   HD23  LEU 107          2HD2      LEU 107 -43.404  -3.115   0.031
  847    H    CYS 108           H        CYS 108 -43.132  -5.194  -3.470
  848    HA   CYS 108           HA       CYS 108 -42.532  -7.981  -2.737
  849    HB2  CYS 108           2HB      CYS 108 -42.245  -6.818  -5.507
  850    HB3  CYS 108           3HB      CYS 108 -40.971  -7.891  -4.908
  851    HG   CYS 108           HG       CYS 108 -44.190  -8.559  -4.615
  852    H    LEU 109           H        LEU 109 -40.056  -8.254  -2.704
  853    HA   LEU 109           HA       LEU 109 -38.868  -5.965  -1.286
  854    HB2  LEU 109           2HB      LEU 109 -38.681  -8.276  -0.436
  855    HB3  LEU 109           3HB      LEU 109 -37.813  -8.756  -1.891
  856    HG   LEU 109           HG       LEU 109 -35.896  -7.354  -1.275
  857   HD11  LEU 109          1HD1      LEU 109 -36.950  -5.447  -0.193
  858   HD12  LEU 109          2HD1      LEU 109 -37.575  -6.485   1.113
  859   HD13  LEU 109          3HD1      LEU 109 -35.829  -6.204   0.937
  860   HD21  LEU 109          3HD2      LEU 109 -36.069  -9.625  -0.332
  861   HD22  LEU 109          1HD2      LEU 109 -35.204  -8.522   0.750
  862   HD23  LEU 109          2HD2      LEU 109 -36.889  -8.967   1.102
  863    H    VAL 110           H        VAL 110 -39.356  -4.860  -3.452
  864    HA   VAL 110           HA       VAL 110 -37.990  -5.372  -5.821
  865    HB   VAL 110           HB       VAL 110 -38.840  -2.687  -4.751
  866   HG11  VAL 110          1HG1      VAL 110 -39.093  -1.942  -7.075
  867   HG12  VAL 110          2HG1      VAL 110 -37.422  -2.378  -6.771
  868   HG13  VAL 110          3HG1      VAL 110 -38.479  -3.492  -7.664
  869   HG21  VAL 110          3HG2      VAL 110 -40.348  -4.690  -6.506
  870   HG22  VAL 110          1HG2      VAL 110 -40.750  -4.268  -4.829
  871   HG23  VAL 110          2HG2      VAL 110 -40.931  -3.066  -6.089
  872    H    ASP 111           H        ASP 111 -36.082  -4.371  -6.850
  873    HA   ASP 111           HA       ASP 111 -33.993  -4.038  -4.722
  874    HB2  ASP 111           2HB      ASP 111 -34.055  -5.953  -6.479
  875    HB3  ASP 111           3HB      ASP 111 -33.340  -4.758  -7.561
  876    H    VAL 112           H        VAL 112 -34.848  -1.795  -4.532
  877    HA   VAL 112           HA       VAL 112 -34.394   0.063  -6.692
  878    HB   VAL 112           HB       VAL 112 -35.167   0.595  -3.792
  879   HG11  VAL 112          1HG1      VAL 112 -35.904   2.093  -6.338
  880   HG12  VAL 112          2HG1      VAL 112 -36.364   2.526  -4.684
  881   HG13  VAL 112          3HG1      VAL 112 -34.670   2.630  -5.166
  882   HG21  VAL 112          3HG2      VAL 112 -36.703  -1.101  -4.696
  883   HG22  VAL 112          1HG2      VAL 112 -37.496   0.461  -4.571
  884   HG23  VAL 112          2HG2      VAL 112 -36.940  -0.131  -6.161
  885    H    VAL 113           H        VAL 113 -32.023  -0.541  -6.826
  886    HA   VAL 113           HA       VAL 113 -30.409   1.099  -4.900
  887    HB   VAL 113           HB       VAL 113 -30.149  -1.285  -4.600
  888   HG11  VAL 113          1HG1      VAL 113 -28.905  -2.690  -6.101
  889   HG12  VAL 113          2HG1      VAL 113 -30.304  -2.051  -6.974
  890   HG13  VAL 113          3HG1      VAL 113 -28.687  -1.375  -7.266
  891   HG21  VAL 113          3HG2      VAL 113 -28.376   0.283  -3.937
  892   HG22  VAL 113          1HG2      VAL 113 -27.723  -1.286  -4.424
  893   HG23  VAL 113          2HG2      VAL 113 -27.607   0.092  -5.534
  894    HA   PRO 114           HA       PRO 114 -29.192   3.271  -8.649
  895    HB2  PRO 114           2HB      PRO 114 -27.854   5.355  -7.643
  896    HB3  PRO 114           3HB      PRO 114 -29.583   5.143  -7.350
  897    HG2  PRO 114           2HG      PRO 114 -27.277   4.378  -5.553
  898    HG3  PRO 114           3HG      PRO 114 -28.774   5.282  -5.126
  899    HD2  PRO 114           2HD      PRO 114 -28.457   2.567  -4.703
  900    HD3  PRO 114           3HD      PRO 114 -30.034   3.324  -5.047
  901    H    VAL 115           H        VAL 115 -26.953   4.469  -9.445
  902    HA   VAL 115           HA       VAL 115 -24.793   2.420  -9.215
  903    HB   VAL 115           HB       VAL 115 -24.305   2.866 -11.600
  904   HG11  VAL 115          1HG1      VAL 115 -26.043   1.366 -12.446
  905   HG12  VAL 115          2HG1      VAL 115 -25.455   0.834 -10.861
  906   HG13  VAL 115          3HG1      VAL 115 -27.026   1.651 -10.994
  907   HG21  VAL 115          3HG2      VAL 115 -25.929   3.816 -13.063
  908   HG22  VAL 115          1HG2      VAL 115 -27.083   4.062 -11.724
  909   HG23  VAL 115          2HG2      VAL 115 -25.566   4.979 -11.781
  910    H    LYS 116           H        LYS 116 -22.766   2.933  -9.239
  911    HA   LYS 116           HA       LYS 116 -22.019   5.755  -8.697
  912    HB2  LYS 116           2HB      LYS 116 -20.840   3.286  -7.341
  913    HB3  LYS 116           3HB      LYS 116 -20.507   4.952  -6.982
  914    HG2  LYS 116           2HG      LYS 116 -21.919   4.516  -5.288
  915    HG3  LYS 116           3HG      LYS 116 -23.105   5.081  -6.455
  916    HD2  LYS 116           2HD      LYS 116 -23.622   2.684  -7.042
  917    HD3  LYS 116           3HD      LYS 116 -22.459   2.168  -5.807
  918    HE2  LYS 116           2HE      LYS 116 -23.761   3.263  -4.061
  919    HE3  LYS 116           3HE      LYS 116 -24.841   3.990  -5.255
  920    HZ1  LYS 116           HZ1      LYS 116 -25.635   1.783  -5.837
  921    HZ2  LYS 116           HZ2      LYS 116 -24.596   1.071  -4.775
  922    HZ3  LYS 116           HZ3      LYS 116 -25.798   2.028  -4.205
  923    H    ASN 117           H        ASN 117 -19.754   6.184  -8.784
  924    HA   ASN 117           HA       ASN 117 -18.415   4.907 -11.145
  925    HB2  ASN 117           2HB      ASN 117 -17.253   6.871 -11.532
  926    HB3  ASN 117           3HB      ASN 117 -18.851   7.432 -11.101
  927   HD21  ASN 117          2HD2      ASN 117 -19.093   8.270  -8.744
  928   HD22  ASN 117          1HD2      ASN 117 -17.636   8.993  -8.077
  929    H    GLU 118           H        GLU 118 -15.833   5.142 -10.848
  930    HA   GLU 118           HA       GLU 118 -15.111   3.104  -9.014
  931    HB2  GLU 118           2HB      GLU 118 -12.841   3.476  -9.759
  932    HB3  GLU 118           3HB      GLU 118 -13.959   3.514 -11.121
  933    HG2  GLU 118           2HG      GLU 118 -13.871   6.015 -11.109
  934    HG3  GLU 118           3HG      GLU 118 -12.730   5.959  -9.764
  935    H    ASP 119           H        ASP 119 -15.219   6.565  -8.428
  936    HA   ASP 119           HA       ASP 119 -13.626   6.536  -6.011
  937    HB2  ASP 119           2HB      ASP 119 -14.265   8.531  -7.499
  938    HB3  ASP 119           3HB      ASP 119 -15.842   8.487  -6.709
  939    H    GLY 120           H        GLY 120 -16.816   5.377  -6.691
  940    HA2  GLY 120           HA2      GLY 120 -18.161   4.141  -5.232
  941    HA3  GLY 120           HA3      GLY 120 -17.396   4.885  -3.827
  942    H    ALA 121           H        ALA 121 -18.217   7.305  -6.068
  943    HA   ALA 121           HA       ALA 121 -20.604   8.054  -4.497
  944    HB1  ALA 121           3HB      ALA 121 -18.727   9.689  -4.810
  945    HB2  ALA 121           1HB      ALA 121 -19.070   9.685  -6.559
  946    HB3  ALA 121           2HB      ALA 121 -20.288  10.278  -5.422
  947    H    VAL 122           H        VAL 122 -22.588   8.402  -5.228
  948    HA   VAL 122           HA       VAL 122 -23.443   6.899  -7.547
  949    HB   VAL 122           HB       VAL 122 -24.667   6.718  -5.525
  950   HG11  VAL 122          1HG1      VAL 122 -26.045   8.402  -4.528
  951   HG12  VAL 122          2HG1      VAL 122 -24.377   8.985  -4.542
  952   HG13  VAL 122          3HG1      VAL 122 -25.552   9.614  -5.718
  953   HG21  VAL 122          3HG2      VAL 122 -26.911   7.029  -6.361
  954   HG22  VAL 122          1HG2      VAL 122 -26.332   8.122  -7.635
  955   HG23  VAL 122          2HG2      VAL 122 -25.842   6.416  -7.638
  956    H    ILE 123           H        ILE 123 -22.883   7.698  -9.419
  957    HA   ILE 123           HA       ILE 123 -23.381  10.534 -10.030
  958    HB   ILE 123           HB       ILE 123 -22.143  10.393 -11.896
  959   HG12  ILE 123          2HG1      ILE 123 -23.017   8.557 -13.138
  960   HG13  ILE 123          3HG1      ILE 123 -21.273   8.459 -13.056
  961   HG21  ILE 123          1HG2      ILE 123 -20.002   9.551 -11.210
  962   HG22  ILE 123          2HG2      ILE 123 -20.852  10.160  -9.779
  963   HG23  ILE 123          3HG2      ILE 123 -20.752   8.416 -10.068
  964   HD11  ILE 123          3HD1      ILE 123 -21.506   6.657 -11.307
  965   HD12  ILE 123          1HD1      ILE 123 -23.264   6.704 -11.586
  966   HD13  ILE 123          2HD1      ILE 123 -22.181   6.249 -12.893
  967    H    MET 124           H        MET 124 -24.889   7.375 -10.633
  968    HA   MET 124           HA       MET 124 -27.112   8.893 -11.928
  969    HB2  MET 124           2HB      MET 124 -25.657   6.531 -13.147
  970    HB3  MET 124           3HB      MET 124 -27.368   6.822 -13.480
  971    HG2  MET 124           2HG      MET 124 -25.026   8.614 -14.061
  972    HG3  MET 124           3HG      MET 124 -25.992   7.735 -15.226
  973    HE1  MET 124           3HE      MET 124 -26.173  11.950 -14.799
  974    HE2  MET 124           1HE      MET 124 -25.023  10.861 -13.983
  975    HE3  MET 124           2HE      MET 124 -25.264  10.736 -15.735
  976    H    PHE 125           H        PHE 125 -29.062   8.089 -11.754
  977    HA   PHE 125           HA       PHE 125 -29.600   6.265  -9.434
  978    HB2  PHE 125           2HB      PHE 125 -30.923   8.769 -10.531
  979    HB3  PHE 125           3HB      PHE 125 -31.895   7.565  -9.712
  980    HD1  PHE 125           HD2      PHE 125 -28.888   7.477  -7.861
  981    HD2  PHE 125           HD1      PHE 125 -32.307   9.976  -8.689
  982    HE1  PHE 125           HE2      PHE 125 -28.582   8.620  -5.693
  983    HE2  PHE 125           HE1      PHE 125 -31.951  11.157  -6.534
  984    HZ   PHE 125           HZ       PHE 125 -30.094  10.472  -5.031
  985    H    ILE 126           H        ILE 126 -29.208   4.507 -10.892
  986    HA   ILE 126           HA       ILE 126 -31.469   3.973 -12.770
  987    HB   ILE 126           HB       ILE 126 -28.894   2.429 -12.481
  988   HG12  ILE 126          2HG1      ILE 126 -29.861   4.538 -14.474
  989   HG13  ILE 126          3HG1      ILE 126 -28.511   4.699 -13.364
  990   HG21  ILE 126          1HG2      ILE 126 -30.878   2.251 -14.779
  991   HG22  ILE 126          2HG2      ILE 126 -29.614   1.107 -14.316
  992   HG23  ILE 126          3HG2      ILE 126 -31.110   1.248 -13.378
  993   HD11  ILE 126          3HD1      ILE 126 -27.636   4.256 -15.516
  994   HD12  ILE 126          1HD1      ILE 126 -27.395   2.783 -14.518
  995   HD13  ILE 126          2HD1      ILE 126 -28.687   2.838 -15.735
  996    H    LEU 127           H        LEU 127 -32.862   3.949 -10.951
  997    HA   LEU 127           HA       LEU 127 -32.629   1.710  -9.072
  998    HB2  LEU 127           2HB      LEU 127 -34.836   3.800  -9.253
  999    HB3  LEU 127           3HB      LEU 127 -34.540   2.648  -7.961
 1000    HG   LEU 127           HG       LEU 127 -32.718   4.954  -8.790
 1001   HD11  LEU 127          1HD1      LEU 127 -33.792   4.442  -5.998
 1002   HD12  LEU 127          2HD1      LEU 127 -32.766   5.750  -6.529
 1003   HD13  LEU 127          3HD1      LEU 127 -34.448   5.663  -7.129
 1004   HD21  LEU 127          3HD2      LEU 127 -31.285   3.172  -8.293
 1005   HD22  LEU 127          1HD2      LEU 127 -31.345   4.109  -6.790
 1006   HD23  LEU 127          2HD2      LEU 127 -32.287   2.628  -6.925
 1007    H    ASN 128           H        ASN 128 -32.442   0.092 -10.380
 1008    HA   ASN 128           HA       ASN 128 -34.251  -0.954 -12.267
 1009    HB2  ASN 128           2HB      ASN 128 -32.354  -2.266 -10.271
 1010    HB3  ASN 128           3HB      ASN 128 -33.298  -3.207 -11.410
 1011   HD21  ASN 128          2HD2      ASN 128 -30.864  -0.464 -11.461
 1012   HD22  ASN 128          1HD2      ASN 128 -30.153  -1.091 -12.931
 1013    H    PHE 129           H        PHE 129 -36.489  -1.009 -11.864
 1014    HA   PHE 129           HA       PHE 129 -37.395  -1.806  -9.203
 1015    HB2  PHE 129           2HB      PHE 129 -39.022  -1.055 -11.631
 1016    HB3  PHE 129           3HB      PHE 129 -39.560  -1.249  -9.957
 1017    HD1  PHE 129           HD1      PHE 129 -37.528   0.342  -8.438
 1018    HD2  PHE 129           HD2      PHE 129 -39.523   1.157 -12.176
 1019    HE1  PHE 129           HE1      PHE 129 -37.254   2.781  -8.066
 1020    HE2  PHE 129           HE2      PHE 129 -39.249   3.592 -11.789
 1021    HZ   PHE 129           HZ       PHE 129 -38.101   4.406  -9.735
 1022    H    GLU 130           H        GLU 130 -36.180  -3.908  -9.722
 1023    HA   GLU 130           HA       GLU 130 -37.828  -5.855 -11.225
 1024    HB2  GLU 130           2HB      GLU 130 -36.271  -7.546 -10.347
 1025    HB3  GLU 130           3HB      GLU 130 -35.537  -6.274 -11.350
 1026    HG2  GLU 130           2HG      GLU 130 -34.579  -5.173  -9.508
 1027    HG3  GLU 130           3HG      GLU 130 -35.482  -6.089  -8.321
 1028    H    VAL 131           H        VAL 131 -39.359  -7.052 -10.462
 1029    HA   VAL 131           HA       VAL 131 -40.285  -6.755  -7.654
 1030    HB   VAL 131           HB       VAL 131 -41.442  -7.876 -10.192
 1031   HG11  VAL 131          1HG1      VAL 131 -42.330  -9.235  -8.308
 1032   HG12  VAL 131          2HG1      VAL 131 -42.888  -7.725  -7.538
 1033   HG13  VAL 131          3HG1      VAL 131 -43.569  -8.245  -9.088
 1034   HG21  VAL 131          3HG2      VAL 131 -41.407  -5.391  -9.965
 1035   HG22  VAL 131          1HG2      VAL 131 -43.057  -6.027  -9.968
 1036   HG23  VAL 131          2HG2      VAL 131 -42.304  -5.527  -8.438
 1037    H    VAL 132           H        VAL 132 -39.543  -8.179  -6.159
 1038    HA   VAL 132           HA       VAL 132 -39.191 -10.999  -6.957
 1039    HB   VAL 132           HB       VAL 132 -37.040 -10.059  -7.448
 1040   HG11  VAL 132          1HG1      VAL 132 -35.548  -9.109  -5.771
 1041   HG12  VAL 132          2HG1      VAL 132 -36.990  -8.107  -5.952
 1042   HG13  VAL 132          3HG1      VAL 132 -36.829  -9.187  -4.546
 1043   HG21  VAL 132          3HG2      VAL 132 -37.163 -12.355  -6.518
 1044   HG22  VAL 132          1HG2      VAL 132 -35.628 -11.545  -6.174
 1045   HG23  VAL 132          2HG2      VAL 132 -36.844 -11.699  -4.894
 1046    H    MET 133           H        MET 133 -39.657 -12.448  -5.465
 1047    HA   MET 133           HA       MET 133 -40.462 -11.562  -2.745
 1048    HB2  MET 133           2HB      MET 133 -41.221 -14.044  -4.337
 1049    HB3  MET 133           3HB      MET 133 -41.702 -13.706  -2.670
 1050    HG2  MET 133           2HG      MET 133 -42.858 -11.638  -3.428
 1051    HG3  MET 133           3HG      MET 133 -42.394 -12.003  -5.090
 1052    HE1  MET 133           3HE      MET 133 -44.729 -12.814  -2.091
 1053    HE2  MET 133           1HE      MET 133 -45.579 -14.285  -2.610
 1054    HE3  MET 133           2HE      MET 133 -43.864 -14.368  -2.163
 1055    H    GLU 134           H        GLU 134 -39.791 -12.682  -0.988
 1056    HA   GLU 134           HA       GLU 134 -37.132 -13.841  -0.982
 1057    HB2  GLU 134           2HB      GLU 134 -39.232 -13.703   1.219
 1058    HB3  GLU 134           3HB      GLU 134 -37.547 -14.195   1.429
 1059    HG2  GLU 134           2HG      GLU 134 -36.823 -11.948   0.577
 1060    HG3  GLU 134           3HG      GLU 134 -38.513 -11.444   0.536
 1061    H    LYS 135           H        LYS 135 -36.490 -15.929  -0.306
 1062    HA   LYS 135           HA       LYS 135 -38.150 -18.120  -1.310
 1063    HB2  LYS 135           2HB      LYS 135 -36.191 -19.497  -1.013
 1064    HB3  LYS 135           3HB      LYS 135 -35.817 -18.039  -1.928
 1065    HG2  LYS 135           2HG      LYS 135 -34.735 -17.037   0.065
 1066    HG3  LYS 135           3HG      LYS 135 -35.222 -18.421   1.045
 1067    HD2  LYS 135           2HD      LYS 135 -32.883 -18.649   0.459
 1068    HD3  LYS 135           3HD      LYS 135 -33.832 -19.929  -0.282
 1069    HE2  LYS 135           2HE      LYS 135 -32.218 -19.216  -1.886
 1070    HE3  LYS 135           3HE      LYS 135 -33.797 -18.683  -2.457
 1071    HZ1  LYS 135           HZ1      LYS 135 -33.256 -16.446  -1.625
 1072    HZ2  LYS 135           HZ2      LYS 135 -31.808 -16.960  -1.065
 1073    HZ3  LYS 135           HZ3      LYS 135 -32.105 -16.941  -2.667
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1 -13.149  -1.354   3.466
    2    H2   MET   1           2H       MET   1 -13.686   0.117   2.993
    3    H3   MET   1           3H       MET   1 -12.431  -0.589   2.210
    4    HA   MET   1           HA       MET   1 -15.194  -1.596   2.257
    5    HB2  MET   1           2HB      MET   1 -14.868   0.499   0.909
    6    HB3  MET   1           3HB      MET   1 -13.692  -0.360  -0.092
    7    HG2  MET   1           2HG      MET   1 -15.467  -1.977  -0.746
    8    HG3  MET   1           3HG      MET   1 -16.624  -1.110   0.274
    9    HE1  MET   1           3HE      MET   1 -18.274  -1.046  -1.803
   10    HE2  MET   1           1HE      MET   1 -17.830  -0.391  -3.396
   11    HE3  MET   1           2HE      MET   1 -17.060  -1.879  -2.802
   12    HA   PRO   2           HA       PRO   2 -13.084  -5.424   1.236
   13    HB2  PRO   2           2HB      PRO   2 -15.219  -7.030   0.686
   14    HB3  PRO   2           3HB      PRO   2 -14.821  -6.477   2.342
   15    HG2  PRO   2           2HG      PRO   2 -16.824  -5.259   0.408
   16    HG3  PRO   2           3HG      PRO   2 -17.082  -5.712   2.124
   17    HD2  PRO   2           2HD      PRO   2 -16.493  -3.167   1.395
   18    HD3  PRO   2           3HD      PRO   2 -15.825  -3.871   2.897
   19    H    VAL   3           H        VAL   3 -12.574  -6.710  -0.575
   20    HA   VAL   3           HA       VAL   3 -13.632  -5.937  -3.253
   21    HB   VAL   3           HB       VAL   3 -10.664  -6.081  -2.579
   22   HG11  VAL   3          1HG1      VAL   3 -12.105  -5.391  -5.181
   23   HG12  VAL   3          2HG1      VAL   3 -10.362  -5.228  -4.903
   24   HG13  VAL   3          3HG1      VAL   3 -11.097  -6.828  -4.884
   25   HG21  VAL   3          3HG2      VAL   3 -10.603  -3.669  -3.174
   26   HG22  VAL   3          1HG2      VAL   3 -12.378  -3.660  -3.275
   27   HG23  VAL   3          2HG2      VAL   3 -11.560  -3.968  -1.726
   28    H    ARG   4           H        ARG   4 -13.764  -7.633  -4.672
   29    HA   ARG   4           HA       ARG   4 -13.274 -10.351  -3.659
   30    HB2  ARG   4           2HB      ARG   4 -15.352  -9.563  -4.824
   31    HB3  ARG   4           3HB      ARG   4 -14.461  -9.543  -6.337
   32    HG2  ARG   4           2HG      ARG   4 -14.512 -12.036  -4.589
   33    HG3  ARG   4           3HG      ARG   4 -15.931 -11.624  -5.529
   34    HD2  ARG   4           2HD      ARG   4 -13.186 -12.080  -6.771
   35    HD3  ARG   4           3HD      ARG   4 -14.420 -13.303  -6.578
   36    HE   ARG   4           HE       ARG   4 -15.857 -12.208  -8.126
   37   HH11  ARG   4          1HH1      ARG   4 -12.782 -10.490  -8.001
   38   HH12  ARG   4          2HH1      ARG   4 -12.994  -9.867  -9.615
   39   HH21  ARG   4          1HH2      ARG   4 -16.056 -11.326 -10.130
   40   HH22  ARG   4          2HH2      ARG   4 -14.800 -10.302 -10.764
   41    H    ARG   5           H        ARG   5 -11.075 -10.041  -3.463
   42    HA   ARG   5           HA       ARG   5  -9.453 -10.710  -5.888
   43    HB2  ARG   5           2HB      ARG   5  -7.662  -9.223  -5.188
   44    HB3  ARG   5           3HB      ARG   5  -9.155  -8.327  -5.444
   45    HG2  ARG   5           2HG      ARG   5  -9.534  -8.294  -2.962
   46    HG3  ARG   5           3HG      ARG   5  -7.988  -9.133  -2.736
   47    HD2  ARG   5           2HD      ARG   5  -6.793  -7.262  -3.791
   48    HD3  ARG   5           3HD      ARG   5  -8.334  -6.448  -4.128
   49    HE   ARG   5           HE       ARG   5  -8.010  -7.047  -1.305
   50   HH11  ARG   5          1HH1      ARG   5  -7.018  -4.692  -3.705
   51   HH12  ARG   5          2HH1      ARG   5  -6.815  -3.435  -2.517
   52   HH21  ARG   5          1HH2      ARG   5  -7.722  -5.400   0.155
   53   HH22  ARG   5          2HH2      ARG   5  -7.198  -3.834  -0.390
   54    H    GLY   6           H        GLY   6  -7.315 -11.618  -5.376
   55    HA2  GLY   6           HA2      GLY   6  -5.959 -13.205  -4.322
   56    HA3  GLY   6           HA3      GLY   6  -7.020 -13.194  -2.912
   57    H    HIS   7           H        HIS   7  -9.432 -13.697  -4.608
   58    HA   HIS   7           HA       HIS   7  -8.996 -16.248  -6.015
   59    HB2  HIS   7           2HB      HIS   7  -9.569 -16.904  -3.685
   60    HB3  HIS   7           3HB      HIS   7 -11.034 -15.924  -3.768
   61    HD2  HIS   7           HD2      HIS   7 -13.157 -16.999  -4.964
   62    HE1  HIS   7           HE1      HIS   7 -11.374 -20.645  -6.271
   63    HE2  HIS   7           HE2      HIS   7 -13.562 -19.369  -6.037
   64    H    VAL   8           H        VAL   8 -10.662 -16.666  -7.556
   65    HA   VAL   8           HA       VAL   8 -12.692 -14.543  -7.964
   66    HB   VAL   8           HB       VAL   8 -10.703 -14.104  -9.404
   67   HG11  VAL   8          1HG1      VAL   8 -10.311 -15.374 -11.416
   68   HG12  VAL   8          2HG1      VAL   8 -10.121 -16.444 -10.019
   69   HG13  VAL   8          3HG1      VAL   8 -11.595 -16.526 -11.012
   70   HG21  VAL   8          3HG2      VAL   8 -13.291 -14.623 -10.898
   71   HG22  VAL   8          1HG2      VAL   8 -12.916 -13.196  -9.910
   72   HG23  VAL   8          2HG2      VAL   8 -11.983 -13.529 -11.375
   73    H    ALA   9           H        ALA   9 -14.665 -15.226  -8.543
   74    HA   ALA   9           HA       ALA   9 -15.371 -18.044  -8.534
   75    HB1  ALA   9           3HB      ALA   9 -16.873 -16.270  -7.696
   76    HB2  ALA   9           1HB      ALA   9 -16.925 -15.539  -9.319
   77    HB3  ALA   9           2HB      ALA   9 -17.627 -17.145  -9.040
   78    HA   PRO  10           HA       PRO  10 -15.069 -19.018 -12.941
   79    HB2  PRO  10           2HB      PRO  10 -17.966 -19.806 -12.775
   80    HB3  PRO  10           3HB      PRO  10 -16.601 -20.690 -13.510
   81    HG2  PRO  10           2HG      PRO  10 -17.552 -21.406 -11.064
   82    HG3  PRO  10           3HG      PRO  10 -15.788 -21.373 -11.380
   83    HD2  PRO  10           2HD      PRO  10 -17.464 -19.324  -9.914
   84    HD3  PRO  10           3HD      PRO  10 -15.834 -19.949  -9.544
   85    H    GLN  11           H        GLN  11 -14.889 -17.284 -14.166
   86    HA   GLN  11           HA       GLN  11 -16.411 -14.965 -13.802
   87    HB2  GLN  11           2HB      GLN  11 -15.033 -13.915 -15.379
   88    HB3  GLN  11           3HB      GLN  11 -14.040 -15.064 -14.500
   89    HG2  GLN  11           2HG      GLN  11 -15.128 -15.373 -17.336
   90    HG3  GLN  11           3HG      GLN  11 -13.472 -15.005 -16.876
   91   HE21  GLN  11          2HE2      GLN  11 -14.933 -17.403 -18.321
   92   HE22  GLN  11          1HE2      GLN  11 -14.131 -18.772 -17.550
   93    H    ASN  12           H        ASN  12 -16.986 -17.508 -16.149
   94    HA   ASN  12           HA       ASN  12 -18.583 -15.956 -17.989
   95    HB2  ASN  12           2HB      ASN  12 -18.255 -18.939 -17.420
   96    HB3  ASN  12           3HB      ASN  12 -19.437 -18.332 -18.574
   97   HD21  ASN  12          2HD2      ASN  12 -17.997 -19.848 -19.932
   98   HD22  ASN  12          1HD2      ASN  12 -16.675 -19.038 -20.761
   99    H    THR  13           H        THR  13 -19.488 -18.138 -15.279
  100    HA   THR  13           HA       THR  13 -22.321 -17.516 -15.499
  101    HB   THR  13           HB       THR  13 -21.181 -19.648 -14.655
  102    HG1  THR  13           HG1      THR  13 -22.994 -20.071 -13.390
  103   HG21  THR  13          1HG2      THR  13 -21.328 -18.213 -11.982
  104   HG22  THR  13          2HG2      THR  13 -20.802 -19.888 -12.299
  105   HG23  THR  13          3HG2      THR  13 -19.838 -18.517 -12.879
  106    H    PHE  14           H        PHE  14 -19.648 -16.405 -13.418
  107    HA   PHE  14           HA       PHE  14 -21.099 -14.752 -11.628
  108    HB2  PHE  14           2HB      PHE  14 -18.697 -15.373 -11.498
  109    HB3  PHE  14           3HB      PHE  14 -18.355 -14.354 -12.881
  110    HD1  PHE  14           HD1      PHE  14 -19.198 -14.389  -9.281
  111    HD2  PHE  14           HD2      PHE  14 -18.376 -11.885 -12.697
  112    HE1  PHE  14           HE1      PHE  14 -18.898 -12.435  -7.778
  113    HE2  PHE  14           HE2      PHE  14 -18.110  -9.925 -11.193
  114    HZ   PHE  14           HZ       PHE  14 -18.363 -10.198  -8.731
  115    H    LEU  15           H        LEU  15 -19.848 -14.125 -14.917
  116    HA   LEU  15           HA       LEU  15 -21.002 -11.444 -15.020
  117    HB2  LEU  15           2HB      LEU  15 -19.064 -11.904 -16.373
  118    HB3  LEU  15           3HB      LEU  15 -19.885 -13.240 -17.193
  119    HG   LEU  15           HG       LEU  15 -21.468 -11.714 -18.234
  120   HD11  LEU  15          1HD1      LEU  15 -19.931  -9.417 -16.934
  121   HD12  LEU  15          2HD1      LEU  15 -21.275  -9.280 -18.106
  122   HD13  LEU  15          3HD1      LEU  15 -21.567  -9.914 -16.499
  123   HD21  LEU  15          3HD2      LEU  15 -19.343 -12.180 -19.377
  124   HD22  LEU  15          1HD2      LEU  15 -19.927 -10.549 -19.749
  125   HD23  LEU  15          2HD2      LEU  15 -18.597 -10.772 -18.588
  126    H    ASP  16           H        ASP  16 -22.073 -14.615 -16.393
  127    HA   ASP  16           HA       ASP  16 -24.400 -13.901 -17.685
  128    HB2  ASP  16           2HB      ASP  16 -23.425 -16.190 -17.420
  129    HB3  ASP  16           3HB      ASP  16 -24.118 -16.262 -15.803
  130    H    THR  17           H        THR  17 -24.004 -14.221 -14.177
  131    HA   THR  17           HA       THR  17 -26.753 -13.709 -13.425
  132    HB   THR  17           HB       THR  17 -24.202 -13.083 -11.871
  133    HG1  THR  17           HG1      THR  17 -24.370 -15.265 -12.379
  134   HG21  THR  17          1HG2      THR  17 -25.659 -13.352  -9.865
  135   HG22  THR  17          2HG2      THR  17 -26.103 -11.942 -10.834
  136   HG23  THR  17          3HG2      THR  17 -27.083 -13.425 -10.929
  137    H    ILE  18           H        ILE  18 -24.062 -11.514 -14.109
  138    HA   ILE  18           HA       ILE  18 -25.487  -9.069 -13.363
  139    HB   ILE  18           HB       ILE  18 -23.029  -9.427 -15.083
  140   HG12  ILE  18          2HG1      ILE  18 -22.565 -10.396 -12.912
  141   HG13  ILE  18          3HG1      ILE  18 -21.629  -8.955 -13.211
  142   HG21  ILE  18          1HG2      ILE  18 -24.167  -6.971 -13.715
  143   HG22  ILE  18          2HG2      ILE  18 -22.510  -7.066 -14.359
  144   HG23  ILE  18          3HG2      ILE  18 -23.880  -7.241 -15.445
  145   HD11  ILE  18          3HD1      ILE  18 -23.169  -7.680 -11.686
  146   HD12  ILE  18          1HD1      ILE  18 -24.163  -9.143 -11.477
  147   HD13  ILE  18          2HD1      ILE  18 -22.498  -9.102 -10.867
  148    H    ILE  19           H        ILE  19 -25.144 -11.120 -16.273
  149    HA   ILE  19           HA       ILE  19 -26.207  -9.192 -18.092
  150    HB   ILE  19           HB       ILE  19 -26.503 -12.215 -18.232
  151   HG12  ILE  19          2HG1      ILE  19 -24.147 -11.830 -18.286
  152   HG13  ILE  19          3HG1      ILE  19 -24.664 -12.135 -19.927
  153   HG21  ILE  19          1HG2      ILE  19 -28.128 -11.085 -19.632
  154   HG22  ILE  19          2HG2      ILE  19 -26.882 -10.027 -20.309
  155   HG23  ILE  19          3HG2      ILE  19 -26.868 -11.770 -20.664
  156   HD11  ILE  19          3HD1      ILE  19 -23.940  -9.459 -18.679
  157   HD12  ILE  19          1HD1      ILE  19 -23.041 -10.360 -19.906
  158   HD13  ILE  19          2HD1      ILE  19 -24.621  -9.629 -20.317
  159    H    ARG  20           H        ARG  20 -27.737 -11.849 -16.106
  160    HA   ARG  20           HA       ARG  20 -30.419 -11.106 -16.738
  161    HB2  ARG  20           2HB      ARG  20 -29.631 -12.103 -14.023
  162    HB3  ARG  20           3HB      ARG  20 -31.178 -12.328 -14.825
  163    HG2  ARG  20           2HG      ARG  20 -28.553 -13.634 -15.716
  164    HG3  ARG  20           3HG      ARG  20 -29.658 -14.320 -14.552
  165    HD2  ARG  20           2HD      ARG  20 -30.395 -15.388 -16.430
  166    HD3  ARG  20           3HD      ARG  20 -31.483 -14.001 -16.413
  167    HE   ARG  20           HE       ARG  20 -30.146 -12.949 -18.169
  168   HH11  ARG  20          2HH2      ARG  20 -28.703 -16.017 -17.353
  169   HH12  ARG  20          1HH2      ARG  20 -27.652 -15.926 -18.711
  170   HH21  ARG  20          1HH1      ARG  20 -29.310 -13.205 -20.056
  171   HH22  ARG  20          2HH1      ARG  20 -28.143 -14.496 -20.385
  172    H    LYS  21           H        LYS  21 -28.188  -9.701 -14.422
  173    HA   LYS  21           HA       LYS  21 -30.084  -8.059 -13.016
  174    HB2  LYS  21           2HB      LYS  21 -27.522  -8.581 -12.518
  175    HB3  LYS  21           3HB      LYS  21 -27.256  -7.120 -13.483
  176    HG2  LYS  21           2HG      LYS  21 -27.282  -6.417 -11.235
  177    HG3  LYS  21           3HG      LYS  21 -28.837  -5.905 -11.903
  178    HD2  LYS  21           2HD      LYS  21 -29.925  -7.897 -10.829
  179    HD3  LYS  21           3HD      LYS  21 -28.339  -8.433 -10.258
  180    HE2  LYS  21           2HE      LYS  21 -29.541  -7.402  -8.441
  181    HE3  LYS  21           3HE      LYS  21 -28.139  -6.410  -8.851
  182    HZ1  LYS  21           HZ1      LYS  21 -30.263  -5.172  -8.475
  183    HZ2  LYS  21           HZ2      LYS  21 -29.601  -4.858  -9.951
  184    HZ3  LYS  21           HZ3      LYS  21 -30.902  -5.849  -9.814
  185    H    PHE  22           H        PHE  22 -28.100  -7.260 -15.918
  186    HA   PHE  22           HA       PHE  22 -29.754  -4.802 -16.214
  187    HB2  PHE  22           2HB      PHE  22 -28.124  -3.845 -17.570
  188    HB3  PHE  22           3HB      PHE  22 -27.345  -4.487 -16.149
  189    HD1  PHE  22           HD1      PHE  22 -27.890  -5.082 -19.825
  190    HD2  PHE  22           HD2      PHE  22 -25.485  -5.940 -16.359
  191    HE1  PHE  22           HE1      PHE  22 -26.203  -6.168 -21.272
  192    HE2  PHE  22           HE2      PHE  22 -23.776  -7.011 -17.819
  193    HZ   PHE  22           HZ       PHE  22 -24.137  -7.129 -20.275
  194    H    GLU  23           H        GLU  23 -30.080  -7.856 -17.332
  195    HA   GLU  23           HA       GLU  23 -30.157  -7.886 -20.000
  196    HB2  GLU  23           2HB      GLU  23 -30.500  -9.841 -18.607
  197    HB3  GLU  23           3HB      GLU  23 -32.098  -9.299 -18.131
  198    HG2  GLU  23           2HG      GLU  23 -33.012  -9.731 -20.279
  199    HG3  GLU  23           3HG      GLU  23 -31.416  -9.757 -21.048
  200    H    GLY  24           H        GLY  24 -32.662  -6.405 -18.004
  201    HA2  GLY  24           HA2      GLY  24 -34.151  -4.743 -18.548
  202    HA3  GLY  24           HA3      GLY  24 -33.681  -4.890 -20.245
  203    H    GLN  25           H        GLN  25 -34.729  -7.907 -19.066
  204    HA   GLN  25           HA       GLN  25 -37.590  -7.395 -19.715
  205    HB2  GLN  25           2HB      GLN  25 -35.885  -9.747 -20.576
  206    HB3  GLN  25           3HB      GLN  25 -37.631  -9.658 -20.753
  207    HG2  GLN  25           2HG      GLN  25 -35.762  -7.573 -22.011
  208    HG3  GLN  25           3HG      GLN  25 -36.171  -9.085 -22.799
  209   HE21  GLN  25          2HE2      GLN  25 -37.602  -6.069 -21.527
  210   HE22  GLN  25          1HE2      GLN  25 -39.142  -6.253 -22.381
  211    H    SER  26           H        SER  26 -35.508  -9.937 -18.222
  212    HA   SER  26           HA       SER  26 -37.591 -10.751 -16.378
  213    HB2  SER  26           2HB      SER  26 -35.746 -12.011 -15.288
  214    HB3  SER  26           3HB      SER  26 -35.837 -12.281 -17.039
  215    HG   SER  26           HG       SER  26 -33.690 -11.890 -16.402
  216    H    ARG  27           H        ARG  27 -34.927  -8.439 -16.190
  217    HA   ARG  27           HA       ARG  27 -36.055  -7.299 -13.660
  218    HB2  ARG  27           2HB      ARG  27 -33.200  -7.070 -14.673
  219    HB3  ARG  27           3HB      ARG  27 -33.819  -6.476 -13.136
  220    HG2  ARG  27           2HG      ARG  27 -33.564  -9.399 -13.982
  221    HG3  ARG  27           3HG      ARG  27 -32.517  -8.543 -12.865
  222    HD2  ARG  27           2HD      ARG  27 -34.289  -8.402 -11.224
  223    HD3  ARG  27           3HD      ARG  27 -35.478  -9.026 -12.358
  224    HE   ARG  27           HE       ARG  27 -34.362 -11.173 -12.352
  225   HH11  ARG  27          2HH1      ARG  27 -33.377  -9.136  -9.598
  226   HH12  ARG  27          1HH1      ARG  27 -32.821 -10.540  -8.734
  227   HH21  ARG  27          2HH2      ARG  27 -33.639 -12.838 -11.130
  228   HH22  ARG  27          1HH2      ARG  27 -32.971 -12.544  -9.554
  229    H    LYS  28           H        LYS  28 -36.130  -4.973 -13.538
  230    HA   LYS  28           HA       LYS  28 -36.602  -3.657 -16.202
  231    HB2  LYS  28           2HB      LYS  28 -38.501  -3.523 -13.843
  232    HB3  LYS  28           3HB      LYS  28 -38.736  -2.914 -15.441
  233    HG2  LYS  28           2HG      LYS  28 -39.973  -4.804 -15.690
  234    HG3  LYS  28           3HG      LYS  28 -38.441  -5.524 -16.129
  235    HD2  LYS  28           2HD      LYS  28 -38.237  -6.517 -13.880
  236    HD3  LYS  28           3HD      LYS  28 -39.525  -5.490 -13.279
  237    HE2  LYS  28           2HE      LYS  28 -40.662  -7.459 -13.524
  238    HE3  LYS  28           3HE      LYS  28 -41.048  -6.654 -15.041
  239    HZ1  LYS  28           HZ1      LYS  28 -40.387  -8.967 -15.389
  240    HZ2  LYS  28           HZ2      LYS  28 -39.280  -8.010 -16.108
  241    HZ3  LYS  28           HZ3      LYS  28 -38.939  -8.732 -14.672
  242    H    PHE  29           H        PHE  29 -36.563  -1.304 -16.219
  243    HA   PHE  29           HA       PHE  29 -35.719   0.159 -13.872
  244    HB2  PHE  29           2HB      PHE  29 -33.368   0.490 -14.410
  245    HB3  PHE  29           3HB      PHE  29 -33.694  -1.192 -14.154
  246    HD1  PHE  29           HD2      PHE  29 -33.495  -2.848 -15.951
  247    HD2  PHE  29           HD1      PHE  29 -32.683   1.337 -16.625
  248    HE1  PHE  29           HE2      PHE  29 -32.275  -3.414 -18.043
  249    HE2  PHE  29           HE1      PHE  29 -31.473   0.757 -18.719
  250    HZ   PHE  29           HZ       PHE  29 -31.276  -1.616 -19.429
  251    H    ILE  30           H        ILE  30 -34.833   2.181 -14.184
  252    HA   ILE  30           HA       ILE  30 -35.369   3.648 -16.699
  253    HB   ILE  30           HB       ILE  30 -36.014   5.591 -15.117
  254   HG12  ILE  30          2HG1      ILE  30 -37.185   5.084 -13.084
  255   HG13  ILE  30          3HG1      ILE  30 -36.821   3.366 -13.209
  256   HG21  ILE  30          1HG2      ILE  30 -38.362   4.959 -15.247
  257   HG22  ILE  30          2HG2      ILE  30 -37.476   4.529 -16.723
  258   HG23  ILE  30          3HG2      ILE  30 -37.900   3.265 -15.544
  259   HD11  ILE  30          3HD1      ILE  30 -34.706   5.544 -12.875
  260   HD12  ILE  30          1HD1      ILE  30 -35.431   4.624 -11.545
  261   HD13  ILE  30          2HD1      ILE  30 -34.447   3.781 -12.745
  262    H    ILE  31           H        ILE  31 -34.306   5.821 -16.613
  263    HA   ILE  31           HA       ILE  31 -31.662   5.750 -15.243
  264    HB   ILE  31           HB       ILE  31 -32.182   7.004 -17.937
  265   HG12  ILE  31          2HG1      ILE  31 -32.638   4.577 -18.224
  266   HG13  ILE  31          3HG1      ILE  31 -31.228   5.141 -19.128
  267   HG21  ILE  31          1HG2      ILE  31 -29.709   6.927 -18.113
  268   HG22  ILE  31          2HG2      ILE  31 -30.265   7.858 -16.715
  269   HG23  ILE  31          3HG2      ILE  31 -29.626   6.230 -16.478
  270   HD11  ILE  31          3HD1      ILE  31 -30.923   2.936 -17.954
  271   HD12  ILE  31          1HD1      ILE  31 -29.694   4.165 -17.597
  272   HD13  ILE  31          2HD1      ILE  31 -30.978   3.841 -16.417
  273    H    ALA  32           H        ALA  32 -31.558   7.285 -13.874
  274    HA   ALA  32           HA       ALA  32 -32.937   9.883 -14.378
  275    HB1  ALA  32           3HB      ALA  32 -33.285  10.029 -11.857
  276    HB2  ALA  32           1HB      ALA  32 -34.313   8.873 -12.748
  277    HB3  ALA  32           2HB      ALA  32 -32.979   8.301 -11.776
  278    H    ASN  33           H        ASN  33 -32.099  11.724 -13.525
  279    HA   ASN  33           HA       ASN  33 -29.174  11.841 -13.426
  280    HB2  ASN  33           2HB      ASN  33 -30.617  13.319 -14.748
  281    HB3  ASN  33           3HB      ASN  33 -31.409  13.907 -13.288
  282   HD21  ASN  33          2HD2      ASN  33 -30.398  15.617 -15.045
  283   HD22  ASN  33          1HD2      ASN  33 -28.917  16.357 -14.444
  284    H    ALA  34           H        ALA  34 -28.215  11.306 -11.534
  285    HA   ALA  34           HA       ALA  34 -29.483  11.631  -8.934
  286    HB1  ALA  34           3HB      ALA  34 -27.894   9.796  -9.483
  287    HB2  ALA  34           1HB      ALA  34 -26.593  10.997  -9.646
  288    HB3  ALA  34           2HB      ALA  34 -27.376  10.740  -8.079
  289    H    ARG  35           H        ARG  35 -27.928  13.857 -10.938
  290    HA   ARG  35           HA       ARG  35 -26.605  15.354  -8.717
  291    HB2  ARG  35           2HB      ARG  35 -26.276  15.841 -11.686
  292    HB3  ARG  35           3HB      ARG  35 -25.247  16.383 -10.372
  293    HG2  ARG  35           2HG      ARG  35 -25.511  13.595 -11.534
  294    HG3  ARG  35           3HG      ARG  35 -24.099  14.631 -11.500
  295    HD2  ARG  35           2HD      ARG  35 -25.337  13.119  -9.169
  296    HD3  ARG  35           3HD      ARG  35 -23.790  12.819  -9.961
  297    HE   ARG  35           HE       ARG  35 -23.567  15.414  -9.024
  298   HH11  ARG  35          1HH1      ARG  35 -24.103  12.281  -7.461
  299   HH12  ARG  35          2HH1      ARG  35 -23.459  12.864  -5.954
  300   HH21  ARG  35          1HH2      ARG  35 -22.741  16.028  -7.062
  301   HH22  ARG  35          2HH2      ARG  35 -22.679  14.895  -5.746
  302    H    VAL  36           H        VAL  36 -29.538  15.475 -10.236
  303    HA   VAL  36           HA       VAL  36 -29.774  18.438 -10.041
  304    HB   VAL  36           HB       VAL  36 -30.134  17.272 -12.260
  305   HG11  VAL  36          1HG1      VAL  36 -32.237  16.274 -12.781
  306   HG12  VAL  36          2HG1      VAL  36 -31.586  15.393 -11.385
  307   HG13  VAL  36          3HG1      VAL  36 -32.881  16.589 -11.166
  308   HG21  VAL  36          3HG2      VAL  36 -32.390  19.012 -11.211
  309   HG22  VAL  36          1HG2      VAL  36 -30.815  19.577 -11.825
  310   HG23  VAL  36          2HG2      VAL  36 -31.941  18.745 -12.910
  311    H    GLU  37           H        GLU  37 -31.309  19.391  -8.774
  312    HA   GLU  37           HA       GLU  37 -32.140  18.012  -6.453
  313    HB2  GLU  37           2HB      GLU  37 -33.279  20.059  -5.849
  314    HB3  GLU  37           3HB      GLU  37 -31.695  20.405  -6.546
  315    HG2  GLU  37           2HG      GLU  37 -32.800  20.985  -8.718
  316    HG3  GLU  37           3HG      GLU  37 -34.374  20.679  -7.982
  317    H    ASN  38           H        ASN  38 -33.841  18.364  -9.456
  318    HA   ASN  38           HA       ASN  38 -36.421  17.456  -8.397
  319    HB2  ASN  38           2HB      ASN  38 -36.081  19.180 -10.232
  320    HB3  ASN  38           3HB      ASN  38 -35.542  17.870 -11.286
  321   HD21  ASN  38          2HD2      ASN  38 -38.318  18.836  -9.176
  322   HD22  ASN  38          1HD2      ASN  38 -39.523  18.142 -10.249
  323    H    CYS  39           H        CYS  39 -33.606  15.796  -9.089
  324    HA   CYS  39           HA       CYS  39 -32.993  13.747  -9.779
  325    HB2  CYS  39           2HB      CYS  39 -33.803  12.012  -8.340
  326    HB3  CYS  39           3HB      CYS  39 -33.656  13.524  -7.435
  327    HG   CYS  39           HG       CYS  39 -36.333  14.096  -7.969
  328    H    ALA  40           H        ALA  40 -34.676  14.742 -11.905
  329    HA   ALA  40           HA       ALA  40 -36.647  12.771 -12.415
  330    HB1  ALA  40           3HB      ALA  40 -35.694  15.033 -14.190
  331    HB2  ALA  40           1HB      ALA  40 -37.138  14.030 -14.463
  332    HB3  ALA  40           2HB      ALA  40 -37.071  15.033 -13.035
  333    H    VAL  41           H        VAL  41 -37.099  11.580 -14.231
  334    HA   VAL  41           HA       VAL  41 -35.082   9.673 -14.970
  335    HB   VAL  41           HB       VAL  41 -38.044   9.920 -15.603
  336   HG11  VAL  41          1HG1      VAL  41 -36.111   7.611 -16.027
  337   HG12  VAL  41          2HG1      VAL  41 -37.884   7.489 -16.165
  338   HG13  VAL  41          3HG1      VAL  41 -36.975   8.503 -17.290
  339   HG21  VAL  41          3HG2      VAL  41 -36.578   8.144 -13.600
  340   HG22  VAL  41          1HG2      VAL  41 -37.564   9.563 -13.192
  341   HG23  VAL  41          2HG2      VAL  41 -38.330   8.160 -13.926
  342    H    ILE  42           H        ILE  42 -33.670  10.682 -16.262
  343    HA   ILE  42           HA       ILE  42 -34.285  12.255 -18.610
  344    HB   ILE  42           HB       ILE  42 -31.837  12.059 -19.010
  345   HG12  ILE  42          2HG1      ILE  42 -31.795  10.389 -16.448
  346   HG13  ILE  42          3HG1      ILE  42 -31.544   9.731 -18.075
  347   HG21  ILE  42          1HG2      ILE  42 -31.192  13.418 -17.107
  348   HG22  ILE  42          2HG2      ILE  42 -32.883  13.777 -17.467
  349   HG23  ILE  42          3HG2      ILE  42 -32.475  12.715 -16.099
  350   HD11  ILE  42          3HD1      ILE  42 -29.556  11.238 -18.284
  351   HD12  ILE  42          1HD1      ILE  42 -29.781  11.663 -16.556
  352   HD13  ILE  42          2HD1      ILE  42 -29.440   9.991 -17.024
  353    H    TYR  43           H        TYR  43 -34.005   8.841 -18.029
  354    HA   TYR  43           HA       TYR  43 -34.891   8.256 -20.740
  355    HB2  TYR  43           2HB      TYR  43 -32.311   8.404 -20.944
  356    HB3  TYR  43           3HB      TYR  43 -32.272   6.910 -20.061
  357    HD1  TYR  43           HD2      TYR  43 -33.839   8.503 -23.068
  358    HD2  TYR  43           HD1      TYR  43 -32.558   4.829 -21.195
  359    HE1  TYR  43           HE2      TYR  43 -34.397   7.247 -25.145
  360    HE2  TYR  43           HE1      TYR  43 -33.124   3.578 -23.271
  361    HH   TYR  43           HH       TYR  43 -34.456   5.199 -26.177
  362    H    CYS  44           H        CYS  44 -35.378   5.901 -21.123
  363    HA   CYS  44           HA       CYS  44 -36.144   4.567 -18.574
  364    HB2  CYS  44           2HB      CYS  44 -38.124   4.981 -20.840
  365    HB3  CYS  44           3HB      CYS  44 -38.450   4.511 -19.168
  366    HG   CYS  44           HG       CYS  44 -37.523   6.851 -18.184
  367    H    ASN  45           H        ASN  45 -36.266   2.271 -18.688
  368    HA   ASN  45           HA       ASN  45 -35.680   1.124 -21.372
  369    HB2  ASN  45           2HB      ASN  45 -34.254   0.504 -19.400
  370    HB3  ASN  45           3HB      ASN  45 -35.634  -0.400 -18.766
  371   HD21  ASN  45          2HD2      ASN  45 -35.250  -2.553 -19.207
  372   HD22  ASN  45          1HD2      ASN  45 -34.775  -3.140 -20.793
  373    H    ASP  46           H        ASP  46 -36.846  -0.650 -22.185
  374    HA   ASP  46           HA       ASP  46 -39.715  -0.304 -22.004
  375    HB2  ASP  46           2HB      ASP  46 -38.072  -2.513 -23.288
  376    HB3  ASP  46           3HB      ASP  46 -39.809  -2.275 -23.501
  377    H    GLY  47           H        GLY  47 -37.455  -2.399 -20.306
  378    HA2  GLY  47           HA2      GLY  47 -39.144  -4.273 -19.087
  379    HA3  GLY  47           HA3      GLY  47 -37.759  -3.499 -18.306
  380    H    PHE  48           H        PHE  48 -38.566  -0.848 -17.933
  381    HA   PHE  48           HA       PHE  48 -40.424  -0.970 -15.771
  382    HB2  PHE  48           2HB      PHE  48 -39.407   1.006 -15.434
  383    HB3  PHE  48           3HB      PHE  48 -38.824   1.085 -17.087
  384    HD1  PHE  48           HD1      PHE  48 -39.968   2.393 -18.799
  385    HD2  PHE  48           HD2      PHE  48 -41.668   2.007 -14.851
  386    HE1  PHE  48           HE1      PHE  48 -41.849   3.851 -19.461
  387    HE2  PHE  48           HE2      PHE  48 -43.529   3.498 -15.513
  388    HZ   PHE  48           HZ       PHE  48 -43.653   4.383 -17.836
  389    H    CYS  49           H        CYS  49 -40.856  -0.280 -19.229
  390    HA   CYS  49           HA       CYS  49 -43.541   0.733 -19.097
  391    HB2  CYS  49           2HB      CYS  49 -41.903   0.987 -21.013
  392    HB3  CYS  49           3HB      CYS  49 -42.228  -0.707 -21.439
  393    HG   CYS  49           HG       CYS  49 -43.564   0.823 -23.062
  394    H    GLU  50           H        GLU  50 -42.206  -2.563 -19.441
  395    HA   GLU  50           HA       GLU  50 -44.848  -3.835 -19.612
  396    HB2  GLU  50           2HB      GLU  50 -42.090  -5.016 -19.133
  397    HB3  GLU  50           3HB      GLU  50 -43.564  -5.924 -19.490
  398    HG2  GLU  50           2HG      GLU  50 -43.785  -4.759 -21.674
  399    HG3  GLU  50           3HG      GLU  50 -42.304  -3.864 -21.362
  400    H    LEU  51           H        LEU  51 -42.551  -3.086 -17.039
  401    HA   LEU  51           HA       LEU  51 -43.616  -4.672 -14.962
  402    HB2  LEU  51           2HB      LEU  51 -41.487  -3.440 -14.902
  403    HB3  LEU  51           3HB      LEU  51 -42.319  -1.922 -14.964
  404    HG   LEU  51           HG       LEU  51 -43.391  -2.333 -12.772
  405   HD11  LEU  51          1HD1      LEU  51 -41.398  -4.605 -12.531
  406   HD12  LEU  51          2HD1      LEU  51 -42.457  -3.962 -11.264
  407   HD13  LEU  51          3HD1      LEU  51 -43.164  -4.792 -12.655
  408   HD21  LEU  51          3HD2      LEU  51 -41.476  -0.880 -13.008
  409   HD22  LEU  51          1HD2      LEU  51 -41.360  -1.792 -11.496
  410   HD23  LEU  51          2HD2      LEU  51 -40.366  -2.265 -12.896
  411    H    CYS  52           H        CYS  52 -44.268  -1.221 -15.705
  412    HA   CYS  52           HA       CYS  52 -46.572  -1.233 -13.847
  413    HB2  CYS  52           2HB      CYS  52 -45.162   1.027 -15.320
  414    HB3  CYS  52           3HB      CYS  52 -46.408   1.189 -14.060
  415    HG   CYS  52           HG       CYS  52 -44.075   1.773 -13.031
  416    H    GLY  53           H        GLY  53 -46.066  -1.331 -17.303
  417    HA2  GLY  53           HA2      GLY  53 -47.645  -1.665 -18.959
  418    HA3  GLY  53           HA3      GLY  53 -48.941  -1.518 -17.775
  419    H    TYR  54           H        TYR  54 -46.765   1.217 -17.813
  420    HA   TYR  54           HA       TYR  54 -48.848   2.874 -19.111
  421    HB2  TYR  54           2HB      TYR  54 -46.395   3.674 -17.520
  422    HB3  TYR  54           3HB      TYR  54 -47.622   4.767 -18.156
  423    HD1  TYR  54           HD2      TYR  54 -50.155   4.113 -17.485
  424    HD2  TYR  54           HD1      TYR  54 -46.597   3.153 -15.244
  425    HE1  TYR  54           HE2      TYR  54 -51.528   3.802 -15.428
  426    HE2  TYR  54           HE1      TYR  54 -47.982   2.801 -13.198
  427    HH   TYR  54           HH       TYR  54 -50.092   2.746 -12.321
  428    H    SER  55           H        SER  55 -46.039   4.543 -19.492
  429    HA   SER  55           HA       SER  55 -45.000   3.427 -21.962
  430    HB2  SER  55           2HB      SER  55 -47.013   4.439 -22.891
  431    HB3  SER  55           3HB      SER  55 -46.684   5.962 -22.046
  432    HG   SER  55           HG       SER  55 -46.009   5.855 -24.313
  433    H    ARG  56           H        ARG  56 -43.076   4.514 -22.582
  434    HA   ARG  56           HA       ARG  56 -41.519   5.861 -20.570
  435    HB2  ARG  56           2HB      ARG  56 -39.970   6.427 -22.407
  436    HB3  ARG  56           3HB      ARG  56 -40.378   4.720 -22.272
  437    HG2  ARG  56           2HG      ARG  56 -41.910   4.894 -24.211
  438    HG3  ARG  56           3HG      ARG  56 -41.586   6.629 -24.326
  439    HD2  ARG  56           2HD      ARG  56 -40.316   5.381 -25.996
  440    HD3  ARG  56           3HD      ARG  56 -39.244   6.207 -24.876
  441    HE   ARG  56           HE       ARG  56 -39.808   3.254 -24.975
  442   HH11  ARG  56          1HH2      ARG  56 -37.647   5.798 -23.830
  443   HH12  ARG  56          2HH2      ARG  56 -36.598   4.609 -23.071
  444   HH21  ARG  56          2HH1      ARG  56 -38.339   1.869 -24.033
  445   HH22  ARG  56          1HH1      ARG  56 -36.957   2.569 -23.184
  446    H    ALA  57           H        ALA  57 -43.655   7.182 -23.064
  447    HA   ALA  57           HA       ALA  57 -42.990   9.942 -22.715
  448    HB1  ALA  57           3HB      ALA  57 -44.220   9.017 -24.649
  449    HB2  ALA  57           1HB      ALA  57 -45.598   8.623 -23.593
  450    HB3  ALA  57           2HB      ALA  57 -45.138  10.317 -23.866
  451    H    GLU  58           H        GLU  58 -44.789   7.793 -20.629
  452    HA   GLU  58           HA       GLU  58 -46.156   9.931 -19.142
  453    HB2  GLU  58           2HB      GLU  58 -45.975   6.946 -18.604
  454    HB3  GLU  58           3HB      GLU  58 -47.023   8.079 -17.790
  455    HG2  GLU  58           2HG      GLU  58 -47.227   7.693 -20.803
  456    HG3  GLU  58           3HG      GLU  58 -47.977   6.577 -19.695
  457    H    VAL  59           H        VAL  59 -43.070   8.291 -19.021
  458    HA   VAL  59           HA       VAL  59 -42.587   9.290 -16.238
  459    HB   VAL  59           HB       VAL  59 -40.638   7.736 -16.203
  460   HG11  VAL  59          1HG1      VAL  59 -42.002   5.831 -15.561
  461   HG12  VAL  59          2HG1      VAL  59 -42.813   7.325 -15.061
  462   HG13  VAL  59          3HG1      VAL  59 -43.390   6.450 -16.488
  463   HG21  VAL  59          3HG2      VAL  59 -42.065   6.331 -18.480
  464   HG22  VAL  59          1HG2      VAL  59 -40.627   7.335 -18.706
  465   HG23  VAL  59          2HG2      VAL  59 -40.534   5.876 -17.695
  466    H    MET  60           H        MET  60 -41.650   9.757 -19.529
  467    HA   MET  60           HA       MET  60 -39.158  10.684 -19.523
  468    HB2  MET  60           2HB      MET  60 -41.647  11.400 -21.026
  469    HB3  MET  60           3HB      MET  60 -40.364  12.592 -21.133
  470    HG2  MET  60           2HG      MET  60 -39.977   9.673 -21.822
  471    HG3  MET  60           3HG      MET  60 -40.358  10.951 -22.967
  472    HE1  MET  60           3HE      MET  60 -37.702   8.762 -21.972
  473    HE2  MET  60           1HE      MET  60 -36.276   9.730 -21.530
  474    HE3  MET  60           2HE      MET  60 -37.647   9.595 -20.408
  475    H    GLN  61           H        GLN  61 -38.140  11.815 -18.133
  476    HA   GLN  61           HA       GLN  61 -37.252  13.597 -17.144
  477    HB2  GLN  61           2HB      GLN  61 -39.200  15.268 -18.732
  478    HB3  GLN  61           3HB      GLN  61 -37.670  15.800 -18.028
  479    HG2  GLN  61           2HG      GLN  61 -36.378  14.788 -19.693
  480    HG3  GLN  61           3HG      GLN  61 -37.522  13.486 -19.980
  481   HE21  GLN  61          2HE2      GLN  61 -38.093  13.531 -22.079
  482   HE22  GLN  61          1HE2      GLN  61 -38.686  14.960 -22.900
  483    H    ARG  62           H        ARG  62 -39.552  12.187 -15.903
  484    HA   ARG  62           HA       ARG  62 -40.520  14.303 -14.025
  485    HB2  ARG  62           2HB      ARG  62 -41.296  11.407 -14.508
  486    HB3  ARG  62           3HB      ARG  62 -42.035  12.486 -13.320
  487    HG2  ARG  62           2HG      ARG  62 -42.740  14.024 -15.195
  488    HG3  ARG  62           3HG      ARG  62 -42.013  12.903 -16.366
  489    HD2  ARG  62           2HD      ARG  62 -44.382  12.462 -16.216
  490    HD3  ARG  62           3HD      ARG  62 -43.433  11.097 -15.572
  491    HE   ARG  62           HE       ARG  62 -43.917  12.810 -13.428
  492   HH11  ARG  62          1HH1      ARG  62 -45.670  10.512 -15.399
  493   HH12  ARG  62          2HH1      ARG  62 -46.948  10.290 -14.225
  494   HH21  ARG  62          2HH2      ARG  62 -45.641  12.531 -11.955
  495   HH22  ARG  62          1HH2      ARG  62 -46.905  11.390 -12.306
  496    HA   PRO  63           HA       PRO  63 -37.877  13.118 -10.662
  497    HB2  PRO  63           2HB      PRO  63 -40.419  12.756  -9.067
  498    HB3  PRO  63           3HB      PRO  63 -38.890  13.556  -8.585
  499    HG2  PRO  63           2HG      PRO  63 -40.984  15.053  -9.405
  500    HG3  PRO  63           3HG      PRO  63 -39.338  15.428 -10.006
  501    HD2  PRO  63           2HD      PRO  63 -41.558  13.935 -11.410
  502    HD3  PRO  63           3HD      PRO  63 -40.425  15.162 -12.056
  503    H    CYS  64           H        CYS  64 -36.870  11.260 -10.097
  504    HA   CYS  64           HA       CYS  64 -37.909   8.681 -10.802
  505    HB2  CYS  64           2HB      CYS  64 -35.533   9.454 -10.856
  506    HB3  CYS  64           3HB      CYS  64 -35.492   9.357  -9.093
  507    HG   CYS  64           HG       CYS  64 -36.442   6.800  -9.131
  508    H    THR  65           H        THR  65 -38.517  10.547  -7.970
  509    HA   THR  65           HA       THR  65 -38.871   8.561  -6.015
  510    HB   THR  65           HB       THR  65 -40.787  10.742  -5.738
  511    HG1  THR  65           HG1      THR  65 -39.289  12.391  -5.645
  512   HG21  THR  65          1HG2      THR  65 -38.229  10.072  -4.233
  513   HG22  THR  65          2HG2      THR  65 -39.541  11.134  -3.683
  514   HG23  THR  65          3HG2      THR  65 -39.834   9.401  -3.882
  515    H    CYS  66           H        CYS  66 -39.674   6.838  -6.941
  516    HA   CYS  66           HA       CYS  66 -41.782   6.440  -8.593
  517    HB2  CYS  66           2HB      CYS  66 -41.654   4.078  -7.875
  518    HB3  CYS  66           3HB      CYS  66 -40.077   4.813  -8.162
  519    HG   CYS  66           HG       CYS  66 -39.842   3.227  -6.115
  520    H    ASP  67           H        ASP  67 -42.243   7.409  -5.369
  521    HA   ASP  67           HA       ASP  67 -44.809   6.370  -4.844
  522    HB2  ASP  67           2HB      ASP  67 -45.103   8.072  -3.264
  523    HB3  ASP  67           3HB      ASP  67 -43.399   7.642  -3.228
  524    H    PHE  68           H        PHE  68 -43.885   8.696  -7.296
  525    HA   PHE  68           HA       PHE  68 -46.453   9.740  -7.852
  526    HB2  PHE  68           2HB      PHE  68 -45.692  10.302  -9.970
  527    HB3  PHE  68           3HB      PHE  68 -44.283  10.392  -8.941
  528    HD1  PHE  68           HD2      PHE  68 -46.014   8.304 -11.545
  529    HD2  PHE  68           HD1      PHE  68 -42.299   9.190  -9.550
  530    HE1  PHE  68           HE2      PHE  68 -44.796   6.856 -13.147
  531    HE2  PHE  68           HE1      PHE  68 -41.095   7.700 -11.113
  532    HZ   PHE  68           HZ       PHE  68 -42.345   6.502 -12.899
  533    H    LEU  69           H        LEU  69 -45.435   6.416  -8.243
  534    HA   LEU  69           HA       LEU  69 -48.174   5.770  -9.134
  535    HB2  LEU  69           2HB      LEU  69 -47.387   3.905 -10.507
  536    HB3  LEU  69           3HB      LEU  69 -46.978   5.502 -11.090
  537    HG   LEU  69           HG       LEU  69 -44.629   5.215 -10.334
  538   HD11  LEU  69          1HD1      LEU  69 -44.884   3.569  -8.534
  539   HD12  LEU  69          2HD1      LEU  69 -45.490   2.363  -9.689
  540   HD13  LEU  69          3HD1      LEU  69 -43.811   2.941  -9.784
  541   HD21  LEU  69          3HD2      LEU  69 -45.663   2.958 -12.099
  542   HD22  LEU  69          1HD2      LEU  69 -45.379   4.622 -12.638
  543   HD23  LEU  69          2HD2      LEU  69 -44.014   3.636 -12.093
  544    H    HIS  70           H        HIS  70 -46.929   5.806  -6.335
  545    HA   HIS  70           HA       HIS  70 -47.180   3.060  -5.443
  546    HB2  HIS  70           2HB      HIS  70 -47.371   5.748  -4.060
  547    HB3  HIS  70           3HB      HIS  70 -47.722   4.247  -3.218
  548    HD2  HIS  70           HD2      HIS  70 -45.482   5.528  -1.876
  549    HE1  HIS  70           HE1      HIS  70 -42.669   3.513  -4.369
  550    HE2  HIS  70           HE2      HIS  70 -42.959   4.814  -2.203
  551    H    GLY  71           H        GLY  71 -48.866   2.040  -4.395
  552    HA2  GLY  71           HA2      GLY  71 -51.614   2.893  -5.238
  553    HA3  GLY  71           HA3      GLY  71 -51.071   1.236  -5.033
  554    HA   PRO  72           HA       PRO  72 -53.253   2.849  -1.165
  555    HB2  PRO  72           2HB      PRO  72 -55.293   1.001  -1.056
  556    HB3  PRO  72           3HB      PRO  72 -55.369   2.517  -2.000
  557    HG2  PRO  72           2HG      PRO  72 -54.592  -0.248  -2.994
  558    HG3  PRO  72           3HG      PRO  72 -55.797   0.881  -3.698
  559    HD2  PRO  72           2HD      PRO  72 -53.290   0.769  -4.680
  560    HD3  PRO  72           3HD      PRO  72 -54.096   2.350  -4.475
  561    H    ARG  73           H        ARG  73 -51.693  -0.050  -2.137
  562    HA   ARG  73           HA       ARG  73 -51.629  -1.278   0.577
  563    HB2  ARG  73           2HB      ARG  73 -50.407  -2.034  -2.123
  564    HB3  ARG  73           3HB      ARG  73 -50.144  -2.940  -0.636
  565    HG2  ARG  73           2HG      ARG  73 -52.593  -3.369  -0.428
  566    HG3  ARG  73           3HG      ARG  73 -52.849  -2.491  -1.941
  567    HD2  ARG  73           2HD      ARG  73 -52.817  -4.715  -2.630
  568    HD3  ARG  73           3HD      ARG  73 -51.189  -4.139  -3.022
  569    HE   ARG  73           HE       ARG  73 -51.146  -5.256  -0.400
  570   HH11  ARG  73          1HH2      ARG  73 -51.489  -6.432  -3.701
  571   HH12  ARG  73          2HH2      ARG  73 -51.066  -8.061  -3.238
  572   HH21  ARG  73          1HH1      ARG  73 -50.527  -7.331   0.074
  573   HH22  ARG  73          2HH1      ARG  73 -50.476  -8.534  -1.179
  574    H    THR  74           H        THR  74 -49.838   1.180  -1.066
  575    HA   THR  74           HA       THR  74 -47.263   0.255  -0.145
  576    HB   THR  74           HB       THR  74 -47.748   2.995  -1.318
  577    HG1  THR  74           HG1      THR  74 -47.023   1.361  -3.199
  578   HG21  THR  74          1HG2      THR  74 -45.440   1.021  -1.121
  579   HG22  THR  74          2HG2      THR  74 -45.487   2.244  -2.410
  580   HG23  THR  74          3HG2      THR  74 -45.475   2.753  -0.722
  581    H    GLN  75           H        GLN  75 -45.807   1.077   1.264
  582    HA   GLN  75           HA       GLN  75 -46.937   2.406   3.614
  583    HB2  GLN  75           2HB      GLN  75 -44.185   1.276   3.063
  584    HB3  GLN  75           3HB      GLN  75 -44.724   1.899   4.609
  585    HG2  GLN  75           2HG      GLN  75 -45.970  -0.511   3.215
  586    HG3  GLN  75           3HG      GLN  75 -44.710  -0.581   4.445
  587   HE21  GLN  75          2HE2      GLN  75 -48.175  -0.124   3.945
  588   HE22  GLN  75          1HE2      GLN  75 -48.545   0.011   5.657
  589    H    ARG  76           H        ARG  76 -46.475   4.339   4.413
  590    HA   ARG  76           HA       ARG  76 -45.341   6.408   2.681
  591    HB2  ARG  76           2HB      ARG  76 -46.026   6.636   5.615
  592    HB3  ARG  76           3HB      ARG  76 -45.869   7.951   4.451
  593    HG2  ARG  76           2HG      ARG  76 -48.097   5.878   4.617
  594    HG3  ARG  76           3HG      ARG  76 -48.211   7.619   4.870
  595    HD2  ARG  76           2HD      ARG  76 -47.609   7.970   2.447
  596    HD3  ARG  76           3HD      ARG  76 -47.573   6.221   2.233
  597    HE   ARG  76           HE       ARG  76 -49.888   6.101   2.309
  598   HH11  ARG  76          1HH1      ARG  76 -49.003   9.400   3.116
  599   HH12  ARG  76          2HH1      ARG  76 -50.642   9.969   2.953
  600   HH21  ARG  76          2HH2      ARG  76 -51.946   6.898   2.126
  601   HH22  ARG  76          1HH2      ARG  76 -52.258   8.586   2.409
  602    H    ARG  77           H        ARG  77 -44.225   4.740   5.593
  603    HA   ARG  77           HA       ARG  77 -41.649   5.935   5.840
  604    HB2  ARG  77           2HB      ARG  77 -41.048   3.841   7.026
  605    HB3  ARG  77           3HB      ARG  77 -42.555   4.601   7.564
  606    HG2  ARG  77           2HG      ARG  77 -43.908   2.958   6.436
  607    HG3  ARG  77           3HG      ARG  77 -42.472   2.158   5.757
  608    HD2  ARG  77           2HD      ARG  77 -41.753   1.431   7.911
  609    HD3  ARG  77           3HD      ARG  77 -42.917   2.487   8.743
  610    HE   ARG  77           HE       ARG  77 -44.536   0.861   7.200
  611   HH11  ARG  77          1HH1      ARG  77 -42.184   0.146   9.710
  612   HH12  ARG  77          2HH1      ARG  77 -43.052  -1.282  10.205
  613   HH21  ARG  77          1HH2      ARG  77 -45.551  -0.874   7.855
  614   HH22  ARG  77          2HH2      ARG  77 -44.939  -1.865   9.168
  615    H    ALA  78           H        ALA  78 -42.696   3.356   3.690
  616    HA   ALA  78           HA       ALA  78 -40.091   2.682   2.599
  617    HB1  ALA  78           3HB      ALA  78 -42.891   2.364   1.392
  618    HB2  ALA  78           1HB      ALA  78 -41.432   1.709   0.754
  619    HB3  ALA  78           2HB      ALA  78 -41.971   1.158   2.331
  620    H    ALA  79           H        ALA  79 -42.772   4.800   1.460
  621    HA   ALA  79           HA       ALA  79 -41.345   5.842  -0.803
  622    HB1  ALA  79           3HB      ALA  79 -43.628   7.102   0.790
  623    HB2  ALA  79           1HB      ALA  79 -43.237   7.373  -0.921
  624    HB3  ALA  79           2HB      ALA  79 -43.829   5.779  -0.374
  625    H    ALA  80           H        ALA  80 -41.573   7.011   2.540
  626    HA   ALA  80           HA       ALA  80 -40.239   9.492   2.178
  627    HB1  ALA  80           3HB      ALA  80 -40.028   9.396   4.650
  628    HB2  ALA  80           1HB      ALA  80 -41.663   8.970   4.100
  629    HB3  ALA  80           2HB      ALA  80 -40.539   7.692   4.616
  630    H    GLN  81           H        GLN  81 -38.909   6.345   3.459
  631    HA   GLN  81           HA       GLN  81 -36.178   7.090   3.523
  632    HB2  GLN  81           2HB      GLN  81 -37.557   4.456   2.967
  633    HB3  GLN  81           3HB      GLN  81 -35.795   4.605   3.060
  634    HG2  GLN  81           2HG      GLN  81 -35.866   5.382   5.338
  635    HG3  GLN  81           3HG      GLN  81 -37.627   5.508   5.314
  636   HE21  GLN  81          2HE2      GLN  81 -38.857   3.470   4.962
  637   HE22  GLN  81          1HE2      GLN  81 -38.183   1.971   5.624
  638    H    ILE  82           H        ILE  82 -38.100   5.978   0.654
  639    HA   ILE  82           HA       ILE  82 -35.824   6.062  -1.119
  640    HB   ILE  82           HB       ILE  82 -38.805   6.101  -1.512
  641   HG12  ILE  82          2HG1      ILE  82 -36.631   4.212  -2.547
  642   HG13  ILE  82          3HG1      ILE  82 -37.277   4.088  -0.908
  643   HG21  ILE  82          1HG2      ILE  82 -38.375   6.006  -3.998
  644   HG22  ILE  82          2HG2      ILE  82 -38.037   7.581  -3.270
  645   HG23  ILE  82          3HG2      ILE  82 -36.690   6.496  -3.671
  646   HD11  ILE  82          3HD1      ILE  82 -38.433   2.539  -2.305
  647   HD12  ILE  82          1HD1      ILE  82 -39.534   3.842  -1.751
  648   HD13  ILE  82          2HD1      ILE  82 -38.917   3.827  -3.427
  649    H    ALA  83           H        ALA  83 -38.332   8.557  -0.446
  650    HA   ALA  83           HA       ALA  83 -37.244  10.619  -2.013
  651    HB1  ALA  83           3HB      ALA  83 -38.520  10.886   0.739
  652    HB2  ALA  83           1HB      ALA  83 -38.387  12.145  -0.494
  653    HB3  ALA  83           2HB      ALA  83 -39.405  10.708  -0.793
  654    H    GLN  84           H        GLN  84 -36.186   9.501   1.201
  655    HA   GLN  84           HA       GLN  84 -34.235  11.582   1.644
  656    HB2  GLN  84           2HB      GLN  84 -34.044   8.811   2.816
  657    HB3  GLN  84           3HB      GLN  84 -33.299  10.293   3.362
  658    HG2  GLN  84           2HG      GLN  84 -36.111   9.391   3.726
  659    HG3  GLN  84           3HG      GLN  84 -34.979   9.939   4.906
  660   HE21  GLN  84          1HE2      GLN  84 -37.564  10.873   2.848
  661   HE22  GLN  84          2HE2      GLN  84 -37.522  12.601   3.230
  662    H    ALA  85           H        ALA  85 -34.085   8.382   0.024
  663    HA   ALA  85           HA       ALA  85 -31.220   8.518  -0.427
  664    HB1  ALA  85           3HB      ALA  85 -33.363   6.861  -1.828
  665    HB2  ALA  85           1HB      ALA  85 -31.612   6.590  -1.888
  666    HB3  ALA  85           2HB      ALA  85 -32.483   6.389  -0.356
  667    H    LEU  86           H        LEU  86 -34.043   9.707  -2.208
  668    HA   LEU  86           HA       LEU  86 -32.469  10.333  -4.574
  669    HB2  LEU  86           2HB      LEU  86 -35.271  11.275  -3.940
  670    HB3  LEU  86           3HB      LEU  86 -34.439  11.283  -5.487
  671    HG   LEU  86           HG       LEU  86 -35.775   9.048  -4.026
  672   HD11  LEU  86          1HD1      LEU  86 -35.392   9.688  -6.966
  673   HD12  LEU  86          2HD1      LEU  86 -36.535   8.513  -6.274
  674   HD13  LEU  86          3HD1      LEU  86 -36.731  10.259  -5.969
  675   HD21  LEU  86          3HD2      LEU  86 -33.446   8.545  -5.959
  676   HD22  LEU  86          1HD2      LEU  86 -33.569   7.962  -4.284
  677   HD23  LEU  86          2HD2      LEU  86 -34.659   7.326  -5.504
  678    H    LEU  87           H        LEU  87 -33.684  12.271  -1.833
  679    HA   LEU  87           HA       LEU  87 -32.429  14.715  -2.857
  680    HB2  LEU  87           2HB      LEU  87 -32.650  15.637  -0.609
  681    HB3  LEU  87           3HB      LEU  87 -34.153  15.085  -1.344
  682    HG   LEU  87           HG       LEU  87 -33.459  12.921   0.196
  683   HD11  LEU  87          1HD1      LEU  87 -32.666  15.383   1.785
  684   HD12  LEU  87          2HD1      LEU  87 -32.861  13.735   2.411
  685   HD13  LEU  87          3HD1      LEU  87 -31.561  14.097   1.255
  686   HD21  LEU  87          3HD2      LEU  87 -35.029  15.382   1.090
  687   HD22  LEU  87          1HD2      LEU  87 -35.676  14.041   0.123
  688   HD23  LEU  87          2HD2      LEU  87 -35.169  13.756   1.793
  689    H    GLY  88           H        GLY  88 -31.253  11.953  -0.995
  690    HA2  GLY  88           HA2      GLY  88 -28.989  11.323  -1.513
  691    HA3  GLY  88           HA3      GLY  88 -28.489  13.011  -1.516
  692    H    ALA  89           H        ALA  89 -30.613  12.067   1.083
  693    HA   ALA  89           HA       ALA  89 -28.811  12.662   3.177
  694    HB1  ALA  89           3HB      ALA  89 -31.246  12.505   3.471
  695    HB2  ALA  89           1HB      ALA  89 -31.167  10.745   3.194
  696    HB3  ALA  89           2HB      ALA  89 -30.403  11.461   4.626
  697    H    GLU  90           H        GLU  90 -29.641   9.433   1.840
  698    HA   GLU  90           HA       GLU  90 -26.916   8.488   2.132
  699    HB2  GLU  90           2HB      GLU  90 -27.451   6.483   3.447
  700    HB3  GLU  90           3HB      GLU  90 -27.644   7.964   4.375
  701    HG2  GLU  90           2HG      GLU  90 -30.140   7.830   3.981
  702    HG3  GLU  90           3HG      GLU  90 -29.887   6.268   3.197
  703    H    GLU  91           H        GLU  91 -26.429   6.870   0.658
  704    HA   GLU  91           HA       GLU  91 -28.496   6.029  -1.298
  705    HB2  GLU  91           2HB      GLU  91 -26.296   6.667  -2.070
  706    HB3  GLU  91           3HB      GLU  91 -25.509   5.451  -1.065
  707    HG2  GLU  91           2HG      GLU  91 -27.621   4.661  -3.084
  708    HG3  GLU  91           3HG      GLU  91 -25.994   5.049  -3.634
  709    H    ARG  92           H        ARG  92 -29.888   4.498  -0.625
  710    HA   ARG  92           HA       ARG  92 -28.895   1.939   0.386
  711    HB2  ARG  92           2HB      ARG  92 -29.300   3.703   2.336
  712    HB3  ARG  92           3HB      ARG  92 -30.993   3.327   2.112
  713    HG2  ARG  92           2HG      ARG  92 -28.935   1.107   2.505
  714    HG3  ARG  92           3HG      ARG  92 -29.471   2.088   3.879
  715    HD2  ARG  92           2HD      ARG  92 -31.870   1.467   3.237
  716    HD3  ARG  92           3HD      ARG  92 -31.130   0.283   2.137
  717    HE   ARG  92           HE       ARG  92 -30.092   0.004   4.805
  718   HH11  ARG  92          2HH1      ARG  92 -32.874  -0.837   2.835
  719   HH12  ARG  92          1HH1      ARG  92 -33.305  -2.182   3.868
  720   HH21  ARG  92          1HH2      ARG  92 -30.690  -1.739   6.059
  721   HH22  ARG  92          2HH2      ARG  92 -32.090  -2.679   5.635
  722    H    LYS  93           H        LYS  93 -30.298   0.266   0.045
  723    HA   LYS  93           HA       LYS  93 -32.466   0.601  -1.894
  724    HB2  LYS  93           2HB      LYS  93 -30.819  -1.285  -1.829
  725    HB3  LYS  93           3HB      LYS  93 -31.615  -1.868  -0.359
  726    HG2  LYS  93           2HG      LYS  93 -33.769  -1.887  -1.910
  727    HG3  LYS  93           3HG      LYS  93 -32.580  -1.809  -3.209
  728    HD2  LYS  93           2HD      LYS  93 -32.741  -3.909  -1.017
  729    HD3  LYS  93           3HD      LYS  93 -33.214  -4.127  -2.706
  730    HE2  LYS  93           2HE      LYS  93 -30.826  -3.552  -3.354
  731    HE3  LYS  93           3HE      LYS  93 -30.407  -3.591  -1.630
  732    HZ1  LYS  93           HZ1      LYS  93 -29.927  -5.725  -2.556
  733    HZ2  LYS  93           HZ2      LYS  93 -31.301  -5.959  -1.691
  734    HZ3  LYS  93           HZ3      LYS  93 -31.352  -5.801  -3.340
  735    H    VAL  94           H        VAL  94 -34.652   0.329  -1.596
  736    HA   VAL  94           HA       VAL  94 -35.713  -0.305   1.122
  737    HB   VAL  94           HB       VAL  94 -36.943   1.900  -0.524
  738   HG11  VAL  94          1HG1      VAL  94 -36.959   1.350   2.478
  739   HG12  VAL  94          2HG1      VAL  94 -37.866   2.620   1.627
  740   HG13  VAL  94          3HG1      VAL  94 -38.268   0.936   1.352
  741   HG21  VAL  94          3HG2      VAL  94 -35.837   3.600   0.922
  742   HG22  VAL  94          1HG2      VAL  94 -34.803   2.326   1.607
  743   HG23  VAL  94          2HG2      VAL  94 -34.686   2.775  -0.114
  744    H    GLU  95           H        GLU  95 -37.714  -1.262   1.156
  745    HA   GLU  95           HA       GLU  95 -38.628  -2.552  -1.338
  746    HB2  GLU  95           2HB      GLU  95 -39.987  -3.922   0.098
  747    HB3  GLU  95           3HB      GLU  95 -38.334  -3.876   0.732
  748    HG2  GLU  95           2HG      GLU  95 -39.048  -2.170   2.417
  749    HG3  GLU  95           3HG      GLU  95 -40.702  -2.273   1.821
  750    H    ILE  96           H        ILE  96 -40.825  -2.267  -2.085
  751    HA   ILE  96           HA       ILE  96 -42.512  -0.200  -1.014
  752    HB   ILE  96           HB       ILE  96 -42.431   0.905  -3.515
  753   HG12  ILE  96          2HG1      ILE  96 -40.198   1.573  -4.133
  754   HG13  ILE  96          3HG1      ILE  96 -39.482   0.576  -2.861
  755   HG21  ILE  96          1HG2      ILE  96 -42.551   2.109  -1.359
  756   HG22  ILE  96          2HG2      ILE  96 -40.773   1.938  -1.231
  757   HG23  ILE  96          3HG2      ILE  96 -41.486   2.865  -2.542
  758   HD11  ILE  96          3HD1      ILE  96 -41.143  -0.545  -5.142
  759   HD12  ILE  96          1HD1      ILE  96 -39.360  -0.426  -5.153
  760   HD13  ILE  96          2HD1      ILE  96 -40.184  -1.443  -3.969
  761    H    ALA  97           H        ALA  97 -44.481   0.022  -2.197
  762    HA   ALA  97           HA       ALA  97 -45.121  -2.321  -3.946
  763    HB1  ALA  97           3HB      ALA  97 -46.912  -0.876  -1.973
  764    HB2  ALA  97           1HB      ALA  97 -47.489  -2.048  -3.161
  765    HB3  ALA  97           2HB      ALA  97 -46.364  -2.549  -1.897
  766    H    PHE  98           H        PHE  98 -46.374  -2.089  -5.738
  767    HA   PHE  98           HA       PHE  98 -46.803   0.691  -6.786
  768    HB2  PHE  98           2HB      PHE  98 -45.563  -1.662  -8.266
  769    HB3  PHE  98           3HB      PHE  98 -45.949  -0.099  -8.969
  770    HD1  PHE  98           HD2      PHE  98 -44.921   1.796  -6.879
  771    HD2  PHE  98           HD1      PHE  98 -43.192  -1.827  -8.492
  772    HE1  PHE  98           HE2      PHE  98 -42.673   2.680  -6.467
  773    HE2  PHE  98           HE1      PHE  98 -40.940  -0.915  -8.076
  774    HZ   PHE  98           HZ       PHE  98 -40.659   1.356  -7.096
  775    H    TYR  99           H        TYR  99 -48.382   0.887  -8.454
  776    HA   TYR  99           HA       TYR  99 -50.048  -1.523  -8.872
  777    HB2  TYR  99           2HB      TYR  99 -52.069  -0.450  -8.812
  778    HB3  TYR  99           3HB      TYR  99 -51.226   0.137  -7.396
  779    HD1  TYR  99           HD2      TYR  99 -50.117   2.481  -7.540
  780    HD2  TYR  99           HD1      TYR  99 -52.971   1.036 -10.421
  781    HE1  TYR  99           HE2      TYR  99 -50.569   4.824  -8.268
  782    HE2  TYR  99           HE1      TYR  99 -53.422   3.367 -11.152
  783    HH   TYR  99           HH       TYR  99 -52.926   5.586 -10.859
  784    H    ARG 100           H        ARG 100 -50.600  -2.058 -10.847
  785    HA   ARG 100           HA       ARG 100 -49.279  -0.774 -13.113
  786    HB2  ARG 100           2HB      ARG 100 -51.213  -3.122 -13.030
  787    HB3  ARG 100           3HB      ARG 100 -50.168  -2.655 -14.382
  788    HG2  ARG 100           2HG      ARG 100 -48.182  -3.051 -12.759
  789    HG3  ARG 100           3HG      ARG 100 -49.372  -3.824 -11.697
  790    HD2  ARG 100           2HD      ARG 100 -48.471  -5.599 -12.958
  791    HD3  ARG 100           3HD      ARG 100 -50.029  -5.285 -13.717
  792    HE   ARG 100           HE       ARG 100 -47.336  -4.379 -14.701
  793   HH11  ARG 100          2HH1      ARG 100 -50.740  -4.850 -15.609
  794   HH12  ARG 100          1HH1      ARG 100 -50.321  -5.002 -17.289
  795   HH21  ARG 100          2HH2      ARG 100 -46.950  -4.656 -16.908
  796   HH22  ARG 100          1HH2      ARG 100 -48.302  -4.789 -17.991
  797    H    LYS 101           H        LYS 101 -50.399  -0.470 -15.137
  798    HA   LYS 101           HA       LYS 101 -52.426   1.507 -15.147
  799    HB2  LYS 101           2HB      LYS 101 -50.740   1.238 -16.850
  800    HB3  LYS 101           3HB      LYS 101 -51.290  -0.372 -17.262
  801    HG2  LYS 101           2HG      LYS 101 -53.262   1.900 -17.547
  802    HG3  LYS 101           3HG      LYS 101 -51.922   1.806 -18.695
  803    HD2  LYS 101           2HD      LYS 101 -52.495  -0.460 -19.330
  804    HD3  LYS 101           3HD      LYS 101 -53.791  -0.535 -18.132
  805    HE2  LYS 101           2HE      LYS 101 -54.984   1.312 -19.258
  806    HE3  LYS 101           3HE      LYS 101 -53.680   1.450 -20.447
  807    HZ1  LYS 101           HZ1      LYS 101 -54.205  -0.814 -21.185
  808    HZ2  LYS 101           HZ2      LYS 101 -55.414  -0.939 -20.089
  809    HZ3  LYS 101           HZ3      LYS 101 -55.526   0.133 -21.311
  810    H    ASP 102           H        ASP 102 -52.735  -2.013 -15.364
  811    HA   ASP 102           HA       ASP 102 -55.591  -1.964 -15.941
  812    HB2  ASP 102           2HB      ASP 102 -55.458  -4.362 -15.742
  813    HB3  ASP 102           3HB      ASP 102 -54.093  -3.778 -16.687
  814    H    GLY 103           H        GLY 103 -53.900  -1.330 -13.071
  815    HA2  GLY 103           HA2      GLY 103 -54.924  -0.671 -11.074
  816    HA3  GLY 103           HA3      GLY 103 -56.314  -1.701 -11.399
  817    H    SER 104           H        SER 104 -53.631  -3.681 -11.932
  818    HA   SER 104           HA       SER 104 -53.989  -5.109  -9.425
  819    HB2  SER 104           2HB      SER 104 -51.846  -5.401 -11.567
  820    HB3  SER 104           3HB      SER 104 -52.069  -6.488 -10.184
  821    HG   SER 104           HG       SER 104 -53.796  -5.992 -12.373
  822    H    CYS 105           H        CYS 105 -52.946  -4.881  -7.504
  823    HA   CYS 105           HA       CYS 105 -50.636  -2.990  -7.325
  824    HB2  CYS 105           2HB      CYS 105 -52.826  -1.960  -6.770
  825    HB3  CYS 105           3HB      CYS 105 -53.077  -3.195  -5.523
  826    HG   CYS 105           HG       CYS 105 -52.420  -1.000  -4.345
  827    H    PHE 106           H        PHE 106 -48.888  -3.719  -6.254
  828    HA   PHE 106           HA       PHE 106 -49.100  -5.864  -4.216
  829    HB2  PHE 106           2HB      PHE 106 -47.367  -7.202  -5.567
  830    HB3  PHE 106           3HB      PHE 106 -49.042  -7.253  -6.068
  831    HD1  PHE 106           HD2      PHE 106 -45.771  -5.553  -6.872
  832    HD2  PHE 106           HD1      PHE 106 -49.687  -6.703  -8.271
  833    HE1  PHE 106           HE2      PHE 106 -45.179  -4.803  -9.159
  834    HE2  PHE 106           HE1      PHE 106 -49.079  -5.982 -10.560
  835    HZ   PHE 106           HZ       PHE 106 -46.822  -5.019 -11.011
  836    H    LEU 107           H        LEU 107 -47.363  -6.216  -2.912
  837    HA   LEU 107           HA       LEU 107 -45.020  -4.366  -3.001
  838    HB2  LEU 107           2HB      LEU 107 -46.504  -4.607  -0.873
  839    HB3  LEU 107           3HB      LEU 107 -45.909  -6.236  -0.773
  840    HG   LEU 107           HG       LEU 107 -44.595  -5.164   0.750
  841   HD11  LEU 107          1HD1      LEU 107 -42.790  -4.652  -1.623
  842   HD12  LEU 107          2HD1      LEU 107 -42.317  -4.941   0.050
  843   HD13  LEU 107          3HD1      LEU 107 -43.012  -6.261  -0.887
  844   HD21  LEU 107          3HD2      LEU 107 -45.375  -2.922   0.388
  845   HD22  LEU 107          1HD2      LEU 107 -43.620  -2.971   0.625
  846   HD23  LEU 107          2HD2      LEU 107 -44.284  -2.777  -1.003
  847    H    CYS 108           H        CYS 108 -43.174  -5.258  -3.767
  848    HA   CYS 108           HA       CYS 108 -42.661  -8.181  -3.450
  849    HB2  CYS 108           2HB      CYS 108 -42.032  -6.504  -5.914
  850    HB3  CYS 108           3HB      CYS 108 -41.526  -8.188  -5.645
  851    HG   CYS 108           HG       CYS 108 -44.636  -7.036  -5.594
  852    H    LEU 109           H        LEU 109 -40.174  -8.594  -3.623
  853    HA   LEU 109           HA       LEU 109 -38.874  -6.654  -1.845
  854    HB2  LEU 109           2HB      LEU 109 -38.864  -9.285  -1.754
  855    HB3  LEU 109           3HB      LEU 109 -37.575  -9.164  -2.923
  856    HG   LEU 109           HG       LEU 109 -36.682  -9.438  -0.710
  857   HD11  LEU 109          1HD1      LEU 109 -36.225  -6.516  -1.427
  858   HD12  LEU 109          2HD1      LEU 109 -35.197  -7.545  -0.410
  859   HD13  LEU 109          3HD1      LEU 109 -35.368  -7.908  -2.135
  860   HD21  LEU 109          3HD2      LEU 109 -38.096  -6.894   0.182
  861   HD22  LEU 109          1HD2      LEU 109 -38.626  -8.549   0.557
  862   HD23  LEU 109          2HD2      LEU 109 -37.068  -7.960   1.154
  863    H    VAL 110           H        VAL 110 -39.275  -5.114  -3.725
  864    HA   VAL 110           HA       VAL 110 -37.809  -5.270  -6.135
  865    HB   VAL 110           HB       VAL 110 -38.765  -2.751  -4.803
  866   HG11  VAL 110          1HG1      VAL 110 -39.059  -1.932  -7.152
  867   HG12  VAL 110          2HG1      VAL 110 -37.378  -2.237  -6.751
  868   HG13  VAL 110          3HG1      VAL 110 -38.287  -3.423  -7.726
  869   HG21  VAL 110          3HG2      VAL 110 -40.843  -3.038  -6.211
  870   HG22  VAL 110          1HG2      VAL 110 -40.266  -4.651  -6.670
  871   HG23  VAL 110          2HG2      VAL 110 -40.689  -4.276  -4.984
  872    H    ASP 111           H        ASP 111 -35.984  -4.065  -6.929
  873    HA   ASP 111           HA       ASP 111 -33.907  -3.984  -4.762
  874    HB2  ASP 111           2HB      ASP 111 -33.913  -5.742  -6.633
  875    HB3  ASP 111           3HB      ASP 111 -33.379  -4.432  -7.690
  876    H    VAL 112           H        VAL 112 -34.742  -1.698  -4.370
  877    HA   VAL 112           HA       VAL 112 -34.269   0.238  -6.474
  878    HB   VAL 112           HB       VAL 112 -35.095   0.723  -3.585
  879   HG11  VAL 112          1HG1      VAL 112 -34.523   2.806  -4.821
  880   HG12  VAL 112          2HG1      VAL 112 -35.596   2.304  -6.147
  881   HG13  VAL 112          3HG1      VAL 112 -36.259   2.691  -4.548
  882   HG21  VAL 112          3HG2      VAL 112 -36.747   0.010  -6.042
  883   HG22  VAL 112          1HG2      VAL 112 -36.624  -0.918  -4.535
  884   HG23  VAL 112          2HG2      VAL 112 -37.418   0.656  -4.519
  885    H    VAL 113           H        VAL 113 -31.967  -0.404  -6.623
  886    HA   VAL 113           HA       VAL 113 -30.261   1.264  -4.801
  887    HB   VAL 113           HB       VAL 113 -28.312  -0.031  -5.629
  888   HG11  VAL 113          1HG1      VAL 113 -28.695  -1.920  -4.132
  889   HG12  VAL 113          2HG1      VAL 113 -29.349  -0.423  -3.447
  890   HG13  VAL 113          3HG1      VAL 113 -30.446  -1.621  -4.184
  891   HG21  VAL 113          3HG2      VAL 113 -30.380  -2.000  -6.698
  892   HG22  VAL 113          1HG2      VAL 113 -29.215  -1.081  -7.676
  893   HG23  VAL 113          2HG2      VAL 113 -28.642  -2.294  -6.530
  894    HA   PRO 114           HA       PRO 114 -29.631   3.652  -8.589
  895    HB2  PRO 114           2HB      PRO 114 -28.139   5.663  -7.718
  896    HB3  PRO 114           3HB      PRO 114 -29.780   5.417  -7.106
  897    HG2  PRO 114           2HG      PRO 114 -27.181   4.554  -5.796
  898    HG3  PRO 114           3HG      PRO 114 -28.555   5.448  -5.058
  899    HD2  PRO 114           2HD      PRO 114 -28.245   2.702  -4.873
  900    HD3  PRO 114           3HD      PRO 114 -29.840   3.512  -4.874
  901    H    VAL 115           H        VAL 115 -27.106   4.927  -9.323
  902    HA   VAL 115           HA       VAL 115 -25.048   2.787  -9.128
  903    HB   VAL 115           HB       VAL 115 -24.301   3.264 -11.430
  904   HG11  VAL 115          1HG1      VAL 115 -25.503   1.213 -10.852
  905   HG12  VAL 115          2HG1      VAL 115 -27.056   2.013 -11.162
  906   HG13  VAL 115          3HG1      VAL 115 -25.905   1.753 -12.490
  907   HG21  VAL 115          3HG2      VAL 115 -25.490   5.360 -11.822
  908   HG22  VAL 115          1HG2      VAL 115 -25.838   4.161 -13.075
  909   HG23  VAL 115          2HG2      VAL 115 -27.043   4.498 -11.806
  910    H    LYS 116           H        LYS 116 -23.133   3.315  -8.667
  911    HA   LYS 116           HA       LYS 116 -22.308   6.160  -8.441
  912    HB2  LYS 116           2HB      LYS 116 -21.120   5.536  -6.345
  913    HB3  LYS 116           3HB      LYS 116 -22.872   5.535  -6.198
  914    HG2  LYS 116           2HG      LYS 116 -21.368   2.950  -6.695
  915    HG3  LYS 116           3HG      LYS 116 -21.392   3.718  -5.104
  916    HD2  LYS 116           2HD      LYS 116 -23.882   3.657  -5.071
  917    HD3  LYS 116           3HD      LYS 116 -23.872   2.843  -6.633
  918    HE2  LYS 116           2HE      LYS 116 -24.140   1.103  -5.100
  919    HE3  LYS 116           3HE      LYS 116 -22.441   1.014  -5.579
  920    HZ1  LYS 116           HZ1      LYS 116 -22.711   0.822  -3.169
  921    HZ2  LYS 116           HZ2      LYS 116 -21.911   2.213  -3.484
  922    HZ3  LYS 116           HZ3      LYS 116 -23.505   2.247  -3.083
  923    H    ASN 117           H        ASN 117 -20.069   6.519  -8.220
  924    HA   ASN 117           HA       ASN 117 -18.548   4.869 -10.184
  925    HB2  ASN 117           2HB      ASN 117 -17.234   6.730 -10.615
  926    HB3  ASN 117           3HB      ASN 117 -18.829   7.415 -10.399
  927   HD21  ASN 117          2HD2      ASN 117 -19.248   8.509  -8.185
  928   HD22  ASN 117          1HD2      ASN 117 -17.817   9.189  -7.426
  929    H    GLU 118           H        GLU 118 -16.004   5.007  -9.613
  930    HA   GLU 118           HA       GLU 118 -15.592   3.099  -7.563
  931    HB2  GLU 118           2HB      GLU 118 -13.233   3.347  -8.030
  932    HB3  GLU 118           3HB      GLU 118 -14.166   3.322  -9.524
  933    HG2  GLU 118           2HG      GLU 118 -13.980   5.813  -9.670
  934    HG3  GLU 118           3HG      GLU 118 -13.022   5.818  -8.188
  935    H    ASP 119           H        ASP 119 -15.622   6.594  -7.231
  936    HA   ASP 119           HA       ASP 119 -14.351   6.667  -4.627
  937    HB2  ASP 119           2HB      ASP 119 -14.614   8.561  -6.336
  938    HB3  ASP 119           3HB      ASP 119 -16.284   8.700  -5.779
  939    H    GLY 120           H        GLY 120 -17.534   5.679  -5.635
  940    HA2  GLY 120           HA2      GLY 120 -19.113   4.656  -4.237
  941    HA3  GLY 120           HA3      GLY 120 -18.490   5.519  -2.831
  942    H    ALA 121           H        ALA 121 -18.702   7.882  -5.121
  943    HA   ALA 121           HA       ALA 121 -21.265   8.889  -4.138
  944    HB1  ALA 121           3HB      ALA 121 -20.699  10.908  -5.380
  945    HB2  ALA 121           1HB      ALA 121 -19.326  10.382  -4.386
  946    HB3  ALA 121           2HB      ALA 121 -19.321  10.094  -6.139
  947    H    VAL 122           H        VAL 122 -23.125   8.741  -4.993
  948    HA   VAL 122           HA       VAL 122 -23.781   7.241  -7.334
  949    HB   VAL 122           HB       VAL 122 -25.130   7.206  -5.386
  950   HG11  VAL 122          1HG1      VAL 122 -26.055  10.054  -5.888
  951   HG12  VAL 122          2HG1      VAL 122 -26.584   8.943  -4.617
  952   HG13  VAL 122          3HG1      VAL 122 -24.934   9.570  -4.597
  953   HG21  VAL 122          3HG2      VAL 122 -27.331   7.366  -6.382
  954   HG22  VAL 122          1HG2      VAL 122 -26.706   8.383  -7.695
  955   HG23  VAL 122          2HG2      VAL 122 -26.171   6.701  -7.537
  956    H    ILE 123           H        ILE 123 -23.031   7.957  -9.198
  957    HA   ILE 123           HA       ILE 123 -23.357  10.767  -9.946
  958    HB   ILE 123           HB       ILE 123 -21.987  10.511 -11.716
  959   HG12  ILE 123          2HG1      ILE 123 -22.807   8.667 -12.954
  960   HG13  ILE 123          3HG1      ILE 123 -21.087   8.502 -12.709
  961   HG21  ILE 123          1HG2      ILE 123 -19.942   9.631 -10.834
  962   HG22  ILE 123          2HG2      ILE 123 -20.881  10.347  -9.511
  963   HG23  ILE 123          3HG2      ILE 123 -20.822   8.583  -9.702
  964   HD11  ILE 123          3HD1      ILE 123 -22.067   6.333 -12.535
  965   HD12  ILE 123          1HD1      ILE 123 -21.571   6.788 -10.895
  966   HD13  ILE 123          2HD1      ILE 123 -23.285   6.885 -11.395
  967    H    MET 124           H        MET 124 -24.961   7.713 -10.582
  968    HA   MET 124           HA       MET 124 -27.052   9.245 -11.996
  969    HB2  MET 124           2HB      MET 124 -25.578   6.955 -13.268
  970    HB3  MET 124           3HB      MET 124 -27.327   7.012 -13.440
  971    HG2  MET 124           2HG      MET 124 -26.946   8.271 -15.215
  972    HG3  MET 124           3HG      MET 124 -26.735   9.588 -14.077
  973    HE1  MET 124           3HE      MET 124 -24.720  11.054 -14.086
  974    HE2  MET 124           1HE      MET 124 -23.628  10.984 -15.482
  975    HE3  MET 124           2HE      MET 124 -25.394  11.035 -15.729
  976    H    PHE 125           H        PHE 125 -29.025   8.430 -11.967
  977    HA   PHE 125           HA       PHE 125 -29.646   6.689  -9.600
  978    HB2  PHE 125           2HB      PHE 125 -30.905   9.165 -10.787
  979    HB3  PHE 125           3HB      PHE 125 -31.921   7.999  -9.985
  980    HD1  PHE 125           HD1      PHE 125 -29.075   7.805  -7.967
  981    HD2  PHE 125           HD2      PHE 125 -32.289  10.463  -9.058
  982    HE1  PHE 125           HE1      PHE 125 -28.833   8.989  -5.811
  983    HE2  PHE 125           HE2      PHE 125 -32.002  11.668  -6.898
  984    HZ   PHE 125           HZ       PHE 125 -30.260  10.935  -5.289
  985    H    ILE 126           H        ILE 126 -29.193   4.827 -10.971
  986    HA   ILE 126           HA       ILE 126 -31.491   4.216 -12.806
  987    HB   ILE 126           HB       ILE 126 -28.943   2.673 -12.452
  988   HG12  ILE 126          2HG1      ILE 126 -29.842   4.648 -14.600
  989   HG13  ILE 126          3HG1      ILE 126 -28.510   4.880 -13.481
  990   HG21  ILE 126          1HG2      ILE 126 -29.671   1.245 -14.175
  991   HG22  ILE 126          2HG2      ILE 126 -31.184   1.498 -13.287
  992   HG23  ILE 126          3HG2      ILE 126 -30.889   2.386 -14.759
  993   HD11  ILE 126          3HD1      ILE 126 -27.599   4.259 -15.575
  994   HD12  ILE 126          1HD1      ILE 126 -27.389   2.877 -14.448
  995   HD13  ILE 126          2HD1      ILE 126 -28.657   2.833 -15.693
  996    H    LEU 127           H        LEU 127 -32.773   4.376 -10.866
  997    HA   LEU 127           HA       LEU 127 -32.562   2.244  -8.895
  998    HB2  LEU 127           2HB      LEU 127 -34.744   4.294  -9.283
  999    HB3  LEU 127           3HB      LEU 127 -34.631   3.141  -7.970
 1000    HG   LEU 127           HG       LEU 127 -33.811   5.282  -7.203
 1001   HD11  LEU 127          1HD1      LEU 127 -32.710   3.351  -6.299
 1002   HD12  LEU 127          2HD1      LEU 127 -31.480   3.612  -7.560
 1003   HD13  LEU 127          3HD1      LEU 127 -31.751   4.853  -6.307
 1004   HD21  LEU 127          3HD2      LEU 127 -32.187   6.612  -7.996
 1005   HD22  LEU 127          1HD2      LEU 127 -31.515   5.351  -9.038
 1006   HD23  LEU 127          2HD2      LEU 127 -33.062   6.136  -9.464
 1007    H    ASN 128           H        ASN 128 -32.420   0.597 -10.074
 1008    HA   ASN 128           HA       ASN 128 -34.172  -0.547 -11.993
 1009    HB2  ASN 128           2HB      ASN 128 -32.309  -1.783  -9.925
 1010    HB3  ASN 128           3HB      ASN 128 -33.244  -2.775 -11.025
 1011   HD21  ASN 128          2HD2      ASN 128 -30.792  -0.066 -11.169
 1012   HD22  ASN 128          1HD2      ASN 128 -30.088  -0.746 -12.620
 1013    H    PHE 129           H        PHE 129 -36.409  -0.594 -11.659
 1014    HA   PHE 129           HA       PHE 129 -37.395  -1.444  -9.031
 1015    HB2  PHE 129           2HB      PHE 129 -38.950  -0.429 -11.416
 1016    HB3  PHE 129           3HB      PHE 129 -39.571  -0.843  -9.813
 1017    HD1  PHE 129           HD1      PHE 129 -38.257   0.375  -7.782
 1018    HD2  PHE 129           HD2      PHE 129 -38.604   1.884 -11.804
 1019    HE1  PHE 129           HE1      PHE 129 -37.769   2.668  -6.964
 1020    HE2  PHE 129           HE2      PHE 129 -38.122   4.177 -10.977
 1021    HZ   PHE 129           HZ       PHE 129 -37.671   4.566  -8.568
 1022    H    GLU 130           H        GLU 130 -36.111  -3.461  -9.801
 1023    HA   GLU 130           HA       GLU 130 -37.728  -5.339 -11.379
 1024    HB2  GLU 130           2HB      GLU 130 -35.947  -6.974 -10.714
 1025    HB3  GLU 130           3HB      GLU 130 -35.459  -5.575 -11.711
 1026    HG2  GLU 130           2HG      GLU 130 -34.499  -4.439  -9.873
 1027    HG3  GLU 130           3HG      GLU 130 -35.212  -5.539  -8.714
 1028    H    VAL 131           H        VAL 131 -39.459  -5.935 -10.575
 1029    HA   VAL 131           HA       VAL 131 -40.198  -6.684  -7.884
 1030    HB   VAL 131           HB       VAL 131 -41.276  -7.247 -10.642
 1031   HG11  VAL 131          1HG1      VAL 131 -43.277  -8.368  -9.528
 1032   HG12  VAL 131          2HG1      VAL 131 -41.824  -9.349  -9.711
 1033   HG13  VAL 131          3HG1      VAL 131 -42.213  -8.650  -8.132
 1034   HG21  VAL 131          3HG2      VAL 131 -42.559  -6.007  -8.170
 1035   HG22  VAL 131          1HG2      VAL 131 -41.691  -5.081  -9.408
 1036   HG23  VAL 131          2HG2      VAL 131 -43.167  -5.969  -9.837
 1037    H    VAL 132           H        VAL 132 -39.369  -8.279  -6.684
 1038    HA   VAL 132           HA       VAL 132 -39.066 -10.890  -7.962
 1039    HB   VAL 132           HB       VAL 132 -36.827 -10.082  -8.199
 1040   HG11  VAL 132          1HG1      VAL 132 -36.731  -9.705  -5.187
 1041   HG12  VAL 132          2HG1      VAL 132 -35.352  -9.597  -6.302
 1042   HG13  VAL 132          3HG1      VAL 132 -36.668  -8.428  -6.426
 1043   HG21  VAL 132          3HG2      VAL 132 -37.179 -12.485  -7.695
 1044   HG22  VAL 132          1HG2      VAL 132 -35.599 -11.878  -7.181
 1045   HG23  VAL 132          2HG2      VAL 132 -36.866 -12.149  -5.973
 1046    H    MET 133           H        MET 133 -39.420 -12.639  -6.562
 1047    HA   MET 133           HA       MET 133 -39.940 -12.161  -3.700
 1048    HB2  MET 133           2HB      MET 133 -42.020 -13.296  -5.624
 1049    HB3  MET 133           3HB      MET 133 -42.108 -13.407  -3.861
 1050    HG2  MET 133           2HG      MET 133 -41.998 -10.905  -3.749
 1051    HG3  MET 133           3HG      MET 133 -42.154 -10.850  -5.503
 1052    HE1  MET 133           3HE      MET 133 -44.290 -11.239  -6.845
 1053    HE2  MET 133           1HE      MET 133 -44.271 -12.950  -6.351
 1054    HE3  MET 133           2HE      MET 133 -45.764 -12.000  -6.209
 1055    H    GLU 134           H        GLU 134 -39.977 -14.107  -2.459
 1056    HA   GLU 134           HA       GLU 134 -38.188 -16.186  -3.421
 1057    HB2  GLU 134           2HB      GLU 134 -39.792 -15.985  -0.843
 1058    HB3  GLU 134           3HB      GLU 134 -38.534 -17.178  -1.193
 1059    HG2  GLU 134           2HG      GLU 134 -36.897 -15.292  -1.515
 1060    HG3  GLU 134           3HG      GLU 134 -38.145 -14.161  -0.990
 1061    H    LYS 135           H        LYS 135 -38.588 -18.420  -3.561
 1062    HA   LYS 135           HA       LYS 135 -41.230 -19.162  -4.655
 1063    HB2  LYS 135           2HB      LYS 135 -39.126 -19.654  -5.884
 1064    HB3  LYS 135           3HB      LYS 135 -38.619 -20.722  -4.565
 1065    HG2  LYS 135           2HG      LYS 135 -40.599 -22.166  -4.968
 1066    HG3  LYS 135           3HG      LYS 135 -41.147 -21.063  -6.248
 1067    HD2  LYS 135           2HD      LYS 135 -39.077 -21.533  -7.537
 1068    HD3  LYS 135           3HD      LYS 135 -38.525 -22.631  -6.250
 1069    HE2  LYS 135           2HE      LYS 135 -40.546 -24.038  -6.594
 1070    HE3  LYS 135           3HE      LYS 135 -41.094 -22.947  -7.872
 1071    HZ1  LYS 135           HZ1      LYS 135 -39.938 -24.875  -8.790
 1072    HZ2  LYS 135           HZ2      LYS 135 -39.089 -23.526  -9.133
 1073    HZ3  LYS 135           HZ3      LYS 135 -38.581 -24.535  -7.951
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -34.780 -15.731   1.922
    2    H2   MET   1           2H       MET   1 -36.301 -16.286   1.595
    3    H3   MET   1           3H       MET   1 -35.868 -14.784   1.144
    4    HA   MET   1           HA       MET   1 -36.004 -16.366  -0.655
    5    HB2  MET   1           2HB      MET   1 -34.708 -14.309  -0.906
    6    HB3  MET   1           3HB      MET   1 -33.248 -15.138  -0.400
    7    HG2  MET   1           2HG      MET   1 -33.332 -15.014  -2.807
    8    HG3  MET   1           3HG      MET   1 -33.430 -16.690  -2.297
    9    HE1  MET   1           3HE      MET   1 -36.961 -14.271  -4.123
   10    HE2  MET   1           1HE      MET   1 -36.408 -13.942  -2.470
   11    HE3  MET   1           2HE      MET   1 -35.332 -13.614  -3.852
   12    HA   PRO   2           HA       PRO   2 -32.622 -19.637  -0.238
   13    HB2  PRO   2           2HB      PRO   2 -31.877 -19.652   2.670
   14    HB3  PRO   2           3HB      PRO   2 -30.858 -19.970   1.232
   15    HG2  PRO   2           2HG      PRO   2 -30.697 -17.592   2.516
   16    HG3  PRO   2           3HG      PRO   2 -30.730 -17.631   0.722
   17    HD2  PRO   2           2HD      PRO   2 -33.045 -17.162   2.628
   18    HD3  PRO   2           3HD      PRO   2 -32.531 -16.179   1.231
   19    H    VAL   3           H        VAL   3 -33.379 -21.709  -0.223
   20    HA   VAL   3           HA       VAL   3 -35.915 -22.219   0.982
   21    HB   VAL   3           HB       VAL   3 -35.167 -23.015  -1.238
   22   HG11  VAL   3          1HG1      VAL   3 -33.689 -25.208   0.274
   23   HG12  VAL   3          2HG1      VAL   3 -33.931 -25.097  -1.479
   24   HG13  VAL   3          3HG1      VAL   3 -32.928 -23.898  -0.657
   25   HG21  VAL   3          3HG2      VAL   3 -36.405 -25.069  -1.233
   26   HG22  VAL   3          1HG2      VAL   3 -36.199 -25.273   0.512
   27   HG23  VAL   3          2HG2      VAL   3 -37.187 -23.932  -0.125
   28    H    ARG   4           H        ARG   4 -36.600 -23.847   2.431
   29    HA   ARG   4           HA       ARG   4 -34.822 -24.269   4.732
   30    HB2  ARG   4           2HB      ARG   4 -37.644 -25.292   4.228
   31    HB3  ARG   4           3HB      ARG   4 -36.781 -25.340   5.759
   32    HG2  ARG   4           2HG      ARG   4 -37.763 -22.833   4.316
   33    HG3  ARG   4           3HG      ARG   4 -38.439 -23.585   5.751
   34    HD2  ARG   4           2HD      ARG   4 -37.260 -21.858   6.689
   35    HD3  ARG   4           3HD      ARG   4 -36.104 -23.189   6.839
   36    HE   ARG   4           HE       ARG   4 -35.769 -21.672   4.367
   37   HH11  ARG   4          1HH2      ARG   4 -34.954 -21.509   7.771
   38   HH12  ARG   4          2HH2      ARG   4 -33.644 -20.394   7.493
   39   HH21  ARG   4          1HH1      ARG   4 -34.155 -20.227   4.085
   40   HH22  ARG   4          2HH1      ARG   4 -33.208 -19.677   5.452
   41    H    ARG   5           H        ARG   5 -34.076 -26.190   5.533
   42    HA   ARG   5           HA       ARG   5 -34.411 -28.737   4.158
   43    HB2  ARG   5           2HB      ARG   5 -32.093 -29.102   3.574
   44    HB3  ARG   5           3HB      ARG   5 -32.745 -27.754   2.673
   45    HG2  ARG   5           2HG      ARG   5 -30.925 -27.461   5.112
   46    HG3  ARG   5           3HG      ARG   5 -30.382 -27.508   3.436
   47    HD2  ARG   5           2HD      ARG   5 -31.781 -25.503   2.940
   48    HD3  ARG   5           3HD      ARG   5 -32.154 -25.372   4.670
   49    HE   ARG   5           HE       ARG   5 -29.352 -25.502   4.445
   50   HH11  ARG   5          1HH1      ARG   5 -31.866 -23.232   3.487
   51   HH12  ARG   5          2HH1      ARG   5 -30.838 -21.855   3.806
   52   HH21  ARG   5          1HH2      ARG   5 -28.094 -23.695   4.733
   53   HH22  ARG   5          2HH2      ARG   5 -28.753 -22.116   4.434
   54    H    GLY   6           H        GLY   6 -33.719 -30.518   5.325
   55    HA2  GLY   6           HA2      GLY   6 -33.530 -30.159   8.218
   56    HA3  GLY   6           HA3      GLY   6 -33.577 -31.681   7.327
   57    H    HIS   7           H        HIS   7 -31.205 -30.781   5.662
   58    HA   HIS   7           HA       HIS   7 -28.955 -30.643   7.572
   59    HB2  HIS   7           2HB      HIS   7 -29.368 -33.060   7.287
   60    HB3  HIS   7           3HB      HIS   7 -29.278 -32.883   5.535
   61    HD2  HIS   7           HD2      HIS   7 -26.877 -32.844   4.426
   62    HE1  HIS   7           HE1      HIS   7 -24.517 -32.966   7.978
   63    HE2  HIS   7           HE2      HIS   7 -24.455 -33.077   5.433
   64    H    VAL   8           H        VAL   8 -26.954 -29.995   6.554
   65    HA   VAL   8           HA       VAL   8 -27.433 -28.097   4.400
   66    HB   VAL   8           HB       VAL   8 -26.136 -27.388   6.231
   67   HG11  VAL   8          1HG1      VAL   8 -25.040 -29.489   6.954
   68   HG12  VAL   8          2HG1      VAL   8 -23.960 -29.398   5.545
   69   HG13  VAL   8          3HG1      VAL   8 -23.909 -28.143   6.791
   70   HG21  VAL   8          3HG2      VAL   8 -24.292 -26.342   5.108
   71   HG22  VAL   8          1HG2      VAL   8 -24.284 -27.576   3.836
   72   HG23  VAL   8          2HG2      VAL   8 -25.652 -26.447   3.977
   73    H    ALA   9           H        ALA   9 -27.605 -28.702   2.403
   74    HA   ALA   9           HA       ALA   9 -26.115 -30.838   1.095
   75    HB1  ALA   9           3HB      ALA   9 -28.352 -30.095   0.351
   76    HB2  ALA   9           1HB      ALA   9 -27.710 -28.470   0.017
   77    HB3  ALA   9           2HB      ALA   9 -27.157 -29.859  -0.936
   78    HA   PRO  10           HA       PRO  10 -22.245 -28.863   0.009
   79    HB2  PRO  10           2HB      PRO  10 -23.091 -29.206  -2.864
   80    HB3  PRO  10           3HB      PRO  10 -21.492 -29.515  -2.124
   81    HG2  PRO  10           2HG      PRO  10 -23.191 -31.580  -2.577
   82    HG3  PRO  10           3HG      PRO  10 -22.287 -31.484  -1.032
   83    HD2  PRO  10           2HD      PRO  10 -25.181 -30.808  -1.555
   84    HD3  PRO  10           3HD      PRO  10 -24.427 -31.593  -0.141
   85    H    GLN  11           H        GLN  11 -22.126 -26.819   0.488
   86    HA   GLN  11           HA       GLN  11 -24.214 -25.033   0.074
   87    HB2  GLN  11           2HB      GLN  11 -23.048 -23.480   1.363
   88    HB3  GLN  11           3HB      GLN  11 -22.660 -25.069   1.996
   89    HG2  GLN  11           2HG      GLN  11 -20.876 -23.290   0.278
   90    HG3  GLN  11           3HG      GLN  11 -20.715 -23.603   2.000
   91   HE21  GLN  11          2HE2      GLN  11 -18.988 -24.196  -0.577
   92   HE22  GLN  11          1HE2      GLN  11 -18.481 -25.854  -0.246
   93    H    ASN  12           H        ASN  12 -21.381 -25.339  -2.005
   94    HA   ASN  12           HA       ASN  12 -21.573 -22.689  -3.157
   95    HB2  ASN  12           2HB      ASN  12 -20.203 -25.290  -3.980
   96    HB3  ASN  12           3HB      ASN  12 -20.203 -23.866  -5.016
   97   HD21  ASN  12          2HD2      ASN  12 -17.784 -24.333  -4.638
   98   HD22  ASN  12          1HD2      ASN  12 -17.076 -23.438  -3.300
   99    H    THR  13           H        THR  13 -22.686 -25.885  -4.318
  100    HA   THR  13           HA       THR  13 -24.086 -24.791  -6.625
  101    HB   THR  13           HB       THR  13 -22.978 -27.066  -6.343
  102    HG1  THR  13           HG1      THR  13 -24.441 -27.964  -7.800
  103   HG21  THR  13          1HG2      THR  13 -24.272 -28.921  -5.550
  104   HG22  THR  13          2HG2      THR  13 -24.177 -27.702  -4.266
  105   HG23  THR  13          3HG2      THR  13 -25.669 -27.869  -5.200
  106    H    PHE  14           H        PHE  14 -25.050 -25.906  -3.372
  107    HA   PHE  14           HA       PHE  14 -27.865 -25.621  -3.606
  108    HB2  PHE  14           2HB      PHE  14 -26.675 -26.611  -1.698
  109    HB3  PHE  14           3HB      PHE  14 -25.973 -25.056  -1.295
  110    HD1  PHE  14           HD1      PHE  14 -29.193 -26.954  -1.455
  111    HD2  PHE  14           HD2      PHE  14 -27.220 -23.364  -0.100
  112    HE1  PHE  14           HE1      PHE  14 -31.213 -26.330  -0.147
  113    HE2  PHE  14           HE2      PHE  14 -29.247 -22.734   1.186
  114    HZ   PHE  14           HZ       PHE  14 -31.248 -24.207   1.150
  115    H    LEU  15           H        LEU  15 -25.317 -23.222  -2.816
  116    HA   LEU  15           HA       LEU  15 -27.205 -21.015  -2.678
  117    HB2  LEU  15           2HB      LEU  15 -25.120 -20.869  -1.479
  118    HB3  LEU  15           3HB      LEU  15 -24.189 -21.057  -2.975
  119    HG   LEU  15           HG       LEU  15 -24.948 -18.940  -3.819
  120   HD11  LEU  15          1HD1      LEU  15 -26.775 -18.874  -1.392
  121   HD12  LEU  15          2HD1      LEU  15 -26.198 -17.359  -2.144
  122   HD13  LEU  15          3HD1      LEU  15 -27.126 -18.497  -3.089
  123   HD21  LEU  15          3HD2      LEU  15 -23.835 -17.460  -2.203
  124   HD22  LEU  15          1HD2      LEU  15 -24.043 -18.675  -0.919
  125   HD23  LEU  15          2HD2      LEU  15 -22.984 -19.009  -2.309
  126    H    ASP  16           H        ASP  16 -25.016 -22.153  -5.337
  127    HA   ASP  16           HA       ASP  16 -25.697 -20.310  -7.294
  128    HB2  ASP  16           2HB      ASP  16 -24.098 -22.267  -7.470
  129    HB3  ASP  16           3HB      ASP  16 -25.490 -23.285  -7.822
  130    H    THR  17           H        THR  17 -27.646 -23.020  -6.201
  131    HA   THR  17           HA       THR  17 -29.828 -22.723  -8.116
  132    HB   THR  17           HB       THR  17 -29.950 -23.892  -5.310
  133    HG1  THR  17           HG1      THR  17 -28.471 -24.961  -6.653
  134   HG21  THR  17          1HG2      THR  17 -31.873 -25.172  -6.218
  135   HG22  THR  17          2HG2      THR  17 -32.194 -23.435  -6.144
  136   HG23  THR  17          3HG2      THR  17 -31.802 -24.196  -7.705
  137    H    ILE  18           H        ILE  18 -29.158 -21.222  -4.959
  138    HA   ILE  18           HA       ILE  18 -31.706 -19.808  -4.836
  139    HB   ILE  18           HB       ILE  18 -29.130 -19.160  -3.386
  140   HG12  ILE  18          2HG1      ILE  18 -29.555 -21.363  -2.701
  141   HG13  ILE  18          3HG1      ILE  18 -30.020 -20.311  -1.409
  142   HG21  ILE  18          1HG2      ILE  18 -30.721 -17.333  -3.258
  143   HG22  ILE  18          2HG2      ILE  18 -32.030 -18.436  -2.798
  144   HG23  ILE  18          3HG2      ILE  18 -30.672 -18.124  -1.692
  145   HD11  ILE  18          3HD1      ILE  18 -31.852 -21.814  -3.360
  146   HD12  ILE  18          1HD1      ILE  18 -31.651 -22.112  -1.626
  147   HD13  ILE  18          2HD1      ILE  18 -32.465 -20.636  -2.187
  148    H    ILE  19           H        ILE  19 -28.396 -19.085  -6.055
  149    HA   ILE  19           HA       ILE  19 -28.887 -16.418  -6.825
  150    HB   ILE  19           HB       ILE  19 -27.259 -18.418  -8.417
  151   HG12  ILE  19          2HG1      ILE  19 -26.195 -18.486  -6.312
  152   HG13  ILE  19          3HG1      ILE  19 -25.250 -17.393  -7.281
  153   HG21  ILE  19          1HG2      ILE  19 -26.065 -16.359  -9.187
  154   HG22  ILE  19          2HG2      ILE  19 -27.761 -16.396  -9.675
  155   HG23  ILE  19          3HG2      ILE  19 -27.262 -15.379  -8.309
  156   HD11  ILE  19          3HD1      ILE  19 -27.215 -16.672  -5.076
  157   HD12  ILE  19          1HD1      ILE  19 -25.453 -16.559  -5.030
  158   HD13  ILE  19          2HD1      ILE  19 -26.383 -15.470  -6.101
  159    H    ARG  20           H        ARG  20 -29.466 -19.479  -8.764
  160    HA   ARG  20           HA       ARG  20 -30.867 -18.227 -10.899
  161    HB2  ARG  20           2HB      ARG  20 -30.671 -21.014  -9.729
  162    HB3  ARG  20           3HB      ARG  20 -32.087 -20.673 -10.699
  163    HG2  ARG  20           2HG      ARG  20 -30.884 -21.276 -12.425
  164    HG3  ARG  20           3HG      ARG  20 -30.214 -19.657 -12.361
  165    HD2  ARG  20           2HD      ARG  20 -28.981 -22.116 -11.043
  166    HD3  ARG  20           3HD      ARG  20 -28.568 -21.559 -12.661
  167    HE   ARG  20           HE       ARG  20 -27.540 -20.552 -10.185
  168   HH11  ARG  20          2HH2      ARG  20 -28.528 -19.231 -13.271
  169   HH12  ARG  20          1HH2      ARG  20 -27.489 -17.857 -13.095
  170   HH21  ARG  20          2HH1      ARG  20 -25.797 -19.236 -10.423
  171   HH22  ARG  20          1HH1      ARG  20 -25.846 -17.946 -11.611
  172    H    LYS  21           H        LYS  21 -32.011 -19.031  -7.705
  173    HA   LYS  21           HA       LYS  21 -34.835 -18.632  -8.207
  174    HB2  LYS  21           2HB      LYS  21 -33.564 -19.650  -6.094
  175    HB3  LYS  21           3HB      LYS  21 -33.604 -17.968  -5.539
  176    HG2  LYS  21           2HG      LYS  21 -35.471 -18.960  -4.571
  177    HG3  LYS  21           3HG      LYS  21 -36.127 -18.019  -5.915
  178    HD2  LYS  21           2HD      LYS  21 -36.283 -20.113  -7.279
  179    HD3  LYS  21           3HD      LYS  21 -35.568 -21.029  -5.931
  180    HE2  LYS  21           2HE      LYS  21 -37.459 -20.284  -4.470
  181    HE3  LYS  21           3HE      LYS  21 -38.184 -19.461  -5.861
  182    HZ1  LYS  21           HZ1      LYS  21 -38.399 -21.624  -6.949
  183    HZ2  LYS  21           HZ2      LYS  21 -37.694 -22.388  -5.680
  184    HZ3  LYS  21           HZ3      LYS  21 -39.144 -21.654  -5.485
  185    H    PHE  22           H        PHE  22 -32.304 -16.336  -7.082
  186    HA   PHE  22           HA       PHE  22 -34.272 -14.139  -7.527
  187    HB2  PHE  22           2HB      PHE  22 -33.190 -12.798  -5.969
  188    HB3  PHE  22           3HB      PHE  22 -33.417 -14.372  -5.255
  189    HD1  PHE  22           HD2      PHE  22 -30.859 -12.034  -6.688
  190    HD2  PHE  22           HD1      PHE  22 -31.566 -15.603  -4.394
  191    HE1  PHE  22           HE2      PHE  22 -28.479 -12.065  -6.016
  192    HE2  PHE  22           HE1      PHE  22 -29.173 -15.623  -3.697
  193    HZ   PHE  22           HZ       PHE  22 -27.629 -13.858  -4.516
  194    H    GLU  23           H        GLU  23 -32.014 -15.434  -9.427
  195    HA   GLU  23           HA       GLU  23 -30.131 -13.660 -10.089
  196    HB2  GLU  23           2HB      GLU  23 -30.272 -15.947 -10.990
  197    HB3  GLU  23           3HB      GLU  23 -31.628 -15.487 -12.008
  198    HG2  GLU  23           2HG      GLU  23 -30.258 -14.090 -13.399
  199    HG3  GLU  23           3HG      GLU  23 -28.933 -14.111 -12.227
  200    H    GLY  24           H        GLY  24 -33.479 -13.241 -11.128
  201    HA2  GLY  24           HA2      GLY  24 -34.537 -11.308 -11.784
  202    HA3  GLY  24           HA3      GLY  24 -33.013 -10.451 -11.578
  203    H    GLN  25           H        GLN  25 -33.516 -13.102 -13.930
  204    HA   GLN  25           HA       GLN  25 -32.612 -11.553 -16.157
  205    HB2  GLN  25           2HB      GLN  25 -33.269 -13.428 -17.527
  206    HB3  GLN  25           3HB      GLN  25 -32.447 -13.971 -16.064
  207    HG2  GLN  25           2HG      GLN  25 -34.640 -14.590 -15.055
  208    HG3  GLN  25           3HG      GLN  25 -35.473 -14.020 -16.503
  209   HE21  GLN  25          2HE2      GLN  25 -36.133 -16.511 -15.924
  210   HE22  GLN  25          1HE2      GLN  25 -35.264 -17.661 -16.932
  211    H    SER  26           H        SER  26 -35.718 -11.629 -14.679
  212    HA   SER  26           HA       SER  26 -37.156 -10.376 -16.917
  213    HB2  SER  26           2HB      SER  26 -39.080 -10.516 -15.348
  214    HB3  SER  26           3HB      SER  26 -38.301 -12.075 -15.655
  215    HG   SER  26           HG       SER  26 -38.705 -11.739 -13.413
  216    H    ARG  27           H        ARG  27 -34.848  -9.045 -15.338
  217    HA   ARG  27           HA       ARG  27 -35.640  -6.957 -13.711
  218    HB2  ARG  27           2HB      ARG  27 -33.363  -7.496 -15.550
  219    HB3  ARG  27           3HB      ARG  27 -33.574  -5.804 -15.216
  220    HG2  ARG  27           2HG      ARG  27 -33.619  -7.613 -12.812
  221    HG3  ARG  27           3HG      ARG  27 -32.090  -7.461 -13.688
  222    HD2  ARG  27           2HD      ARG  27 -32.203  -5.007 -13.515
  223    HD3  ARG  27           3HD      ARG  27 -33.701  -5.128 -12.584
  224    HE   ARG  27           HE       ARG  27 -32.417  -6.388 -10.842
  225   HH11  ARG  27          1HH2      ARG  27 -30.460  -4.286 -12.864
  226   HH12  ARG  27          2HH2      ARG  27 -29.060  -4.541 -11.849
  227   HH21  ARG  27          2HH1      ARG  27 -30.843  -6.459  -9.583
  228   HH22  ARG  27          1HH1      ARG  27 -29.289  -5.687  -9.920
  229    H    LYS  28           H        LYS  28 -35.966  -4.854 -13.834
  230    HA   LYS  28           HA       LYS  28 -36.610  -3.403 -16.314
  231    HB2  LYS  28           2HB      LYS  28 -38.639  -2.440 -15.195
  232    HB3  LYS  28           3HB      LYS  28 -38.805  -4.049 -15.872
  233    HG2  LYS  28           2HG      LYS  28 -38.237  -3.643 -12.936
  234    HG3  LYS  28           3HG      LYS  28 -39.843  -3.363 -13.587
  235    HD2  LYS  28           2HD      LYS  28 -38.387  -6.015 -13.688
  236    HD3  LYS  28           3HD      LYS  28 -39.705  -5.557 -12.601
  237    HE2  LYS  28           2HE      LYS  28 -41.286  -5.374 -14.416
  238    HE3  LYS  28           3HE      LYS  28 -40.016  -5.594 -15.625
  239    HZ1  LYS  28           HZ1      LYS  28 -40.826  -7.667 -13.664
  240    HZ2  LYS  28           HZ2      LYS  28 -41.191  -7.664 -15.259
  241    HZ3  LYS  28           HZ3      LYS  28 -39.631  -7.819 -14.782
  242    H    PHE  29           H        PHE  29 -36.451  -1.093 -16.083
  243    HA   PHE  29           HA       PHE  29 -35.495   0.121 -13.628
  244    HB2  PHE  29           2HB      PHE  29 -33.151   0.409 -14.274
  245    HB3  PHE  29           3HB      PHE  29 -33.544  -1.281 -14.140
  246    HD1  PHE  29           HD1      PHE  29 -33.584  -2.777 -16.079
  247    HD2  PHE  29           HD2      PHE  29 -32.524   1.389 -16.455
  248    HE1  PHE  29           HE1      PHE  29 -32.574  -3.234 -18.299
  249    HE2  PHE  29           HE2      PHE  29 -31.506   0.918 -18.677
  250    HZ   PHE  29           HZ       PHE  29 -31.519  -1.390 -19.592
  251    H    ILE  30           H        ILE  30 -34.606   2.235 -13.837
  252    HA   ILE  30           HA       ILE  30 -35.184   3.678 -16.379
  253    HB   ILE  30           HB       ILE  30 -35.588   5.711 -14.807
  254   HG12  ILE  30          2HG1      ILE  30 -36.743   5.294 -12.731
  255   HG13  ILE  30          3HG1      ILE  30 -36.504   3.552 -12.867
  256   HG21  ILE  30          1HG2      ILE  30 -37.154   4.742 -16.364
  257   HG22  ILE  30          2HG2      ILE  30 -37.637   3.528 -15.156
  258   HG23  ILE  30          3HG2      ILE  30 -37.978   5.253 -14.877
  259   HD11  ILE  30          3HD1      ILE  30 -34.248   5.595 -12.609
  260   HD12  ILE  30          1HD1      ILE  30 -34.951   4.659 -11.280
  261   HD13  ILE  30          2HD1      ILE  30 -34.081   3.816 -12.565
  262    H    ILE  31           H        ILE  31 -34.053   5.786 -16.455
  263    HA   ILE  31           HA       ILE  31 -31.386   5.750 -15.142
  264    HB   ILE  31           HB       ILE  31 -31.920   6.958 -17.863
  265   HG12  ILE  31          2HG1      ILE  31 -32.410   4.532 -18.099
  266   HG13  ILE  31          3HG1      ILE  31 -31.005   5.068 -19.028
  267   HG21  ILE  31          1HG2      ILE  31 -29.409   6.174 -16.335
  268   HG22  ILE  31          2HG2      ILE  31 -29.434   6.818 -18.001
  269   HG23  ILE  31          3HG2      ILE  31 -30.008   7.806 -16.649
  270   HD11  ILE  31          3HD1      ILE  31 -30.700   2.879 -17.796
  271   HD12  ILE  31          1HD1      ILE  31 -29.456   4.109 -17.499
  272   HD13  ILE  31          2HD1      ILE  31 -30.722   3.836 -16.289
  273    H    ALA  32           H        ALA  32 -31.341   7.304 -13.770
  274    HA   ALA  32           HA       ALA  32 -32.685   9.892 -14.433
  275    HB1  ALA  32           3HB      ALA  32 -32.788   8.446 -11.770
  276    HB2  ALA  32           1HB      ALA  32 -33.277  10.126 -11.995
  277    HB3  ALA  32           2HB      ALA  32 -34.137   8.819 -12.852
  278    H    ASN  33           H        ASN  33 -31.907  11.818 -13.599
  279    HA   ASN  33           HA       ASN  33 -28.980  11.808 -13.217
  280    HB2  ASN  33           2HB      ASN  33 -29.301  14.338 -13.075
  281    HB3  ASN  33           3HB      ASN  33 -29.557  13.545 -14.605
  282   HD21  ASN  33          2HD2      ASN  33 -30.628  15.552 -15.195
  283   HD22  ASN  33          1HD2      ASN  33 -32.319  15.722 -14.755
  284    H    ALA  34           H        ALA  34 -28.235  11.127 -11.324
  285    HA   ALA  34           HA       ALA  34 -29.551  11.576  -8.782
  286    HB1  ALA  34           3HB      ALA  34 -26.685  10.736  -9.383
  287    HB2  ALA  34           1HB      ALA  34 -27.556  10.511  -7.860
  288    HB3  ALA  34           2HB      ALA  34 -28.074   9.631  -9.306
  289    H    ARG  35           H        ARG  35 -27.663  13.591 -10.707
  290    HA   ARG  35           HA       ARG  35 -26.339  15.096  -8.524
  291    HB2  ARG  35           2HB      ARG  35 -26.192  15.405 -11.544
  292    HB3  ARG  35           3HB      ARG  35 -25.179  16.256 -10.389
  293    HG2  ARG  35           2HG      ARG  35 -25.159  13.230 -10.801
  294    HG3  ARG  35           3HG      ARG  35 -24.055  14.383 -11.528
  295    HD2  ARG  35           2HD      ARG  35 -22.799  13.612  -9.780
  296    HD3  ARG  35           3HD      ARG  35 -23.441  15.108  -9.122
  297    HE   ARG  35           HE       ARG  35 -24.418  12.316  -8.499
  298   HH11  ARG  35          1HH1      ARG  35 -23.982  15.597  -7.303
  299   HH12  ARG  35          2HH1      ARG  35 -24.461  15.131  -5.695
  300   HH21  ARG  35          1HH2      ARG  35 -24.922  11.817  -6.524
  301   HH22  ARG  35          2HH2      ARG  35 -25.030  13.027  -5.257
  302    H    VAL  36           H        VAL  36 -29.385  15.294  -9.666
  303    HA   VAL  36           HA       VAL  36 -29.521  18.260  -9.417
  304    HB   VAL  36           HB       VAL  36 -29.826  17.074 -11.752
  305   HG11  VAL  36          1HG1      VAL  36 -31.640  15.527 -11.039
  306   HG12  VAL  36          2HG1      VAL  36 -32.687  16.933 -10.738
  307   HG13  VAL  36          3HG1      VAL  36 -32.111  16.617 -12.365
  308   HG21  VAL  36          3HG2      VAL  36 -31.226  18.857 -12.507
  309   HG22  VAL  36          1HG2      VAL  36 -31.716  19.250 -10.835
  310   HG23  VAL  36          2HG2      VAL  36 -30.021  19.457 -11.357
  311    H    GLU  37           H        GLU  37 -31.133  19.133  -8.175
  312    HA   GLU  37           HA       GLU  37 -32.141  17.623  -6.019
  313    HB2  GLU  37           2HB      GLU  37 -31.701  20.081  -6.127
  314    HB3  GLU  37           3HB      GLU  37 -33.163  20.283  -7.099
  315    HG2  GLU  37           2HG      GLU  37 -34.546  19.478  -5.224
  316    HG3  GLU  37           3HG      GLU  37 -33.096  19.113  -4.282
  317    H    ASN  38           H        ASN  38 -33.641  18.178  -9.153
  318    HA   ASN  38           HA       ASN  38 -36.275  17.215  -8.341
  319    HB2  ASN  38           2HB      ASN  38 -35.493  18.938 -10.242
  320    HB3  ASN  38           3HB      ASN  38 -35.439  17.477 -11.224
  321   HD21  ASN  38          2HD2      ASN  38 -37.655  16.053 -10.604
  322   HD22  ASN  38          1HD2      ASN  38 -39.096  17.053 -10.838
  323    H    CYS  39           H        CYS  39 -33.406  15.550  -8.979
  324    HA   CYS  39           HA       CYS  39 -32.863  13.479  -9.814
  325    HB2  CYS  39           2HB      CYS  39 -33.687  11.788  -8.226
  326    HB3  CYS  39           3HB      CYS  39 -33.142  13.275  -7.436
  327    HG   CYS  39           HG       CYS  39 -36.246  12.482  -8.256
  328    H    ALA  40           H        ALA  40 -34.139  14.066 -12.007
  329    HA   ALA  40           HA       ALA  40 -36.481  12.278 -12.281
  330    HB1  ALA  40           3HB      ALA  40 -36.979  14.620 -12.608
  331    HB2  ALA  40           1HB      ALA  40 -35.771  14.723 -13.924
  332    HB3  ALA  40           2HB      ALA  40 -37.217  13.715 -14.085
  333    H    VAL  41           H        VAL  41 -37.019  11.341 -14.236
  334    HA   VAL  41           HA       VAL  41 -35.045   9.452 -15.089
  335    HB   VAL  41           HB       VAL  41 -37.997   9.830 -15.731
  336   HG11  VAL  41          1HG1      VAL  41 -36.951   8.431 -17.500
  337   HG12  VAL  41          2HG1      VAL  41 -36.220   7.414 -16.240
  338   HG13  VAL  41          3HG1      VAL  41 -37.984   7.464 -16.447
  339   HG21  VAL  41          3HG2      VAL  41 -36.593   7.878 -13.846
  340   HG22  VAL  41          1HG2      VAL  41 -37.509   9.305 -13.338
  341   HG23  VAL  41          2HG2      VAL  41 -38.344   7.990 -14.154
  342    H    ILE  42           H        ILE  42 -33.577  10.550 -16.289
  343    HA   ILE  42           HA       ILE  42 -34.171  12.126 -18.655
  344    HB   ILE  42           HB       ILE  42 -31.739  11.981 -19.047
  345   HG12  ILE  42          2HG1      ILE  42 -31.637  10.247 -16.533
  346   HG13  ILE  42          3HG1      ILE  42 -31.375   9.655 -18.180
  347   HG21  ILE  42          1HG2      ILE  42 -31.091  13.329 -17.145
  348   HG22  ILE  42          2HG2      ILE  42 -32.788  13.668 -17.492
  349   HG23  ILE  42          3HG2      ILE  42 -32.356  12.613 -16.127
  350   HD11  ILE  42          3HD1      ILE  42 -29.646  11.590 -16.624
  351   HD12  ILE  42          1HD1      ILE  42 -29.270   9.937 -17.136
  352   HD13  ILE  42          2HD1      ILE  42 -29.430  11.212 -18.362
  353    H    TYR  43           H        TYR  43 -33.841   8.720 -18.007
  354    HA   TYR  43           HA       TYR  43 -34.830   8.117 -20.677
  355    HB2  TYR  43           2HB      TYR  43 -32.231   8.202 -20.921
  356    HB3  TYR  43           3HB      TYR  43 -32.227   6.731 -19.998
  357    HD1  TYR  43           HD2      TYR  43 -33.652   8.294 -23.081
  358    HD2  TYR  43           HD1      TYR  43 -32.617   4.623 -21.058
  359    HE1  TYR  43           HE2      TYR  43 -34.101   7.008 -25.171
  360    HE2  TYR  43           HE1      TYR  43 -33.078   3.344 -23.140
  361    HH   TYR  43           HH       TYR  43 -33.711   3.448 -25.343
  362    H    CYS  44           H        CYS  44 -35.468   5.797 -20.943
  363    HA   CYS  44           HA       CYS  44 -35.726   4.384 -18.365
  364    HB2  CYS  44           2HB      CYS  44 -38.176   4.168 -18.672
  365    HB3  CYS  44           3HB      CYS  44 -37.669   5.858 -18.462
  366    HG   CYS  44           HG       CYS  44 -39.632   5.638 -20.267
  367    H    ASN  45           H        ASN  45 -36.184   2.180 -18.429
  368    HA   ASN  45           HA       ASN  45 -35.832   0.899 -21.080
  369    HB2  ASN  45           2HB      ASN  45 -34.581   0.133 -19.018
  370    HB3  ASN  45           3HB      ASN  45 -36.103  -0.535 -18.421
  371   HD21  ASN  45          2HD2      ASN  45 -33.727  -0.646 -21.127
  372   HD22  ASN  45          1HD2      ASN  45 -34.180  -2.267 -21.626
  373    H    ASP  46           H        ASP  46 -37.282  -0.574 -21.908
  374    HA   ASP  46           HA       ASP  46 -40.084   0.141 -21.564
  375    HB2  ASP  46           2HB      ASP  46 -38.786  -2.110 -23.136
  376    HB3  ASP  46           3HB      ASP  46 -40.499  -1.687 -23.196
  377    H    GLY  47           H        GLY  47 -38.016  -2.362 -20.146
  378    HA2  GLY  47           HA2      GLY  47 -39.920  -4.107 -19.043
  379    HA3  GLY  47           HA3      GLY  47 -38.407  -3.621 -18.264
  380    H    PHE  48           H        PHE  48 -38.852  -0.900 -17.671
  381    HA   PHE  48           HA       PHE  48 -40.635  -1.198 -15.396
  382    HB2  PHE  48           2HB      PHE  48 -39.209   0.208 -14.560
  383    HB3  PHE  48           3HB      PHE  48 -38.522   0.584 -16.117
  384    HD1  PHE  48           HD2      PHE  48 -39.377   2.534 -17.482
  385    HD2  PHE  48           HD1      PHE  48 -40.761   1.731 -13.472
  386    HE1  PHE  48           HE2      PHE  48 -40.139   4.852 -17.255
  387    HE2  PHE  48           HE1      PHE  48 -41.573   4.056 -13.283
  388    HZ   PHE  48           HZ       PHE  48 -41.257   5.639 -15.176
  389    H    CYS  49           H        CYS  49 -40.923   0.071 -18.598
  390    HA   CYS  49           HA       CYS  49 -43.351   1.609 -18.320
  391    HB2  CYS  49           2HB      CYS  49 -41.694   1.739 -20.228
  392    HB3  CYS  49           3HB      CYS  49 -42.285   0.155 -20.774
  393    HG   CYS  49           HG       CYS  49 -43.354   1.904 -22.286
  394    H    GLU  50           H        GLU  50 -42.608  -1.862 -18.883
  395    HA   GLU  50           HA       GLU  50 -45.462  -2.600 -19.025
  396    HB2  GLU  50           2HB      GLU  50 -42.981  -4.329 -18.698
  397    HB3  GLU  50           3HB      GLU  50 -44.623  -4.903 -19.011
  398    HG2  GLU  50           2HG      GLU  50 -44.661  -3.603 -21.147
  399    HG3  GLU  50           3HG      GLU  50 -42.985  -3.146 -20.884
  400    H    LEU  51           H        LEU  51 -42.934  -2.474 -16.527
  401    HA   LEU  51           HA       LEU  51 -44.187  -3.871 -14.452
  402    HB2  LEU  51           2HB      LEU  51 -41.900  -3.003 -14.370
  403    HB3  LEU  51           3HB      LEU  51 -42.502  -1.359 -14.323
  404    HG   LEU  51           HG       LEU  51 -43.648  -1.679 -12.220
  405   HD11  LEU  51          1HD1      LEU  51 -43.091  -3.577 -10.773
  406   HD12  LEU  51          2HD1      LEU  51 -43.982  -4.106 -12.202
  407   HD13  LEU  51          3HD1      LEU  51 -42.219  -4.362 -12.113
  408   HD21  LEU  51          3HD2      LEU  51 -41.349  -0.742 -12.344
  409   HD22  LEU  51          1HD2      LEU  51 -41.753  -1.516 -10.802
  410   HD23  LEU  51          2HD2      LEU  51 -40.720  -2.362 -11.945
  411    H    CYS  52           H        CYS  52 -44.439  -0.328 -15.138
  412    HA   CYS  52           HA       CYS  52 -46.796  -0.091 -13.390
  413    HB2  CYS  52           2HB      CYS  52 -46.767   2.257 -14.017
  414    HB3  CYS  52           3HB      CYS  52 -45.158   1.725 -13.518
  415    HG   CYS  52           HG       CYS  52 -44.097   1.495 -15.851
  416    H    GLY  53           H        GLY  53 -46.240  -0.569 -16.810
  417    HA2  GLY  53           HA2      GLY  53 -47.726  -1.420 -18.378
  418    HA3  GLY  53           HA3      GLY  53 -49.082  -1.161 -17.286
  419    H    TYR  54           H        TYR  54 -47.101   1.659 -17.801
  420    HA   TYR  54           HA       TYR  54 -49.288   2.915 -19.358
  421    HB2  TYR  54           2HB      TYR  54 -46.974   4.112 -17.822
  422    HB3  TYR  54           3HB      TYR  54 -48.115   5.047 -18.780
  423    HD1  TYR  54           HD1      TYR  54 -50.686   4.622 -18.300
  424    HD2  TYR  54           HD2      TYR  54 -47.462   3.969 -15.510
  425    HE1  TYR  54           HE1      TYR  54 -52.267   4.914 -16.396
  426    HE2  TYR  54           HE2      TYR  54 -49.046   4.240 -13.611
  427    HH   TYR  54           HH       TYR  54 -51.202   4.692 -12.984
  428    H    SER  55           H        SER  55 -46.539   4.703 -19.969
  429    HA   SER  55           HA       SER  55 -45.643   3.438 -22.447
  430    HB2  SER  55           2HB      SER  55 -47.783   4.349 -23.200
  431    HB3  SER  55           3HB      SER  55 -47.364   5.940 -22.539
  432    HG   SER  55           HG       SER  55 -46.929   5.688 -24.828
  433    H    ARG  56           H        ARG  56 -43.722   4.428 -23.179
  434    HA   ARG  56           HA       ARG  56 -42.220   5.769 -21.136
  435    HB2  ARG  56           2HB      ARG  56 -40.361   5.764 -22.677
  436    HB3  ARG  56           3HB      ARG  56 -41.166   4.198 -22.600
  437    HG2  ARG  56           2HG      ARG  56 -42.330   4.818 -24.793
  438    HG3  ARG  56           3HG      ARG  56 -41.269   6.231 -24.869
  439    HD2  ARG  56           2HD      ARG  56 -40.411   3.302 -24.785
  440    HD3  ARG  56           3HD      ARG  56 -40.404   4.339 -26.205
  441    HE   ARG  56           HE       ARG  56 -38.619   5.668 -25.238
  442   HH11  ARG  56          2HH2      ARG  56 -38.973   2.492 -23.655
  443   HH12  ARG  56          1HH2      ARG  56 -37.526   2.814 -22.706
  444   HH21  ARG  56          2HH1      ARG  56 -36.672   5.728 -24.129
  445   HH22  ARG  56          1HH1      ARG  56 -36.299   4.428 -23.016
  446    H    ALA  57           H        ALA  57 -43.965   7.113 -23.831
  447    HA   ALA  57           HA       ALA  57 -42.884   9.770 -23.793
  448    HB1  ALA  57           3HB      ALA  57 -44.985  10.336 -24.958
  449    HB2  ALA  57           1HB      ALA  57 -44.275   8.851 -25.618
  450    HB3  ALA  57           2HB      ALA  57 -45.671   8.758 -24.516
  451    H    GLU  58           H        GLU  58 -44.757   8.108 -21.425
  452    HA   GLU  58           HA       GLU  58 -45.921  10.509 -20.190
  453    HB2  GLU  58           2HB      GLU  58 -46.080   7.617 -19.281
  454    HB3  GLU  58           3HB      GLU  58 -47.041   8.956 -18.721
  455    HG2  GLU  58           2HG      GLU  58 -47.148   7.951 -21.600
  456    HG3  GLU  58           3HG      GLU  58 -48.175   7.345 -20.326
  457    H    VAL  59           H        VAL  59 -43.022   8.565 -19.937
  458    HA   VAL  59           HA       VAL  59 -42.675   9.258 -17.059
  459    HB   VAL  59           HB       VAL  59 -41.133   7.622 -16.816
  460   HG11  VAL  59          1HG1      VAL  59 -42.196   5.592 -17.664
  461   HG12  VAL  59          2HG1      VAL  59 -43.439   6.777 -17.268
  462   HG13  VAL  59          3HG1      VAL  59 -42.978   6.483 -18.959
  463   HG21  VAL  59          3HG2      VAL  59 -39.539   8.028 -18.558
  464   HG22  VAL  59          1HG2      VAL  59 -40.068   6.356 -18.668
  465   HG23  VAL  59          2HG2      VAL  59 -40.695   7.534 -19.807
  466    H    MET  60           H        MET  60 -41.600  10.302 -20.133
  467    HA   MET  60           HA       MET  60 -38.970  10.957 -19.862
  468    HB2  MET  60           2HB      MET  60 -41.171  12.510 -21.283
  469    HB3  MET  60           3HB      MET  60 -39.464  12.924 -21.419
  470    HG2  MET  60           2HG      MET  60 -40.706  10.304 -22.282
  471    HG3  MET  60           3HG      MET  60 -40.229  11.631 -23.317
  472    HE1  MET  60           3HE      MET  60 -37.589   8.238 -21.832
  473    HE2  MET  60           1HE      MET  60 -38.803   8.928 -20.739
  474    HE3  MET  60           2HE      MET  60 -39.305   8.223 -22.290
  475    H    GLN  61           H        GLN  61 -37.944  11.869 -18.329
  476    HA   GLN  61           HA       GLN  61 -37.016  13.472 -17.084
  477    HB2  GLN  61           2HB      GLN  61 -38.860  15.433 -18.446
  478    HB3  GLN  61           3HB      GLN  61 -37.321  15.789 -17.659
  479    HG2  GLN  61           2HG      GLN  61 -36.047  14.967 -19.445
  480    HG3  GLN  61           3HG      GLN  61 -37.258  13.798 -19.947
  481   HE21  GLN  61          1HE2      GLN  61 -37.508  14.261 -22.087
  482   HE22  GLN  61          2HE2      GLN  61 -38.166  15.787 -22.643
  483    H    ARG  62           H        ARG  62 -39.441  12.012 -16.081
  484    HA   ARG  62           HA       ARG  62 -40.463  13.972 -14.075
  485    HB2  ARG  62           2HB      ARG  62 -41.167  11.121 -14.831
  486    HB3  ARG  62           3HB      ARG  62 -41.953  12.030 -13.535
  487    HG2  ARG  62           2HG      ARG  62 -42.666  13.782 -15.167
  488    HG3  ARG  62           3HG      ARG  62 -41.842  12.911 -16.478
  489    HD2  ARG  62           2HD      ARG  62 -44.166  12.350 -16.528
  490    HD3  ARG  62           3HD      ARG  62 -43.202  10.927 -16.042
  491    HE   ARG  62           HE       ARG  62 -43.867  12.176 -13.673
  492   HH11  ARG  62          1HH1      ARG  62 -45.576  10.564 -16.265
  493   HH12  ARG  62          2HH1      ARG  62 -46.924  10.085 -15.253
  494   HH21  ARG  62          2HH2      ARG  62 -45.673  11.574 -12.403
  495   HH22  ARG  62          1HH2      ARG  62 -46.951  10.624 -13.103
  496    HA   PRO  63           HA       PRO  63 -37.897  12.741 -10.724
  497    HB2  PRO  63           2HB      PRO  63 -39.659  12.508  -8.587
  498    HB3  PRO  63           3HB      PRO  63 -39.004  14.037  -9.238
  499    HG2  PRO  63           2HG      PRO  63 -41.648  12.710  -9.912
  500    HG3  PRO  63           3HG      PRO  63 -41.346  14.428  -9.484
  501    HD2  PRO  63           2HD      PRO  63 -41.602  13.703 -12.045
  502    HD3  PRO  63           3HD      PRO  63 -40.297  14.839 -11.594
  503    H    CYS  64           H        CYS  64 -36.975  10.918 -10.114
  504    HA   CYS  64           HA       CYS  64 -37.984   8.289 -10.680
  505    HB2  CYS  64           2HB      CYS  64 -35.627   9.088 -10.800
  506    HB3  CYS  64           3HB      CYS  64 -35.607   9.265  -9.045
  507    HG   CYS  64           HG       CYS  64 -36.390   6.668  -8.684
  508    H    THR  65           H        THR  65 -38.508  10.323  -7.941
  509    HA   THR  65           HA       THR  65 -38.710   8.513  -5.831
  510    HB   THR  65           HB       THR  65 -40.479  10.956  -6.005
  511    HG1  THR  65           HG1      THR  65 -38.711  12.160  -5.331
  512   HG21  THR  65          1HG2      THR  65 -38.829   9.627  -3.819
  513   HG22  THR  65          2HG2      THR  65 -39.851  11.075  -3.611
  514   HG23  THR  65          3HG2      THR  65 -40.592   9.512  -3.991
  515    H    CYS  66           H        CYS  66 -39.720   6.749  -6.242
  516    HA   CYS  66           HA       CYS  66 -41.958   6.068  -7.600
  517    HB2  CYS  66           2HB      CYS  66 -42.082   4.064  -6.156
  518    HB3  CYS  66           3HB      CYS  66 -40.398   4.480  -6.530
  519    HG   CYS  66           HG       CYS  66 -40.538   3.691  -4.033
  520    H    ASP  67           H        ASP  67 -42.161   7.833  -4.644
  521    HA   ASP  67           HA       ASP  67 -44.806   7.456  -3.754
  522    HB2  ASP  67           2HB      ASP  67 -43.099   8.992  -2.748
  523    HB3  ASP  67           3HB      ASP  67 -43.288  10.077  -4.118
  524    H    PHE  68           H        PHE  68 -43.648   9.402  -6.558
  525    HA   PHE  68           HA       PHE  68 -46.226  10.479  -7.246
  526    HB2  PHE  68           2HB      PHE  68 -43.628  10.169  -8.800
  527    HB3  PHE  68           3HB      PHE  68 -45.037  11.009  -9.426
  528    HD1  PHE  68           HD2      PHE  68 -46.059  12.934  -7.964
  529    HD2  PHE  68           HD1      PHE  68 -42.037  11.441  -7.567
  530    HE1  PHE  68           HE2      PHE  68 -45.382  15.046  -6.843
  531    HE2  PHE  68           HE1      PHE  68 -41.364  13.544  -6.430
  532    HZ   PHE  68           HZ       PHE  68 -43.036  15.352  -6.072
  533    H    LEU  69           H        LEU  69 -45.091   7.297  -7.625
  534    HA   LEU  69           HA       LEU  69 -47.359   6.690  -9.428
  535    HB2  LEU  69           2HB      LEU  69 -46.088   4.916 -10.532
  536    HB3  LEU  69           3HB      LEU  69 -45.485   6.531 -10.827
  537    HG   LEU  69           HG       LEU  69 -43.634   6.112  -9.158
  538   HD11  LEU  69          1HD1      LEU  69 -44.596   3.224  -9.373
  539   HD12  LEU  69          2HD1      LEU  69 -43.040   3.748  -8.685
  540   HD13  LEU  69          3HD1      LEU  69 -44.546   4.189  -7.892
  541   HD21  LEU  69          3HD2      LEU  69 -42.317   4.754 -10.724
  542   HD22  LEU  69          1HD2      LEU  69 -43.807   4.235 -11.546
  543   HD23  LEU  69          2HD2      LEU  69 -43.305   5.940 -11.587
  544    H    HIS  70           H        HIS  70 -46.938   6.665  -6.375
  545    HA   HIS  70           HA       HIS  70 -46.901   3.968  -5.546
  546    HB2  HIS  70           2HB      HIS  70 -47.509   4.675  -3.446
  547    HB3  HIS  70           3HB      HIS  70 -46.677   6.064  -4.106
  548    HD2  HIS  70           HD2      HIS  70 -48.872   7.753  -5.482
  549    HE1  HIS  70           HE1      HIS  70 -51.344   7.205  -2.056
  550    HE2  HIS  70           HE2      HIS  70 -50.972   8.607  -4.146
  551    H    GLY  71           H        GLY  71 -48.427   2.452  -4.945
  552    HA2  GLY  71           HA2      GLY  71 -51.090   2.635  -6.290
  553    HA3  GLY  71           HA3      GLY  71 -50.210   1.144  -5.977
  554    HA   PRO  72           HA       PRO  72 -53.320   2.421  -2.631
  555    HB2  PRO  72           2HB      PRO  72 -54.671  -0.164  -3.411
  556    HB3  PRO  72           3HB      PRO  72 -55.410   1.387  -2.906
  557    HG2  PRO  72           2HG      PRO  72 -55.352   0.723  -5.520
  558    HG3  PRO  72           3HG      PRO  72 -54.906   2.393  -5.029
  559    HD2  PRO  72           2HD      PRO  72 -53.064   0.065  -5.650
  560    HD3  PRO  72           3HD      PRO  72 -52.993   1.747  -6.248
  561    H    ARG  73           H        ARG  73 -51.348  -0.373  -3.063
  562    HA   ARG  73           HA       ARG  73 -51.434  -0.953  -0.130
  563    HB2  ARG  73           2HB      ARG  73 -50.817  -2.822  -2.438
  564    HB3  ARG  73           3HB      ARG  73 -50.387  -3.178  -0.764
  565    HG2  ARG  73           2HG      ARG  73 -52.734  -2.899  -0.063
  566    HG3  ARG  73           3HG      ARG  73 -53.223  -2.599  -1.734
  567    HD2  ARG  73           2HD      ARG  73 -51.767  -5.140  -0.905
  568    HD3  ARG  73           3HD      ARG  73 -53.505  -4.984  -0.722
  569    HE   ARG  73           HE       ARG  73 -52.003  -5.244  -3.253
  570   HH11  ARG  73          1HH2      ARG  73 -55.165  -4.526  -1.891
  571   HH12  ARG  73          2HH2      ARG  73 -55.981  -4.993  -3.357
  572   HH21  ARG  73          1HH1      ARG  73 -53.070  -5.840  -5.001
  573   HH22  ARG  73          2HH1      ARG  73 -54.825  -5.758  -5.087
  574    H    THR  74           H        THR  74 -49.590   0.897  -2.145
  575    HA   THR  74           HA       THR  74 -46.955   0.137  -1.175
  576    HB   THR  74           HB       THR  74 -47.739   2.911  -2.062
  577    HG1  THR  74           HG1      THR  74 -46.618   1.142  -3.889
  578   HG21  THR  74          1HG2      THR  74 -45.382   2.900  -2.966
  579   HG22  THR  74          2HG2      THR  74 -45.469   2.788  -1.206
  580   HG23  THR  74          3HG2      THR  74 -45.135   1.331  -2.163
  581    H    GLN  75           H        GLN  75 -45.817   0.765   0.542
  582    HA   GLN  75           HA       GLN  75 -47.279   2.075   2.739
  583    HB2  GLN  75           2HB      GLN  75 -44.479   0.931   2.721
  584    HB3  GLN  75           3HB      GLN  75 -45.345   1.590   4.113
  585    HG2  GLN  75           2HG      GLN  75 -47.099  -0.142   3.866
  586    HG3  GLN  75           3HG      GLN  75 -46.191  -0.865   2.530
  587   HE21  GLN  75          2HE2      GLN  75 -46.527  -2.753   4.201
  588   HE22  GLN  75          1HE2      GLN  75 -45.211  -2.938   5.353
  589    H    ARG  76           H        ARG  76 -47.011   4.037   3.436
  590    HA   ARG  76           HA       ARG  76 -45.743   6.027   1.734
  591    HB2  ARG  76           2HB      ARG  76 -46.801   6.427   4.529
  592    HB3  ARG  76           3HB      ARG  76 -46.584   7.661   3.288
  593    HG2  ARG  76           2HG      ARG  76 -48.673   5.444   3.351
  594    HG3  ARG  76           3HG      ARG  76 -48.941   7.180   3.446
  595    HD2  ARG  76           2HD      ARG  76 -48.162   7.438   1.093
  596    HD3  ARG  76           3HD      ARG  76 -47.824   5.710   1.014
  597    HE   ARG  76           HE       ARG  76 -50.048   5.217   0.761
  598   HH11  ARG  76          2HH1      ARG  76 -49.881   8.620   1.593
  599   HH12  ARG  76          1HH1      ARG  76 -51.571   8.874   1.261
  600   HH21  ARG  76          1HH2      ARG  76 -52.194   5.605   0.391
  601   HH22  ARG  76          2HH2      ARG  76 -52.844   7.203   0.608
  602    H    ARG  77           H        ARG  77 -44.905   4.640   4.890
  603    HA   ARG  77           HA       ARG  77 -42.467   5.980   5.383
  604    HB2  ARG  77           2HB      ARG  77 -41.813   4.063   6.669
  605    HB3  ARG  77           3HB      ARG  77 -43.486   4.517   6.985
  606    HG2  ARG  77           2HG      ARG  77 -44.291   2.541   6.391
  607    HG3  ARG  77           3HG      ARG  77 -43.375   2.426   4.906
  608    HD2  ARG  77           2HD      ARG  77 -42.121   1.904   7.623
  609    HD3  ARG  77           3HD      ARG  77 -42.961   0.676   6.684
  610    HE   ARG  77           HE       ARG  77 -40.463   2.101   5.811
  611   HH11  ARG  77          1HH1      ARG  77 -42.518  -0.741   5.325
  612   HH12  ARG  77          2HH1      ARG  77 -41.162  -1.632   4.634
  613   HH21  ARG  77          1HH2      ARG  77 -39.002   1.013   4.723
  614   HH22  ARG  77          2HH2      ARG  77 -39.301  -0.657   4.226
  615    H    ALA  78           H        ALA  78 -43.030   3.260   3.179
  616    HA   ALA  78           HA       ALA  78 -40.254   2.819   2.509
  617    HB1  ALA  78           3HB      ALA  78 -41.182   1.375   0.774
  618    HB2  ALA  78           1HB      ALA  78 -42.058   1.100   2.274
  619    HB3  ALA  78           2HB      ALA  78 -42.780   2.041   0.942
  620    H    ALA  79           H        ALA  79 -42.967   4.548   0.894
  621    HA   ALA  79           HA       ALA  79 -41.356   5.523  -1.302
  622    HB1  ALA  79           3HB      ALA  79 -43.927   6.648  -0.096
  623    HB2  ALA  79           1HB      ALA  79 -43.291   6.967  -1.720
  624    HB3  ALA  79           2HB      ALA  79 -43.850   5.337  -1.303
  625    H    ALA  80           H        ALA  80 -42.043   6.847   1.921
  626    HA   ALA  80           HA       ALA  80 -40.837   9.388   1.532
  627    HB1  ALA  80           3HB      ALA  80 -42.457   8.923   3.297
  628    HB2  ALA  80           1HB      ALA  80 -41.339   7.765   4.055
  629    HB3  ALA  80           2HB      ALA  80 -40.934   9.496   4.007
  630    H    GLN  81           H        GLN  81 -39.468   6.421   3.153
  631    HA   GLN  81           HA       GLN  81 -36.822   7.267   3.561
  632    HB2  GLN  81           2HB      GLN  81 -37.999   4.580   2.752
  633    HB3  GLN  81           3HB      GLN  81 -36.284   4.803   3.101
  634    HG2  GLN  81           2HG      GLN  81 -36.744   5.478   5.383
  635    HG3  GLN  81           3HG      GLN  81 -38.479   5.441   5.114
  636   HE21  GLN  81          2HE2      GLN  81 -35.578   3.435   5.557
  637   HE22  GLN  81          1HE2      GLN  81 -36.461   1.937   5.791
  638    H    ILE  82           H        ILE  82 -38.300   5.963   0.517
  639    HA   ILE  82           HA       ILE  82 -35.867   6.217  -1.006
  640    HB   ILE  82           HB       ILE  82 -38.784   5.961  -1.703
  641   HG12  ILE  82          2HG1      ILE  82 -36.368   4.216  -2.383
  642   HG13  ILE  82          3HG1      ILE  82 -37.178   4.108  -0.818
  643   HG21  ILE  82          1HG2      ILE  82 -36.470   6.465  -3.620
  644   HG22  ILE  82          2HG2      ILE  82 -38.042   5.792  -4.120
  645   HG23  ILE  82          3HG2      ILE  82 -37.956   7.422  -3.435
  646   HD11  ILE  82          3HD1      ILE  82 -38.464   3.580  -3.497
  647   HD12  ILE  82          1HD1      ILE  82 -38.066   2.429  -2.202
  648   HD13  ILE  82          2HD1      ILE  82 -39.325   3.660  -1.930
  649    H    ALA  83           H        ALA  83 -38.672   8.468  -0.697
  650    HA   ALA  83           HA       ALA  83 -37.651  10.562  -2.240
  651    HB1  ALA  83           3HB      ALA  83 -39.128  11.999  -0.989
  652    HB2  ALA  83           1HB      ALA  83 -39.925  10.417  -1.192
  653    HB3  ALA  83           2HB      ALA  83 -39.190  10.864   0.363
  654    H    GLN  84           H        GLN  84 -36.745   9.720   1.095
  655    HA   GLN  84           HA       GLN  84 -35.059  12.072   1.527
  656    HB2  GLN  84           2HB      GLN  84 -34.713   9.406   2.934
  657    HB3  GLN  84           3HB      GLN  84 -34.197  11.002   3.440
  658    HG2  GLN  84           2HG      GLN  84 -36.913   9.780   3.546
  659    HG3  GLN  84           3HG      GLN  84 -36.010  10.475   4.822
  660   HE21  GLN  84          1HE2      GLN  84 -38.445  11.030   2.502
  661   HE22  GLN  84          2HE2      GLN  84 -38.637  12.768   2.780
  662    H    ALA  85           H        ALA  85 -34.523   8.728   0.252
  663    HA   ALA  85           HA       ALA  85 -31.648   8.948   0.181
  664    HB1  ALA  85           3HB      ALA  85 -33.535   7.130  -1.389
  665    HB2  ALA  85           1HB      ALA  85 -31.788   6.911  -1.189
  666    HB3  ALA  85           2HB      ALA  85 -32.858   6.786   0.220
  667    H    LEU  86           H        LEU  86 -34.235   9.790  -2.097
  668    HA   LEU  86           HA       LEU  86 -32.350  10.543  -4.192
  669    HB2  LEU  86           2HB      LEU  86 -35.275  11.272  -4.127
  670    HB3  LEU  86           3HB      LEU  86 -34.182  11.143  -5.491
  671    HG   LEU  86           HG       LEU  86 -35.688   9.010  -4.021
  672   HD11  LEU  86          1HD1      LEU  86 -36.161   8.257  -6.276
  673   HD12  LEU  86          2HD1      LEU  86 -36.398  10.014  -6.189
  674   HD13  LEU  86          3HD1      LEU  86 -34.936   9.364  -6.941
  675   HD21  LEU  86          3HD2      LEU  86 -34.372   7.208  -5.125
  676   HD22  LEU  86          1HD2      LEU  86 -33.139   8.396  -5.609
  677   HD23  LEU  86          2HD2      LEU  86 -33.415   8.005  -3.899
  678    H    LEU  87           H        LEU  87 -34.089  12.265  -1.621
  679    HA   LEU  87           HA       LEU  87 -33.349  14.942  -2.227
  680    HB2  LEU  87           2HB      LEU  87 -35.095  14.646  -0.770
  681    HB3  LEU  87           3HB      LEU  87 -34.374  13.266   0.019
  682    HG   LEU  87           HG       LEU  87 -33.255  15.893   0.583
  683   HD11  LEU  87          1HD1      LEU  87 -35.688  14.654   1.902
  684   HD12  LEU  87          2HD1      LEU  87 -34.850  16.113   2.482
  685   HD13  LEU  87          3HD1      LEU  87 -35.673  16.133   0.918
  686   HD21  LEU  87          3HD2      LEU  87 -32.013  14.049   1.556
  687   HD22  LEU  87          1HD2      LEU  87 -32.799  14.979   2.816
  688   HD23  LEU  87          2HD2      LEU  87 -33.494  13.429   2.318
  689    H    GLY  88           H        GLY  88 -31.634  12.255  -0.702
  690    HA2  GLY  88           HA2      GLY  88 -29.263  12.107  -1.173
  691    HA3  GLY  88           HA3      GLY  88 -29.090  13.840  -0.911
  692    H    ALA  89           H        ALA  89 -31.078  12.089   1.400
  693    HA   ALA  89           HA       ALA  89 -29.427  12.772   3.621
  694    HB1  ALA  89           3HB      ALA  89 -31.836  12.385   3.821
  695    HB2  ALA  89           1HB      ALA  89 -31.635  10.681   3.353
  696    HB3  ALA  89           2HB      ALA  89 -30.955  11.275   4.882
  697    H    GLU  90           H        GLU  90 -29.939   9.629   1.984
  698    HA   GLU  90           HA       GLU  90 -27.158   8.947   2.012
  699    HB2  GLU  90           2HB      GLU  90 -27.367   6.802   3.230
  700    HB3  GLU  90           3HB      GLU  90 -27.509   8.203   4.278
  701    HG2  GLU  90           2HG      GLU  90 -29.989   7.923   4.324
  702    HG3  GLU  90           3HG      GLU  90 -29.841   6.503   3.285
  703    H    GLU  91           H        GLU  91 -26.697   7.362   0.456
  704    HA   GLU  91           HA       GLU  91 -28.835   6.432  -1.379
  705    HB2  GLU  91           2HB      GLU  91 -26.658   6.994  -2.256
  706    HB3  GLU  91           3HB      GLU  91 -25.833   5.891  -1.154
  707    HG2  GLU  91           2HG      GLU  91 -27.982   4.809  -2.973
  708    HG3  GLU  91           3HG      GLU  91 -26.441   5.263  -3.684
  709    H    ARG  92           H        ARG  92 -30.116   4.834  -0.781
  710    HA   ARG  92           HA       ARG  92 -29.107   2.460   0.665
  711    HB2  ARG  92           2HB      ARG  92 -29.857   4.186   2.368
  712    HB3  ARG  92           3HB      ARG  92 -31.457   4.147   1.650
  713    HG2  ARG  92           2HG      ARG  92 -31.482   2.798   3.637
  714    HG3  ARG  92           3HG      ARG  92 -31.656   1.730   2.253
  715    HD2  ARG  92           2HD      ARG  92 -30.173   0.729   3.885
  716    HD3  ARG  92           3HD      ARG  92 -29.248   1.113   2.429
  717    HE   ARG  92           HE       ARG  92 -29.085   3.316   4.283
  718   HH11  ARG  92          1HH1      ARG  92 -27.754   0.070   3.988
  719   HH12  ARG  92          2HH1      ARG  92 -26.363   0.499   4.949
  720   HH21  ARG  92          1HH2      ARG  92 -27.447   3.756   5.419
  721   HH22  ARG  92          2HH2      ARG  92 -26.165   2.589   5.775
  722    H    LYS  93           H        LYS  93 -30.088   0.624   0.071
  723    HA   LYS  93           HA       LYS  93 -32.234   0.581  -1.933
  724    HB2  LYS  93           2HB      LYS  93 -30.379  -0.988  -2.027
  725    HB3  LYS  93           3HB      LYS  93 -30.877  -1.677  -0.459
  726    HG2  LYS  93           2HG      LYS  93 -33.142  -2.146  -1.673
  727    HG3  LYS  93           3HG      LYS  93 -32.245  -1.784  -3.153
  728    HD2  LYS  93           2HD      LYS  93 -31.525  -3.904  -1.098
  729    HD3  LYS  93           3HD      LYS  93 -32.331  -4.203  -2.640
  730    HE2  LYS  93           2HE      LYS  93 -30.333  -3.270  -3.835
  731    HE3  LYS  93           3HE      LYS  93 -29.513  -3.072  -2.276
  732    HZ1  LYS  93           HZ1      LYS  93 -30.439  -5.629  -3.459
  733    HZ2  LYS  93           HZ2      LYS  93 -28.881  -5.153  -3.348
  734    HZ3  LYS  93           HZ3      LYS  93 -29.716  -5.510  -1.982
  735    H    VAL  94           H        VAL  94 -34.321   0.499  -1.525
  736    HA   VAL  94           HA       VAL  94 -35.372  -0.423   1.119
  737    HB   VAL  94           HB       VAL  94 -36.687   1.840  -0.386
  738   HG11  VAL  94          1HG1      VAL  94 -37.618   2.397   1.839
  739   HG12  VAL  94          2HG1      VAL  94 -38.019   0.752   1.393
  740   HG13  VAL  94          3HG1      VAL  94 -36.713   1.049   2.562
  741   HG21  VAL  94          3HG2      VAL  94 -34.583   2.227   1.785
  742   HG22  VAL  94          1HG2      VAL  94 -34.478   2.780   0.095
  743   HG23  VAL  94          2HG2      VAL  94 -35.675   3.490   1.171
  744    H    GLU  95           H        GLU  95 -37.506  -1.269   1.016
  745    HA   GLU  95           HA       GLU  95 -38.228  -2.596  -1.516
  746    HB2  GLU  95           2HB      GLU  95 -39.826  -3.777  -0.157
  747    HB3  GLU  95           3HB      GLU  95 -38.271  -3.748   0.707
  748    HG2  GLU  95           2HG      GLU  95 -39.150  -1.730   2.005
  749    HG3  GLU  95           3HG      GLU  95 -40.726  -2.014   1.272
  750    H    ILE  96           H        ILE  96 -40.513  -2.368  -2.322
  751    HA   ILE  96           HA       ILE  96 -42.273  -0.490  -1.278
  752    HB   ILE  96           HB       ILE  96 -42.329   0.794  -3.718
  753   HG12  ILE  96          2HG1      ILE  96 -40.272   1.819  -4.284
  754   HG13  ILE  96          3HG1      ILE  96 -39.413   0.984  -2.988
  755   HG21  ILE  96          1HG2      ILE  96 -42.702   1.743  -1.462
  756   HG22  ILE  96          2HG2      ILE  96 -40.945   2.012  -1.359
  757   HG23  ILE  96          3HG2      ILE  96 -41.898   2.795  -2.621
  758   HD11  ILE  96          3HD1      ILE  96 -39.175   0.193  -5.470
  759   HD12  ILE  96          1HD1      ILE  96 -39.207  -0.955  -4.137
  760   HD13  ILE  96          2HD1      ILE  96 -40.678  -0.694  -5.117
  761    H    ALA  97           H        ALA  97 -44.291  -0.431  -2.322
  762    HA   ALA  97           HA       ALA  97 -44.769  -2.794  -4.029
  763    HB1  ALA  97           3HB      ALA  97 -47.097  -2.525  -3.548
  764    HB2  ALA  97           1HB      ALA  97 -46.245  -2.244  -2.019
  765    HB3  ALA  97           2HB      ALA  97 -46.866  -0.892  -2.997
  766    H    PHE  98           H        PHE  98 -45.709  -2.796  -5.996
  767    HA   PHE  98           HA       PHE  98 -46.001  -0.221  -7.479
  768    HB2  PHE  98           2HB      PHE  98 -44.725  -2.778  -8.447
  769    HB3  PHE  98           3HB      PHE  98 -45.522  -1.697  -9.570
  770    HD1  PHE  98           HD1      PHE  98 -42.652  -1.940  -7.179
  771    HD2  PHE  98           HD2      PHE  98 -44.628   0.391 -10.228
  772    HE1  PHE  98           HE1      PHE  98 -40.672  -0.436  -7.347
  773    HE2  PHE  98           HE2      PHE  98 -42.649   1.877 -10.382
  774    HZ   PHE  98           HZ       PHE  98 -40.698   1.499  -8.901
  775    H    TYR  99           H        TYR  99 -47.549  -0.320  -9.261
  776    HA   TYR  99           HA       TYR  99 -49.444  -2.534  -9.096
  777    HB2  TYR  99           2HB      TYR  99 -51.399  -1.325  -8.880
  778    HB3  TYR  99           3HB      TYR  99 -50.346  -0.641  -7.661
  779    HD1  TYR  99           HD2      TYR  99 -49.038   1.591  -8.367
  780    HD2  TYR  99           HD1      TYR  99 -52.606   0.081 -10.271
  781    HE1  TYR  99           HE2      TYR  99 -49.566   3.870  -9.220
  782    HE2  TYR  99           HE1      TYR  99 -53.122   2.358 -11.120
  783    HH   TYR  99           HH       TYR  99 -52.491   4.559 -11.162
  784    H    ARG 100           H        ARG 100 -50.364  -3.144 -10.943
  785    HA   ARG 100           HA       ARG 100 -49.380  -1.974 -13.485
  786    HB2  ARG 100           2HB      ARG 100 -51.629  -3.969 -13.374
  787    HB3  ARG 100           3HB      ARG 100 -50.391  -3.760 -14.600
  788    HG2  ARG 100           2HG      ARG 100 -50.080  -5.047 -11.853
  789    HG3  ARG 100           3HG      ARG 100 -50.186  -5.880 -13.382
  790    HD2  ARG 100           2HD      ARG 100 -47.913  -4.039 -12.522
  791    HD3  ARG 100           3HD      ARG 100 -47.874  -5.794 -12.476
  792    HE   ARG 100           HE       ARG 100 -47.252  -4.150 -14.701
  793   HH11  ARG 100          2HH2      ARG 100 -48.709  -7.286 -14.027
  794   HH12  ARG 100          1HH2      ARG 100 -48.338  -7.891 -15.616
  795   HH21  ARG 100          1HH1      ARG 100 -46.853  -4.989 -16.687
  796   HH22  ARG 100          2HH1      ARG 100 -47.324  -6.629 -17.090
  797    H    LYS 101           H        LYS 101 -50.588  -0.561 -14.737
  798    HA   LYS 101           HA       LYS 101 -52.317   1.164 -13.501
  799    HB2  LYS 101           2HB      LYS 101 -52.668   2.247 -15.635
  800    HB3  LYS 101           3HB      LYS 101 -51.000   1.787 -15.341
  801    HG2  LYS 101           2HG      LYS 101 -51.303   1.335 -17.569
  802    HG3  LYS 101           3HG      LYS 101 -51.401  -0.259 -16.820
  803    HD2  LYS 101           2HD      LYS 101 -53.977   0.046 -16.931
  804    HD3  LYS 101           3HD      LYS 101 -53.666   1.461 -17.930
  805    HE2  LYS 101           2HE      LYS 101 -52.689  -1.381 -18.432
  806    HE3  LYS 101           3HE      LYS 101 -54.147  -0.699 -19.167
  807    HZ1  LYS 101           HZ1      LYS 101 -52.302  -0.537 -20.704
  808    HZ2  LYS 101           HZ2      LYS 101 -52.720   0.976 -20.256
  809    HZ3  LYS 101           HZ3      LYS 101 -51.369   0.270 -19.638
  810    H    ASP 102           H        ASP 102 -53.466  -1.805 -14.657
  811    HA   ASP 102           HA       ASP 102 -56.282  -1.093 -14.861
  812    HB2  ASP 102           2HB      ASP 102 -54.858  -3.748 -14.441
  813    HB3  ASP 102           3HB      ASP 102 -56.585  -3.571 -14.741
  814    H    GLY 103           H        GLY 103 -54.201  -1.293 -12.173
  815    HA2  GLY 103           HA2      GLY 103 -55.042  -0.450 -10.062
  816    HA3  GLY 103           HA3      GLY 103 -56.500  -1.416 -10.253
  817    H    SER 104           H        SER 104 -53.800  -3.287 -11.161
  818    HA   SER 104           HA       SER 104 -54.164  -4.969  -8.777
  819    HB2  SER 104           2HB      SER 104 -52.516  -5.400 -11.292
  820    HB3  SER 104           3HB      SER 104 -52.814  -6.602 -10.020
  821    HG   SER 104           HG       SER 104 -54.290  -6.819 -11.766
  822    H    CYS 105           H        CYS 105 -53.108  -4.173  -7.007
  823    HA   CYS 105           HA       CYS 105 -50.293  -3.281  -7.247
  824    HB2  CYS 105           2HB      CYS 105 -52.063  -1.732  -6.430
  825    HB3  CYS 105           3HB      CYS 105 -52.305  -2.780  -5.025
  826    HG   CYS 105           HG       CYS 105 -49.343  -1.596  -5.968
  827    H    PHE 106           H        PHE 106 -48.596  -4.101  -6.130
  828    HA   PHE 106           HA       PHE 106 -48.961  -6.080  -3.973
  829    HB2  PHE 106           2HB      PHE 106 -47.458  -7.712  -5.201
  830    HB3  PHE 106           3HB      PHE 106 -49.102  -7.569  -5.793
  831    HD1  PHE 106           HD1      PHE 106 -45.562  -6.604  -6.512
  832    HD2  PHE 106           HD2      PHE 106 -49.594  -6.821  -8.027
  833    HE1  PHE 106           HE1      PHE 106 -44.750  -6.017  -8.772
  834    HE2  PHE 106           HE2      PHE 106 -48.773  -6.261 -10.292
  835    HZ   PHE 106           HZ       PHE 106 -46.339  -5.843 -10.674
  836    H    LEU 107           H        LEU 107 -47.232  -6.340  -2.636
  837    HA   LEU 107           HA       LEU 107 -44.805  -4.657  -3.017
  838    HB2  LEU 107           2HB      LEU 107 -46.193  -4.358  -0.946
  839    HB3  LEU 107           3HB      LEU 107 -45.911  -6.032  -0.534
  840    HG   LEU 107           HG       LEU 107 -44.577  -4.503   0.791
  841   HD11  LEU 107          1HD1      LEU 107 -42.540  -5.867  -0.992
  842   HD12  LEU 107          2HD1      LEU 107 -42.432  -5.490   0.714
  843   HD13  LEU 107          3HD1      LEU 107 -43.544  -6.769   0.166
  844   HD21  LEU 107          3HD2      LEU 107 -43.146  -3.689  -1.718
  845   HD22  LEU 107          1HD2      LEU 107 -44.292  -2.685  -0.770
  846   HD23  LEU 107          2HD2      LEU 107 -42.751  -3.188  -0.062
  847    H    CYS 108           H        CYS 108 -43.008  -5.621  -3.612
  848    HA   CYS 108           HA       CYS 108 -42.449  -8.450  -2.876
  849    HB2  CYS 108           2HB      CYS 108 -41.971  -7.178  -5.608
  850    HB3  CYS 108           3HB      CYS 108 -41.422  -8.791  -5.104
  851    HG   CYS 108           HG       CYS 108 -43.935  -9.560  -4.366
  852    H    LEU 109           H        LEU 109 -39.939  -8.840  -3.292
  853    HA   LEU 109           HA       LEU 109 -38.619  -6.863  -1.577
  854    HB2  LEU 109           2HB      LEU 109 -37.574  -9.453  -2.767
  855    HB3  LEU 109           3HB      LEU 109 -36.825  -8.520  -1.479
  856    HG   LEU 109           HG       LEU 109 -39.514  -9.960  -1.301
  857   HD11  LEU 109          1HD1      LEU 109 -36.811 -10.607  -0.062
  858   HD12  LEU 109          2HD1      LEU 109 -38.331 -11.494   0.198
  859   HD13  LEU 109          3HD1      LEU 109 -37.581 -11.480  -1.407
  860   HD21  LEU 109          3HD2      LEU 109 -37.910  -8.485   0.835
  861   HD22  LEU 109          1HD2      LEU 109 -39.498  -8.005   0.192
  862   HD23  LEU 109          2HD2      LEU 109 -39.344  -9.493   1.131
  863    H    VAL 110           H        VAL 110 -39.068  -5.325  -3.477
  864    HA   VAL 110           HA       VAL 110 -37.615  -5.401  -5.875
  865    HB   VAL 110           HB       VAL 110 -38.743  -2.998  -4.454
  866   HG11  VAL 110          1HG1      VAL 110 -38.894  -2.042  -6.778
  867   HG12  VAL 110          2HG1      VAL 110 -37.218  -2.310  -6.295
  868   HG13  VAL 110          3HG1      VAL 110 -38.022  -3.467  -7.375
  869   HG21  VAL 110          3HG2      VAL 110 -39.949  -4.809  -6.598
  870   HG22  VAL 110          1HG2      VAL 110 -40.491  -4.695  -4.911
  871   HG23  VAL 110          2HG2      VAL 110 -40.684  -3.317  -5.979
  872    H    ASP 111           H        ASP 111 -35.712  -4.401  -6.633
  873    HA   ASP 111           HA       ASP 111 -33.698  -4.080  -4.454
  874    HB2  ASP 111           2HB      ASP 111 -33.723  -6.027  -6.161
  875    HB3  ASP 111           3HB      ASP 111 -33.026  -4.860  -7.282
  876    H    VAL 112           H        VAL 112 -34.382  -1.809  -4.257
  877    HA   VAL 112           HA       VAL 112 -33.996   0.005  -6.501
  878    HB   VAL 112           HB       VAL 112 -34.726   0.623  -3.610
  879   HG11  VAL 112          1HG1      VAL 112 -35.399   2.144  -6.159
  880   HG12  VAL 112          2HG1      VAL 112 -35.819   2.605  -4.502
  881   HG13  VAL 112          3HG1      VAL 112 -34.129   2.633  -5.006
  882   HG21  VAL 112          3HG2      VAL 112 -37.070   0.597  -4.437
  883   HG22  VAL 112          1HG2      VAL 112 -36.494  -0.050  -5.996
  884   HG23  VAL 112          2HG2      VAL 112 -36.334  -1.001  -4.507
  885    H    VAL 113           H        VAL 113 -31.640  -0.569  -6.730
  886    HA   VAL 113           HA       VAL 113 -29.966   1.066  -4.852
  887    HB   VAL 113           HB       VAL 113 -29.639  -1.295  -4.542
  888   HG11  VAL 113          1HG1      VAL 113 -28.485  -2.717  -6.108
  889   HG12  VAL 113          2HG1      VAL 113 -29.961  -2.119  -6.877
  890   HG13  VAL 113          3HG1      VAL 113 -28.385  -1.421  -7.312
  891   HG21  VAL 113          3HG2      VAL 113 -27.203  -1.278  -4.549
  892   HG22  VAL 113          1HG2      VAL 113 -27.183   0.094  -5.674
  893   HG23  VAL 113          2HG2      VAL 113 -27.841   0.288  -4.031
  894    HA   PRO 114           HA       PRO 114 -29.044   3.247  -8.679
  895    HB2  PRO 114           2HB      PRO 114 -27.765   5.407  -7.749
  896    HB3  PRO 114           3HB      PRO 114 -29.449   5.069  -7.310
  897    HG2  PRO 114           2HG      PRO 114 -26.946   4.428  -5.737
  898    HG3  PRO 114           3HG      PRO 114 -28.442   5.254  -5.170
  899    HD2  PRO 114           2HD      PRO 114 -27.952   2.552  -4.820
  900    HD3  PRO 114           3HD      PRO 114 -29.595   3.233  -4.999
  901    H    VAL 115           H        VAL 115 -26.748   4.715  -9.344
  902    HA   VAL 115           HA       VAL 115 -24.516   2.741  -9.263
  903    HB   VAL 115           HB       VAL 115 -24.008   3.314 -11.616
  904   HG11  VAL 115          1HG1      VAL 115 -25.035   1.177 -10.980
  905   HG12  VAL 115          2HG1      VAL 115 -26.652   1.888 -11.146
  906   HG13  VAL 115          3HG1      VAL 115 -25.599   1.725 -12.566
  907   HG21  VAL 115          3HG2      VAL 115 -25.404   5.333 -11.759
  908   HG22  VAL 115          1HG2      VAL 115 -25.691   4.192 -13.081
  909   HG23  VAL 115          2HG2      VAL 115 -26.860   4.325 -11.736
  910    H    LYS 116           H        LYS 116 -22.607   3.383  -8.946
  911    HA   LYS 116           HA       LYS 116 -22.005   6.266  -8.512
  912    HB2  LYS 116           2HB      LYS 116 -21.082   3.859  -6.877
  913    HB3  LYS 116           3HB      LYS 116 -20.596   5.508  -6.595
  914    HG2  LYS 116           2HG      LYS 116 -22.466   5.971  -5.408
  915    HG3  LYS 116           3HG      LYS 116 -23.516   5.334  -6.657
  916    HD2  LYS 116           2HD      LYS 116 -24.000   4.117  -4.728
  917    HD3  LYS 116           3HD      LYS 116 -23.093   3.011  -5.767
  918    HE2  LYS 116           2HE      LYS 116 -21.050   3.395  -4.438
  919    HE3  LYS 116           3HE      LYS 116 -21.867   4.661  -3.509
  920    HZ1  LYS 116           HZ1      LYS 116 -22.618   1.790  -3.479
  921    HZ2  LYS 116           HZ2      LYS 116 -21.883   2.603  -2.263
  922    HZ3  LYS 116           HZ3      LYS 116 -23.423   2.977  -2.685
  923    H    ASN 117           H        ASN 117 -19.789   6.813  -8.516
  924    HA   ASN 117           HA       ASN 117 -18.271   5.457 -10.704
  925    HB2  ASN 117           2HB      ASN 117 -17.139   7.441 -11.082
  926    HB3  ASN 117           3HB      ASN 117 -18.767   7.972 -10.731
  927   HD21  ASN 117          2HD2      ASN 117 -19.133   8.875  -8.423
  928   HD22  ASN 117          1HD2      ASN 117 -17.720   9.638  -7.707
  929    H    GLU 118           H        GLU 118 -15.706   5.763 -10.288
  930    HA   GLU 118           HA       GLU 118 -15.025   3.776  -8.386
  931    HB2  GLU 118           2HB      GLU 118 -12.729   4.207  -9.013
  932    HB3  GLU 118           3HB      GLU 118 -13.771   4.192 -10.433
  933    HG2  GLU 118           2HG      GLU 118 -13.758   6.693 -10.455
  934    HG3  GLU 118           3HG      GLU 118 -12.692   6.692  -9.050
  935    H    ASP 119           H        ASP 119 -15.254   7.242  -7.866
  936    HA   ASP 119           HA       ASP 119 -13.804   7.281  -5.359
  937    HB2  ASP 119           2HB      ASP 119 -14.365   9.240  -6.922
  938    HB3  ASP 119           3HB      ASP 119 -15.989   9.195  -6.233
  939    H    GLY 120           H        GLY 120 -16.946   6.074  -6.204
  940    HA2  GLY 120           HA2      GLY 120 -18.335   4.835  -4.787
  941    HA3  GLY 120           HA3      GLY 120 -17.685   5.651  -3.365
  942    H    ALA 121           H        ALA 121 -18.343   8.051  -5.616
  943    HA   ALA 121           HA       ALA 121 -20.849   8.765  -4.261
  944    HB1  ALA 121           3HB      ALA 121 -19.238  10.356  -6.299
  945    HB2  ALA 121           1HB      ALA 121 -20.525  10.965  -5.249
  946    HB3  ALA 121           2HB      ALA 121 -18.988  10.425  -4.536
  947    H    VAL 122           H        VAL 122 -22.801   9.024  -5.098
  948    HA   VAL 122           HA       VAL 122 -23.442   7.386  -7.400
  949    HB   VAL 122           HB       VAL 122 -24.702   7.180  -5.395
  950   HG11  VAL 122          1HG1      VAL 122 -25.935   9.918  -5.786
  951   HG12  VAL 122          2HG1      VAL 122 -26.253   8.739  -4.509
  952   HG13  VAL 122          3HG1      VAL 122 -24.684   9.549  -4.574
  953   HG21  VAL 122          3HG2      VAL 122 -26.925   7.180  -6.327
  954   HG22  VAL 122          1HG2      VAL 122 -26.422   8.266  -7.641
  955   HG23  VAL 122          2HG2      VAL 122 -25.747   6.628  -7.527
  956    H    ILE 123           H        ILE 123 -22.847   8.187  -9.271
  957    HA   ILE 123           HA       ILE 123 -23.471  10.967  -9.952
  958    HB   ILE 123           HB       ILE 123 -22.140  10.856 -11.745
  959   HG12  ILE 123          2HG1      ILE 123 -22.898   9.010 -13.033
  960   HG13  ILE 123          3HG1      ILE 123 -21.161   8.950 -12.862
  961   HG21  ILE 123          1HG2      ILE 123 -20.007  10.072 -10.971
  962   HG22  ILE 123          2HG2      ILE 123 -20.934  10.657  -9.576
  963   HG23  ILE 123          3HG2      ILE 123 -20.771   8.916  -9.861
  964   HD11  ILE 123          3HD1      ILE 123 -21.444   7.135 -11.117
  965   HD12  ILE 123          1HD1      ILE 123 -23.180   7.131 -11.515
  966   HD13  ILE 123          2HD1      ILE 123 -21.998   6.716 -12.746
  967    H    MET 124           H        MET 124 -24.835   7.738 -10.579
  968    HA   MET 124           HA       MET 124 -27.093   9.174 -11.903
  969    HB2  MET 124           2HB      MET 124 -25.527   6.881 -13.119
  970    HB3  MET 124           3HB      MET 124 -27.244   7.106 -13.473
  971    HG2  MET 124           2HG      MET 124 -24.947   8.961 -14.026
  972    HG3  MET 124           3HG      MET 124 -25.906   8.088 -15.200
  973    HE1  MET 124           3HE      MET 124 -24.955  11.208 -13.947
  974    HE2  MET 124           1HE      MET 124 -25.200  11.067 -15.698
  975    HE3  MET 124           2HE      MET 124 -26.109  12.287 -14.769
  976    H    PHE 125           H        PHE 125 -29.021   8.267 -11.768
  977    HA   PHE 125           HA       PHE 125 -29.472   6.384  -9.468
  978    HB2  PHE 125           2HB      PHE 125 -30.920   8.835 -10.507
  979    HB3  PHE 125           3HB      PHE 125 -31.836   7.561  -9.725
  980    HD1  PHE 125           HD1      PHE 125 -28.974   7.423  -7.751
  981    HD2  PHE 125           HD2      PHE 125 -32.228  10.078  -8.731
  982    HE1  PHE 125           HE1      PHE 125 -28.716   8.543  -5.571
  983    HE2  PHE 125           HE2      PHE 125 -31.916  11.238  -6.553
  984    HZ   PHE 125           HZ       PHE 125 -30.159  10.467  -4.973
  985    H    ILE 126           H        ILE 126 -29.122   4.579 -10.778
  986    HA   ILE 126           HA       ILE 126 -31.303   4.036 -12.735
  987    HB   ILE 126           HB       ILE 126 -28.721   2.527 -12.354
  988   HG12  ILE 126          2HG1      ILE 126 -29.670   4.553 -14.441
  989   HG13  ILE 126          3HG1      ILE 126 -28.365   4.795 -13.299
  990   HG21  ILE 126          1HG2      ILE 126 -30.945   1.343 -13.277
  991   HG22  ILE 126          2HG2      ILE 126 -30.621   2.275 -14.707
  992   HG23  ILE 126          3HG2      ILE 126 -29.397   1.134 -14.127
  993   HD11  ILE 126          3HD1      ILE 126 -27.173   2.849 -14.318
  994   HD12  ILE 126          1HD1      ILE 126 -28.415   2.829 -15.588
  995   HD13  ILE 126          2HD1      ILE 126 -27.395   4.275 -15.389
  996    H    LEU 127           H        LEU 127 -32.728   4.028 -10.961
  997    HA   LEU 127           HA       LEU 127 -32.491   1.845  -9.003
  998    HB2  LEU 127           2HB      LEU 127 -34.537   4.088  -9.217
  999    HB3  LEU 127           3HB      LEU 127 -34.435   2.895  -7.936
 1000    HG   LEU 127           HG       LEU 127 -32.293   4.960  -8.652
 1001   HD11  LEU 127          1HD1      LEU 127 -33.985   5.947  -7.168
 1002   HD12  LEU 127          2HD1      LEU 127 -33.723   4.628  -5.994
 1003   HD13  LEU 127          3HD1      LEU 127 -32.408   5.746  -6.361
 1004   HD21  LEU 127          3HD2      LEU 127 -32.274   2.590  -6.788
 1005   HD22  LEU 127          1HD2      LEU 127 -31.118   3.044  -8.062
 1006   HD23  LEU 127          2HD2      LEU 127 -31.176   3.952  -6.543
 1007    H    ASN 128           H        ASN 128 -32.321   0.231 -10.249
 1008    HA   ASN 128           HA       ASN 128 -34.184  -0.914 -12.035
 1009    HB2  ASN 128           2HB      ASN 128 -32.154  -2.111 -10.088
 1010    HB3  ASN 128           3HB      ASN 128 -33.084  -3.087 -11.207
 1011   HD21  ASN 128          2HD2      ASN 128 -30.671  -0.332 -11.233
 1012   HD22  ASN 128          1HD2      ASN 128 -30.015  -0.893 -12.753
 1013    H    PHE 129           H        PHE 129 -36.388  -1.101 -11.541
 1014    HA   PHE 129           HA       PHE 129 -37.133  -1.807  -8.801
 1015    HB2  PHE 129           2HB      PHE 129 -38.854  -1.078 -11.176
 1016    HB3  PHE 129           3HB      PHE 129 -39.384  -1.321  -9.507
 1017    HD1  PHE 129           HD1      PHE 129 -37.921   0.169  -7.729
 1018    HD2  PHE 129           HD2      PHE 129 -38.732   1.172 -11.841
 1019    HE1  PHE 129           HE1      PHE 129 -37.610   2.577  -7.202
 1020    HE2  PHE 129           HE2      PHE 129 -38.442   3.578 -11.308
 1021    HZ   PHE 129           HZ       PHE 129 -37.868   4.286  -8.994
 1022    H    GLU 130           H        GLU 130 -35.891  -3.956  -9.394
 1023    HA   GLU 130           HA       GLU 130 -37.557  -5.839 -10.901
 1024    HB2  GLU 130           2HB      GLU 130 -35.956  -7.556 -10.202
 1025    HB3  GLU 130           3HB      GLU 130 -35.289  -6.194 -11.127
 1026    HG2  GLU 130           2HG      GLU 130 -34.181  -5.283  -9.359
 1027    HG3  GLU 130           3HG      GLU 130 -35.191  -5.993  -8.134
 1028    H    VAL 131           H        VAL 131 -39.294  -6.317 -10.169
 1029    HA   VAL 131           HA       VAL 131 -40.266  -6.895  -7.517
 1030    HB   VAL 131           HB       VAL 131 -41.169  -7.530 -10.331
 1031   HG11  VAL 131          1HG1      VAL 131 -42.806  -7.951  -7.821
 1032   HG12  VAL 131          2HG1      VAL 131 -43.389  -8.108  -9.489
 1033   HG13  VAL 131          3HG1      VAL 131 -42.191  -9.248  -8.874
 1034   HG21  VAL 131          3HG2      VAL 131 -42.245  -5.566  -8.260
 1035   HG22  VAL 131          1HG2      VAL 131 -41.218  -5.137  -9.642
 1036   HG23  VAL 131          2HG2      VAL 131 -42.833  -5.785  -9.925
 1037    H    VAL 132           H        VAL 132 -39.446  -8.544  -6.257
 1038    HA   VAL 132           HA       VAL 132 -39.324 -11.228  -7.492
 1039    HB   VAL 132           HB       VAL 132 -37.094 -10.433  -7.841
 1040   HG11  VAL 132          1HG1      VAL 132 -36.811 -10.067  -4.841
 1041   HG12  VAL 132          2HG1      VAL 132 -35.528  -9.914  -6.056
 1042   HG13  VAL 132          3HG1      VAL 132 -36.868  -8.766  -6.053
 1043   HG21  VAL 132          3HG2      VAL 132 -37.434 -12.825  -7.310
 1044   HG22  VAL 132          1HG2      VAL 132 -35.836 -12.230  -6.837
 1045   HG23  VAL 132          2HG2      VAL 132 -37.080 -12.481  -5.599
 1046    H    MET 133           H        MET 133 -39.908 -12.865  -6.244
 1047    HA   MET 133           HA       MET 133 -39.803 -12.701  -3.307
 1048    HB2  MET 133           2HB      MET 133 -42.361 -13.418  -4.807
 1049    HB3  MET 133           3HB      MET 133 -42.084 -13.680  -3.081
 1050    HG2  MET 133           2HG      MET 133 -41.674 -11.198  -2.849
 1051    HG3  MET 133           3HG      MET 133 -42.245 -11.018  -4.509
 1052    HE1  MET 133           3HE      MET 133 -46.028 -12.080  -4.225
 1053    HE2  MET 133           1HE      MET 133 -44.705 -11.606  -5.313
 1054    HE3  MET 133           2HE      MET 133 -44.715 -13.222  -4.570
 1055    H    GLU 134           H        GLU 134 -39.928 -14.827  -2.307
 1056    HA   GLU 134           HA       GLU 134 -38.913 -17.022  -3.980
 1057    HB2  GLU 134           2HB      GLU 134 -38.773 -18.309  -1.941
 1058    HB3  GLU 134           3HB      GLU 134 -37.971 -16.749  -1.776
 1059    HG2  GLU 134           2HG      GLU 134 -39.896 -15.872  -0.488
 1060    HG3  GLU 134           3HG      GLU 134 -40.742 -17.411  -0.684
 1061    H    LYS 135           H        LYS 135 -39.951 -19.015  -4.340
 1062    HA   LYS 135           HA       LYS 135 -42.867 -19.227  -3.937
 1063    HB2  LYS 135           2HB      LYS 135 -41.405 -18.859  -6.546
 1064    HB3  LYS 135           3HB      LYS 135 -42.695 -20.035  -6.542
 1065    HG2  LYS 135           2HG      LYS 135 -43.205 -17.236  -5.485
 1066    HG3  LYS 135           3HG      LYS 135 -43.169 -17.566  -7.206
 1067    HD2  LYS 135           2HD      LYS 135 -45.426 -17.573  -6.463
 1068    HD3  LYS 135           3HD      LYS 135 -45.006 -19.180  -7.018
 1069    HE2  LYS 135           2HE      LYS 135 -44.870 -18.502  -4.058
 1070    HE3  LYS 135           3HE      LYS 135 -46.434 -18.737  -4.828
 1071    HZ1  LYS 135           HZ1      LYS 135 -45.722 -20.814  -3.931
 1072    HZ2  LYS 135           HZ2      LYS 135 -45.677 -20.958  -5.551
 1073    HZ3  LYS 135           HZ3      LYS 135 -44.288 -20.799  -4.689
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  -4.252   1.057 -16.417
    2    H2   MET   1           2H       MET   1  -4.550   2.550 -17.007
    3    H3   MET   1           3H       MET   1  -3.074   1.866 -17.210
    4    HA   MET   1           HA       MET   1  -5.584   0.879 -18.405
    5    HB2  MET   1           2HB      MET   1  -3.233   2.336 -19.699
    6    HB3  MET   1           3HB      MET   1  -4.476   1.468 -20.599
    7    HG2  MET   1           2HG      MET   1  -6.224   2.924 -19.618
    8    HG3  MET   1           3HG      MET   1  -4.967   3.860 -18.794
    9    HE1  MET   1           3HE      MET   1  -6.235   6.319 -21.571
   10    HE2  MET   1           1HE      MET   1  -7.205   5.137 -20.664
   11    HE3  MET   1           2HE      MET   1  -5.947   6.083 -19.832
   12    HA   PRO   2           HA       PRO   2  -3.469  -2.952 -18.660
   13    HB2  PRO   2           2HB      PRO   2  -4.865  -4.320 -20.540
   14    HB3  PRO   2           3HB      PRO   2  -5.606  -3.783 -19.003
   15    HG2  PRO   2           2HG      PRO   2  -5.723  -2.378 -21.699
   16    HG3  PRO   2           3HG      PRO   2  -7.087  -2.811 -20.619
   17    HD2  PRO   2           2HD      PRO   2  -5.972  -0.335 -20.580
   18    HD3  PRO   2           3HD      PRO   2  -6.530  -1.123 -19.074
   19    H    VAL   3           H        VAL   3  -3.306  -0.873 -21.429
   20    HA   VAL   3           HA       VAL   3  -1.825  -2.602 -23.181
   21    HB   VAL   3           HB       VAL   3  -1.556  -0.657 -24.619
   22   HG11  VAL   3          1HG1      VAL   3  -3.683  -1.933 -24.610
   23   HG12  VAL   3          2HG1      VAL   3  -4.371  -0.767 -23.463
   24   HG13  VAL   3          3HG1      VAL   3  -3.885  -0.242 -25.085
   25   HG21  VAL   3          3HG2      VAL   3  -2.892   0.974 -22.407
   26   HG22  VAL   3          1HG2      VAL   3  -1.191   1.114 -22.904
   27   HG23  VAL   3          2HG2      VAL   3  -2.481   1.530 -24.038
   28    H    ARG   4           H        ARG   4  -0.617  -2.115 -20.484
   29    HA   ARG   4           HA       ARG   4   2.095  -1.087 -21.183
   30    HB2  ARG   4           2HB      ARG   4   2.499  -1.039 -18.799
   31    HB3  ARG   4           3HB      ARG   4   1.016  -0.172 -19.197
   32    HG2  ARG   4           2HG      ARG   4  -0.335  -2.140 -18.452
   33    HG3  ARG   4           3HG      ARG   4   1.159  -2.999 -18.040
   34    HD2  ARG   4           2HD      ARG   4   1.718  -1.182 -16.410
   35    HD3  ARG   4           3HD      ARG   4   0.213  -0.367 -16.834
   36    HE   ARG   4           HE       ARG   4  -1.024  -1.913 -15.621
   37   HH11  ARG   4          1HH2      ARG   4   2.278  -3.096 -15.725
   38   HH12  ARG   4          2HH2      ARG   4   1.975  -4.306 -14.509
   39   HH21  ARG   4          2HH1      ARG   4  -1.331  -3.472 -14.075
   40   HH22  ARG   4          1HH1      ARG   4  -0.016  -4.508 -13.607
   41    H    ARG   5           H        ARG   5   0.886  -3.679 -22.003
   42    HA   ARG   5           HA       ARG   5   3.275  -5.391 -21.748
   43    HB2  ARG   5           2HB      ARG   5   1.894  -7.369 -21.032
   44    HB3  ARG   5           3HB      ARG   5   2.173  -6.159 -19.788
   45    HG2  ARG   5           2HG      ARG   5  -0.081  -5.298 -19.964
   46    HG3  ARG   5           3HG      ARG   5  -0.419  -6.285 -21.392
   47    HD2  ARG   5           2HD      ARG   5  -0.101  -8.345 -19.995
   48    HD3  ARG   5           3HD      ARG   5   0.181  -7.317 -18.591
   49    HE   ARG   5           HE       ARG   5  -2.086  -6.839 -18.440
   50   HH11  ARG   5          1HH2      ARG   5  -1.597  -8.474 -21.503
   51   HH12  ARG   5          2HH2      ARG   5  -3.304  -8.722 -21.746
   52   HH21  ARG   5          1HH1      ARG   5  -4.245  -7.185 -18.818
   53   HH22  ARG   5          2HH1      ARG   5  -4.758  -7.998 -20.266
   54    H    GLY   6           H        GLY   6   2.929  -4.251 -23.898
   55    HA2  GLY   6           HA2      GLY   6   2.575  -4.460 -26.204
   56    HA3  GLY   6           HA3      GLY   6   1.885  -6.066 -25.949
   57    H    HIS   7           H        HIS   7   0.404  -5.075 -27.702
   58    HA   HIS   7           HA       HIS   7  -1.569  -3.112 -26.858
   59    HB2  HIS   7           2HB      HIS   7  -0.915  -3.439 -29.227
   60    HB3  HIS   7           3HB      HIS   7  -1.679  -5.033 -29.208
   61    HD2  HIS   7           HD2      HIS   7  -4.352  -5.110 -29.416
   62    HE1  HIS   7           HE1      HIS   7  -5.099  -0.912 -29.466
   63    HE2  HIS   7           HE2      HIS   7  -6.139  -3.213 -29.784
   64    H    VAL   8           H        VAL   8  -3.586  -3.355 -26.110
   65    HA   VAL   8           HA       VAL   8  -4.774  -6.048 -25.728
   66    HB   VAL   8           HB       VAL   8  -4.818  -3.906 -23.560
   67   HG11  VAL   8          1HG1      VAL   8  -5.800  -5.754 -22.185
   68   HG12  VAL   8          2HG1      VAL   8  -6.838  -5.305 -23.528
   69   HG13  VAL   8          3HG1      VAL   8  -5.852  -6.782 -23.630
   70   HG21  VAL   8          3HG2      VAL   8  -3.468  -5.533 -22.227
   71   HG22  VAL   8          1HG2      VAL   8  -3.274  -6.536 -23.680
   72   HG23  VAL   8          2HG2      VAL   8  -2.578  -4.904 -23.610
   73    H    ALA   9           H        ALA   9  -6.998  -6.096 -26.055
   74    HA   ALA   9           HA       ALA   9  -8.184  -4.078 -27.681
   75    HB1  ALA   9           3HB      ALA   9  -8.791  -6.469 -27.738
   76    HB2  ALA   9           1HB      ALA   9  -9.407  -6.374 -26.071
   77    HB3  ALA   9           2HB      ALA   9 -10.229  -5.503 -27.374
   78    HA   PRO  10           HA       PRO  10  -9.819  -1.148 -24.802
   79    HB2  PRO  10           2HB      PRO  10 -12.376  -0.571 -25.705
   80    HB3  PRO  10           3HB      PRO  10 -10.856   0.028 -26.419
   81    HG2  PRO  10           2HG      PRO  10 -12.503  -2.371 -27.288
   82    HG3  PRO  10           3HG      PRO  10 -11.803  -1.079 -28.314
   83    HD2  PRO  10           2HD      PRO  10 -10.583  -3.462 -28.047
   84    HD3  PRO  10           3HD      PRO  10  -9.613  -1.963 -28.058
   85    H    GLN  11           H        GLN  11  -9.969  -1.933 -22.844
   86    HA   GLN  11           HA       GLN  11 -11.464  -4.185 -22.103
   87    HB2  GLN  11           2HB      GLN  11 -10.630  -3.895 -19.926
   88    HB3  GLN  11           3HB      GLN  11  -9.370  -3.407 -21.043
   89    HG2  GLN  11           2HG      GLN  11 -11.160  -1.565 -19.387
   90    HG3  GLN  11           3HG      GLN  11  -9.475  -1.944 -19.072
   91   HE21  GLN  11          2HE2      GLN  11 -11.088   0.651 -19.843
   92   HE22  GLN  11          1HE2      GLN  11 -10.012   1.346 -21.058
   93    H    ASN  12           H        ASN  12 -12.513  -0.840 -22.086
   94    HA   ASN  12           HA       ASN  12 -14.593  -1.128 -20.084
   95    HB2  ASN  12           2HB      ASN  12 -13.964   0.936 -22.248
   96    HB3  ASN  12           3HB      ASN  12 -15.431   1.018 -21.278
   97   HD21  ASN  12          2HD2      ASN  12 -14.294   3.186 -20.828
   98   HD22  ASN  12          1HD2      ASN  12 -13.272   3.184 -19.397
   99    H    THR  13           H        THR  13 -14.670  -1.117 -23.671
  100    HA   THR  13           HA       THR  13 -17.489  -1.832 -23.790
  101    HB   THR  13           HB       THR  13 -16.111  -0.488 -25.449
  102    HG1  THR  13           HG1      THR  13 -17.453  -1.185 -27.119
  103   HG21  THR  13          1HG2      THR  13 -15.474  -3.219 -26.605
  104   HG22  THR  13          2HG2      THR  13 -15.051  -1.622 -27.278
  105   HG23  THR  13          3HG2      THR  13 -14.325  -2.175 -25.755
  106    H    PHE  14           H        PHE  14 -14.408  -3.622 -24.063
  107    HA   PHE  14           HA       PHE  14 -15.444  -6.179 -24.740
  108    HB2  PHE  14           2HB      PHE  14 -13.072  -5.493 -24.688
  109    HB3  PHE  14           3HB      PHE  14 -13.131  -5.377 -22.940
  110    HD1  PHE  14           HD2      PHE  14 -13.230  -7.734 -25.818
  111    HD2  PHE  14           HD1      PHE  14 -13.012  -7.358 -21.525
  112    HE1  PHE  14           HE2      PHE  14 -12.641 -10.142 -25.635
  113    HE2  PHE  14           HE1      PHE  14 -12.425  -9.766 -21.346
  114    HZ   PHE  14           HZ       PHE  14 -12.240 -11.160 -23.400
  115    H    LEU  15           H        LEU  15 -15.086  -4.550 -21.582
  116    HA   LEU  15           HA       LEU  15 -16.337  -6.710 -20.088
  117    HB2  LEU  15           2HB      LEU  15 -14.829  -5.226 -18.941
  118    HB3  LEU  15           3HB      LEU  15 -15.800  -3.813 -19.374
  119    HG   LEU  15           HG       LEU  15 -17.643  -4.566 -17.987
  120   HD11  LEU  15          1HD1      LEU  15 -17.440  -6.493 -16.449
  121   HD12  LEU  15          2HD1      LEU  15 -17.411  -7.024 -18.120
  122   HD13  LEU  15          3HD1      LEU  15 -15.892  -6.948 -17.218
  123   HD21  LEU  15          3HD2      LEU  15 -14.998  -4.673 -16.486
  124   HD22  LEU  15          1HD2      LEU  15 -15.866  -3.200 -16.971
  125   HD23  LEU  15          2HD2      LEU  15 -16.590  -4.300 -15.786
  126    H    ASP  16           H        ASP  16 -17.645  -3.566 -21.304
  127    HA   ASP  16           HA       ASP  16 -20.290  -3.711 -20.519
  128    HB2  ASP  16           2HB      ASP  16 -19.204  -1.908 -21.844
  129    HB3  ASP  16           3HB      ASP  16 -19.325  -2.918 -23.279
  130    H    THR  17           H        THR  17 -18.823  -5.509 -23.173
  131    HA   THR  17           HA       THR  17 -21.245  -6.797 -24.137
  132    HB   THR  17           HB       THR  17 -18.376  -7.810 -24.271
  133    HG1  THR  17           HG1      THR  17 -18.613  -5.826 -25.288
  134   HG21  THR  17          1HG2      THR  17 -20.849  -8.558 -25.889
  135   HG22  THR  17          2HG2      THR  17 -19.183  -9.045 -26.276
  136   HG23  THR  17          3HG2      THR  17 -19.943  -9.620 -24.786
  137    H    ILE  18           H        ILE  18 -18.915  -7.713 -21.603
  138    HA   ILE  18           HA       ILE  18 -20.213 -10.242 -20.962
  139    HB   ILE  18           HB       ILE  18 -18.386  -8.549 -19.243
  140   HG12  ILE  18          2HG1      ILE  18 -17.195  -9.017 -21.300
  141   HG13  ILE  18          3HG1      ILE  18 -16.486  -9.810 -19.921
  142   HG21  ILE  18          1HG2      ILE  18 -19.144 -11.486 -19.074
  143   HG22  ILE  18          2HG2      ILE  18 -17.807 -10.747 -18.160
  144   HG23  ILE  18          3HG2      ILE  18 -19.458 -10.204 -17.891
  145   HD11  ILE  18          3HD1      ILE  18 -17.476 -11.980 -20.677
  146   HD12  ILE  18          1HD1      ILE  18 -18.276 -11.138 -22.029
  147   HD13  ILE  18          2HD1      ILE  18 -16.507 -11.239 -21.962
  148    H    ILE  19           H        ILE  19 -20.435  -6.856 -19.777
  149    HA   ILE  19           HA       ILE  19 -22.235  -7.336 -17.675
  150    HB   ILE  19           HB       ILE  19 -22.305  -4.953 -19.573
  151   HG12  ILE  19          2HG1      ILE  19 -20.121  -4.883 -18.634
  152   HG13  ILE  19          3HG1      ILE  19 -21.079  -3.711 -17.768
  153   HG21  ILE  19          1HG2      ILE  19 -24.365  -5.092 -18.324
  154   HG22  ILE  19          2HG2      ILE  19 -23.487  -5.361 -16.807
  155   HG23  ILE  19          3HG2      ILE  19 -23.391  -3.792 -17.641
  156   HD11  ILE  19          3HD1      ILE  19 -21.341  -5.415 -15.909
  157   HD12  ILE  19          1HD1      ILE  19 -20.209  -6.459 -16.811
  158   HD13  ILE  19          2HD1      ILE  19 -19.663  -4.881 -16.225
  159    H    ARG  20           H        ARG  20 -22.987  -6.652 -21.140
  160    HA   ARG  20           HA       ARG  20 -25.824  -7.150 -20.931
  161    HB2  ARG  20           2HB      ARG  20 -23.843  -7.191 -23.212
  162    HB3  ARG  20           3HB      ARG  20 -25.540  -7.637 -23.454
  163    HG2  ARG  20           2HG      ARG  20 -26.341  -5.518 -22.639
  164    HG3  ARG  20           3HG      ARG  20 -24.717  -5.005 -22.145
  165    HD2  ARG  20           2HD      ARG  20 -25.483  -5.697 -25.003
  166    HD3  ARG  20           3HD      ARG  20 -25.549  -4.059 -24.328
  167    HE   ARG  20           HE       ARG  20 -23.060  -4.509 -23.703
  168   HH11  ARG  20          1HH2      ARG  20 -24.338  -5.887 -26.672
  169   HH12  ARG  20          2HH2      ARG  20 -22.843  -5.596 -27.521
  170   HH21  ARG  20          1HH1      ARG  20 -21.450  -3.852 -24.906
  171   HH22  ARG  20          2HH1      ARG  20 -21.125  -4.606 -26.465
  172    H    LYS  21           H        LYS  21 -23.128  -9.368 -21.285
  173    HA   LYS  21           HA       LYS  21 -24.657 -11.747 -21.829
  174    HB2  LYS  21           2HB      LYS  21 -22.082 -11.235 -21.814
  175    HB3  LYS  21           3HB      LYS  21 -22.200 -11.855 -20.144
  176    HG2  LYS  21           2HG      LYS  21 -23.040 -13.976 -20.918
  177    HG3  LYS  21           3HG      LYS  21 -23.229 -13.367 -22.588
  178    HD2  LYS  21           2HD      LYS  21 -20.852 -13.003 -22.809
  179    HD3  LYS  21           3HD      LYS  21 -20.603 -13.358 -21.092
  180    HE2  LYS  21           2HE      LYS  21 -21.377 -15.707 -21.473
  181    HE3  LYS  21           3HE      LYS  21 -21.641 -15.342 -23.183
  182    HZ1  LYS  21           HZ1      LYS  21 -19.004 -15.260 -21.811
  183    HZ2  LYS  21           HZ2      LYS  21 -19.501 -16.430 -22.831
  184    HZ3  LYS  21           HZ3      LYS  21 -19.247 -14.921 -23.394
  185    H    PHE  22           H        PHE  22 -23.729 -10.276 -18.673
  186    HA   PHE  22           HA       PHE  22 -25.567 -12.218 -17.357
  187    HB2  PHE  22           2HB      PHE  22 -24.431 -11.958 -15.337
  188    HB3  PHE  22           3HB      PHE  22 -23.268 -12.261 -16.599
  189    HD1  PHE  22           HD2      PHE  22 -24.704  -9.532 -14.428
  190    HD2  PHE  22           HD1      PHE  22 -21.382 -10.855 -16.828
  191    HE1  PHE  22           HE2      PHE  22 -23.351  -7.640 -13.589
  192    HE2  PHE  22           HE1      PHE  22 -20.012  -8.968 -15.959
  193    HZ   PHE  22           HZ       PHE  22 -20.996  -7.361 -14.338
  194    H    GLU  23           H        GLU  23 -25.935  -9.184 -18.467
  195    HA   GLU  23           HA       GLU  23 -26.703  -7.491 -16.566
  196    HB2  GLU  23           2HB      GLU  23 -26.488  -6.928 -18.934
  197    HB3  GLU  23           3HB      GLU  23 -27.943  -7.832 -19.324
  198    HG2  GLU  23           2HG      GLU  23 -29.330  -6.191 -18.209
  199    HG3  GLU  23           3HG      GLU  23 -27.912  -5.415 -17.483
  200    H    GLY  24           H        GLY  24 -28.811 -10.147 -17.573
  201    HA2  GLY  24           HA2      GLY  24 -30.743 -10.982 -16.594
  202    HA3  GLY  24           HA3      GLY  24 -30.541  -9.816 -15.282
  203    H    GLN  25           H        GLN  25 -31.286  -9.651 -18.790
  204    HA   GLN  25           HA       GLN  25 -32.728  -7.217 -18.620
  205    HB2  GLN  25           2HB      GLN  25 -32.601  -9.330 -20.802
  206    HB3  GLN  25           3HB      GLN  25 -33.363  -7.744 -21.000
  207    HG2  GLN  25           2HG      GLN  25 -31.229  -6.623 -20.434
  208    HG3  GLN  25           3HG      GLN  25 -30.426  -8.187 -20.303
  209   HE21  GLN  25          2HE2      GLN  25 -29.371  -6.350 -22.018
  210   HE22  GLN  25          1HE2      GLN  25 -29.684  -6.859 -23.689
  211    H    SER  26           H        SER  26 -33.937 -10.202 -17.599
  212    HA   SER  26           HA       SER  26 -36.774  -9.751 -18.142
  213    HB2  SER  26           2HB      SER  26 -37.063 -11.541 -16.442
  214    HB3  SER  26           3HB      SER  26 -35.957 -11.997 -17.751
  215    HG   SER  26           HG       SER  26 -35.091 -12.552 -15.711
  216    H    ARG  27           H        ARG  27 -34.464  -8.481 -15.894
  217    HA   ARG  27           HA       ARG  27 -36.431  -7.561 -13.903
  218    HB2  ARG  27           2HB      ARG  27 -33.461  -6.948 -14.164
  219    HB3  ARG  27           3HB      ARG  27 -34.464  -6.631 -12.768
  220    HG2  ARG  27           2HG      ARG  27 -33.654  -9.362 -13.844
  221    HG3  ARG  27           3HG      ARG  27 -33.086  -8.596 -12.373
  222    HD2  ARG  27           2HD      ARG  27 -35.310  -8.842 -11.347
  223    HD3  ARG  27           3HD      ARG  27 -35.973  -9.440 -12.866
  224    HE   ARG  27           HE       ARG  27 -34.935 -11.493 -12.599
  225   HH11  ARG  27          2HH1      ARG  27 -33.898  -9.454  -9.883
  226   HH12  ARG  27          1HH1      ARG  27 -33.278 -10.842  -9.031
  227   HH21  ARG  27          1HH2      ARG  27 -34.131 -13.156 -11.409
  228   HH22  ARG  27          2HH2      ARG  27 -33.411 -12.857  -9.856
  229    H    LYS  28           H        LYS  28 -36.697  -5.317 -13.362
  230    HA   LYS  28           HA       LYS  28 -37.002  -3.657 -15.839
  231    HB2  LYS  28           2HB      LYS  28 -38.786  -3.639 -13.374
  232    HB3  LYS  28           3HB      LYS  28 -39.053  -2.834 -14.889
  233    HG2  LYS  28           2HG      LYS  28 -40.383  -4.617 -15.298
  234    HG3  LYS  28           3HG      LYS  28 -38.901  -5.353 -15.871
  235    HD2  LYS  28           2HD      LYS  28 -38.721  -6.612 -13.756
  236    HD3  LYS  28           3HD      LYS  28 -39.999  -5.623 -13.032
  237    HE2  LYS  28           2HE      LYS  28 -41.013  -7.678 -13.627
  238    HE3  LYS  28           3HE      LYS  28 -41.613  -6.465 -14.741
  239    HZ1  LYS  28           HZ1      LYS  28 -39.380  -8.323 -15.431
  240    HZ2  LYS  28           HZ2      LYS  28 -40.944  -8.583 -15.839
  241    HZ3  LYS  28           HZ3      LYS  28 -40.142  -7.302 -16.448
  242    H    PHE  29           H        PHE  29 -36.828  -1.333 -15.709
  243    HA   PHE  29           HA       PHE  29 -35.783  -0.066 -13.331
  244    HB2  PHE  29           2HB      PHE  29 -33.439   0.170 -13.991
  245    HB3  PHE  29           3HB      PHE  29 -33.846  -1.502 -13.767
  246    HD1  PHE  29           HD1      PHE  29 -34.034  -3.079 -15.688
  247    HD2  PHE  29           HD2      PHE  29 -32.616   0.973 -16.127
  248    HE1  PHE  29           HE1      PHE  29 -32.921  -3.702 -17.810
  249    HE2  PHE  29           HE2      PHE  29 -31.478   0.330 -18.248
  250    HZ   PHE  29           HZ       PHE  29 -31.617  -2.005 -19.079
  251    H    ILE  30           H        ILE  30 -34.847   2.011 -13.573
  252    HA   ILE  30           HA       ILE  30 -35.562   3.469 -16.071
  253    HB   ILE  30           HB       ILE  30 -35.950   5.470 -14.510
  254   HG12  ILE  30          2HG1      ILE  30 -36.826   5.098 -12.311
  255   HG13  ILE  30          3HG1      ILE  30 -36.559   3.357 -12.411
  256   HG21  ILE  30          1HG2      ILE  30 -38.302   4.910 -14.336
  257   HG22  ILE  30          2HG2      ILE  30 -37.599   4.350 -15.869
  258   HG23  ILE  30          3HG2      ILE  30 -37.929   3.182 -14.569
  259   HD11  ILE  30          3HD1      ILE  30 -34.869   4.595 -11.026
  260   HD12  ILE  30          1HD1      ILE  30 -34.143   3.663 -12.330
  261   HD13  ILE  30          2HD1      ILE  30 -34.319   5.430 -12.485
  262    H    ILE  31           H        ILE  31 -34.421   5.624 -16.151
  263    HA   ILE  31           HA       ILE  31 -31.667   5.502 -15.029
  264    HB   ILE  31           HB       ILE  31 -32.330   6.613 -17.761
  265   HG12  ILE  31          2HG1      ILE  31 -32.898   4.177 -17.829
  266   HG13  ILE  31          3HG1      ILE  31 -31.573   4.650 -18.900
  267   HG21  ILE  31          1HG2      ILE  31 -30.311   7.458 -16.719
  268   HG22  ILE  31          2HG2      ILE  31 -29.741   5.825 -16.368
  269   HG23  ILE  31          3HG2      ILE  31 -29.857   6.389 -18.055
  270   HD11  ILE  31          3HD1      ILE  31 -31.030   3.563 -16.139
  271   HD12  ILE  31          1HD1      ILE  31 -31.211   2.514 -17.573
  272   HD13  ILE  31          2HD1      ILE  31 -29.911   3.720 -17.503
  273    H    ALA  32           H        ALA  32 -31.477   7.120 -13.723
  274    HA   ALA  32           HA       ALA  32 -32.673   9.755 -14.491
  275    HB1  ALA  32           3HB      ALA  32 -32.811   8.407 -11.784
  276    HB2  ALA  32           1HB      ALA  32 -33.130  10.129 -12.026
  277    HB3  ALA  32           2HB      ALA  32 -34.144   8.902 -12.824
  278    H    ASN  33           H        ASN  33 -31.742  11.676 -13.817
  279    HA   ASN  33           HA       ASN  33 -28.804  11.450 -13.419
  280    HB2  ASN  33           2HB      ASN  33 -28.804  13.925 -13.696
  281    HB3  ASN  33           3HB      ASN  33 -29.296  13.005 -15.096
  282   HD21  ASN  33          2HD2      ASN  33 -29.845  15.459 -15.448
  283   HD22  ASN  33          1HD2      ASN  33 -31.546  15.792 -15.161
  284    H    ALA  34           H        ALA  34 -28.216  10.966 -11.415
  285    HA   ALA  34           HA       ALA  34 -29.678  11.771  -9.076
  286    HB1  ALA  34           3HB      ALA  34 -26.882  10.589  -9.346
  287    HB2  ALA  34           1HB      ALA  34 -27.877  10.607  -7.881
  288    HB3  ALA  34           2HB      ALA  34 -28.395   9.653  -9.277
  289    H    ARG  35           H        ARG  35 -27.532  13.575 -10.923
  290    HA   ARG  35           HA       ARG  35 -26.509  15.193  -8.643
  291    HB2  ARG  35           2HB      ARG  35 -25.850  15.526 -11.584
  292    HB3  ARG  35           3HB      ARG  35 -24.992  16.186 -10.201
  293    HG2  ARG  35           2HG      ARG  35 -25.030  13.342 -11.221
  294    HG3  ARG  35           3HG      ARG  35 -23.665  14.419 -11.011
  295    HD2  ARG  35           2HD      ARG  35 -25.204  12.900  -8.887
  296    HD3  ARG  35           3HD      ARG  35 -23.507  12.725  -9.350
  297    HE   ARG  35           HE       ARG  35 -23.688  15.333  -8.431
  298   HH11  ARG  35          1HH2      ARG  35 -24.237  12.144  -7.049
  299   HH12  ARG  35          2HH2      ARG  35 -23.915  12.704  -5.426
  300   HH21  ARG  35          1HH1      ARG  35 -23.275  15.959  -6.328
  301   HH22  ARG  35          2HH1      ARG  35 -23.353  14.795  -5.040
  302    H    VAL  36           H        VAL  36 -29.275  15.301 -10.468
  303    HA   VAL  36           HA       VAL  36 -29.411  18.274 -10.539
  304    HB   VAL  36           HB       VAL  36 -29.977  16.683 -12.552
  305   HG11  VAL  36          1HG1      VAL  36 -32.347  16.243 -12.850
  306   HG12  VAL  36          2HG1      VAL  36 -31.746  15.362 -11.430
  307   HG13  VAL  36          3HG1      VAL  36 -32.717  16.844 -11.245
  308   HG21  VAL  36          3HG2      VAL  36 -30.073  19.111 -12.612
  309   HG22  VAL  36          1HG2      VAL  36 -31.395  18.358 -13.508
  310   HG23  VAL  36          2HG2      VAL  36 -31.713  19.078 -11.907
  311    H    GLU  37           H        GLU  37 -30.922  19.423  -9.329
  312    HA   GLU  37           HA       GLU  37 -31.631  18.415  -6.818
  313    HB2  GLU  37           2HB      GLU  37 -31.383  20.798  -7.509
  314    HB3  GLU  37           3HB      GLU  37 -32.945  20.709  -8.332
  315    HG2  GLU  37           2HG      GLU  37 -34.073  20.276  -6.183
  316    HG3  GLU  37           3HG      GLU  37 -32.516  20.211  -5.352
  317    H    ASN  38           H        ASN  38 -33.589  18.301  -9.769
  318    HA   ASN  38           HA       ASN  38 -35.989  17.358  -8.391
  319    HB2  ASN  38           2HB      ASN  38 -35.885  18.866 -10.456
  320    HB3  ASN  38           3HB      ASN  38 -35.405  17.439 -11.376
  321   HD21  ASN  38          2HD2      ASN  38 -37.293  17.394 -12.682
  322   HD22  ASN  38          1HD2      ASN  38 -38.881  17.091 -11.999
  323    H    CYS  39           H        CYS  39 -33.155  15.719  -9.272
  324    HA   CYS  39           HA       CYS  39 -32.583  13.589  -9.875
  325    HB2  CYS  39           2HB      CYS  39 -34.742  13.066  -7.799
  326    HB3  CYS  39           3HB      CYS  39 -33.523  11.890  -8.313
  327    HG   CYS  39           HG       CYS  39 -32.934  14.934  -7.119
  328    H    ALA  40           H        ALA  40 -33.865  14.318 -12.061
  329    HA   ALA  40           HA       ALA  40 -36.339  12.826 -12.402
  330    HB1  ALA  40           3HB      ALA  40 -36.651  14.143 -14.398
  331    HB2  ALA  40           1HB      ALA  40 -36.190  15.178 -13.046
  332    HB3  ALA  40           2HB      ALA  40 -34.985  14.765 -14.293
  333    H    VAL  41           H        VAL  41 -36.931  11.542 -14.109
  334    HA   VAL  41           HA       VAL  41 -35.075   9.458 -14.858
  335    HB   VAL  41           HB       VAL  41 -38.033   9.882 -15.434
  336   HG11  VAL  41          1HG1      VAL  41 -37.083   8.284 -17.062
  337   HG12  VAL  41          2HG1      VAL  41 -36.299   7.396 -15.741
  338   HG13  VAL  41          3HG1      VAL  41 -38.071   7.429 -15.879
  339   HG21  VAL  41          3HG2      VAL  41 -36.657   8.126 -13.353
  340   HG22  VAL  41          1HG2      VAL  41 -37.559   9.618 -13.018
  341   HG23  VAL  41          2HG2      VAL  41 -38.407   8.223 -13.669
  342    H    ILE  42           H        ILE  42 -33.624  10.403 -16.232
  343    HA   ILE  42           HA       ILE  42 -34.323  11.899 -18.615
  344    HB   ILE  42           HB       ILE  42 -31.939  11.627 -19.184
  345   HG12  ILE  42          2HG1      ILE  42 -31.717   9.949 -16.639
  346   HG13  ILE  42          3HG1      ILE  42 -31.616   9.309 -18.282
  347   HG21  ILE  42          1HG2      ILE  42 -32.778  13.406 -17.612
  348   HG22  ILE  42          2HG2      ILE  42 -32.305  12.371 -16.248
  349   HG23  ILE  42          3HG2      ILE  42 -31.080  12.990 -17.374
  350   HD11  ILE  42          3HD1      ILE  42 -29.671  11.201 -16.942
  351   HD12  ILE  42          1HD1      ILE  42 -29.420   9.513 -17.418
  352   HD13  ILE  42          2HD1      ILE  42 -29.622  10.752 -18.674
  353    H    TYR  43           H        TYR  43 -34.087   8.510 -17.876
  354    HA   TYR  43           HA       TYR  43 -35.242   7.835 -20.473
  355    HB2  TYR  43           2HB      TYR  43 -32.657   7.861 -20.834
  356    HB3  TYR  43           3HB      TYR  43 -32.638   6.419 -19.872
  357    HD1  TYR  43           HD1      TYR  43 -34.049   7.921 -22.974
  358    HD2  TYR  43           HD2      TYR  43 -33.207   4.281 -20.808
  359    HE1  TYR  43           HE1      TYR  43 -34.632   6.575 -24.994
  360    HE2  TYR  43           HE2      TYR  43 -33.779   2.948 -22.825
  361    HH   TYR  43           HH       TYR  43 -34.451   2.994 -25.009
  362    H    CYS  44           H        CYS  44 -35.953   5.522 -20.638
  363    HA   CYS  44           HA       CYS  44 -35.949   4.115 -18.063
  364    HB2  CYS  44           2HB      CYS  44 -38.402   3.761 -18.102
  365    HB3  CYS  44           3HB      CYS  44 -37.973   5.473 -17.921
  366    HG   CYS  44           HG       CYS  44 -40.084   5.202 -19.459
  367    H    ASN  45           H        ASN  45 -36.421   1.862 -18.149
  368    HA   ASN  45           HA       ASN  45 -35.802   0.706 -20.794
  369    HB2  ASN  45           2HB      ASN  45 -34.659   0.008 -18.640
  370    HB3  ASN  45           3HB      ASN  45 -36.153  -0.822 -18.197
  371   HD21  ASN  45          2HD2      ASN  45 -33.588  -0.613 -20.727
  372   HD22  ASN  45          1HD2      ASN  45 -33.833  -2.258 -21.289
  373    H    ASP  46           H        ASP  46 -36.970  -1.046 -21.704
  374    HA   ASP  46           HA       ASP  46 -39.823  -0.700 -21.794
  375    HB2  ASP  46           2HB      ASP  46 -38.140  -1.763 -23.517
  376    HB3  ASP  46           3HB      ASP  46 -38.417  -3.253 -22.617
  377    H    GLY  47           H        GLY  47 -37.713  -2.726 -19.798
  378    HA2  GLY  47           HA2      GLY  47 -39.536  -4.457 -18.551
  379    HA3  GLY  47           HA3      GLY  47 -38.134  -3.709 -17.774
  380    H    PHE  48           H        PHE  48 -38.791  -1.025 -17.505
  381    HA   PHE  48           HA       PHE  48 -40.728  -0.891 -15.427
  382    HB2  PHE  48           2HB      PHE  48 -39.678   1.098 -15.266
  383    HB3  PHE  48           3HB      PHE  48 -39.076   1.018 -16.911
  384    HD1  PHE  48           HD1      PHE  48 -41.918   2.147 -14.795
  385    HD2  PHE  48           HD2      PHE  48 -40.234   2.163 -18.766
  386    HE1  PHE  48           HE1      PHE  48 -43.802   3.540 -15.596
  387    HE2  PHE  48           HE2      PHE  48 -42.129   3.530 -19.563
  388    HZ   PHE  48           HZ       PHE  48 -43.933   4.207 -17.991
  389    H    CYS  49           H        CYS  49 -41.065  -0.555 -18.933
  390    HA   CYS  49           HA       CYS  49 -43.752   0.492 -18.928
  391    HB2  CYS  49           2HB      CYS  49 -41.991   0.549 -20.823
  392    HB3  CYS  49           3HB      CYS  49 -42.572  -1.082 -21.229
  393    HG   CYS  49           HG       CYS  49 -45.136  -0.391 -21.347
  394    H    GLU  50           H        GLU  50 -42.429  -2.828 -19.007
  395    HA   GLU  50           HA       GLU  50 -45.071  -4.103 -19.176
  396    HB2  GLU  50           2HB      GLU  50 -42.372  -5.253 -18.355
  397    HB3  GLU  50           3HB      GLU  50 -43.834  -6.172 -18.727
  398    HG2  GLU  50           2HG      GLU  50 -43.814  -5.180 -21.043
  399    HG3  GLU  50           3HG      GLU  50 -42.251  -4.451 -20.672
  400    H    LEU  51           H        LEU  51 -42.930  -3.075 -16.580
  401    HA   LEU  51           HA       LEU  51 -44.158  -4.452 -14.399
  402    HB2  LEU  51           2HB      LEU  51 -41.943  -3.473 -14.392
  403    HB3  LEU  51           3HB      LEU  51 -42.580  -1.870 -14.635
  404    HG   LEU  51           HG       LEU  51 -43.738  -1.953 -12.434
  405   HD11  LEU  51          1HD1      LEU  51 -42.000  -4.420 -12.014
  406   HD12  LEU  51          2HD1      LEU  51 -42.937  -3.563 -10.770
  407   HD13  LEU  51          3HD1      LEU  51 -43.781  -4.394 -12.086
  408   HD21  LEU  51          3HD2      LEU  51 -41.644  -0.750 -12.741
  409   HD22  LEU  51          1HD2      LEU  51 -41.675  -1.525 -11.151
  410   HD23  LEU  51          2HD2      LEU  51 -40.715  -2.243 -12.465
  411    H    CYS  52           H        CYS  52 -44.540  -1.056 -15.492
  412    HA   CYS  52           HA       CYS  52 -46.863  -0.701 -13.703
  413    HB2  CYS  52           2HB      CYS  52 -45.470   1.336 -15.486
  414    HB3  CYS  52           3HB      CYS  52 -46.558   1.639 -14.114
  415    HG   CYS  52           HG       CYS  52 -43.540   0.307 -14.176
  416    H    GLY  53           H        GLY  53 -46.317  -1.286 -17.103
  417    HA2  GLY  53           HA2      GLY  53 -47.848  -1.696 -18.780
  418    HA3  GLY  53           HA3      GLY  53 -49.148  -1.548 -17.606
  419    H    TYR  54           H        TYR  54 -47.193   1.319 -17.804
  420    HA   TYR  54           HA       TYR  54 -49.347   2.724 -19.290
  421    HB2  TYR  54           2HB      TYR  54 -47.097   3.771 -17.556
  422    HB3  TYR  54           3HB      TYR  54 -48.218   4.781 -18.458
  423    HD1  TYR  54           HD1      TYR  54 -50.666   4.808 -17.937
  424    HD2  TYR  54           HD2      TYR  54 -47.767   2.827 -15.444
  425    HE1  TYR  54           HE1      TYR  54 -52.283   4.818 -16.037
  426    HE2  TYR  54           HE2      TYR  54 -49.384   2.819 -13.549
  427    HH   TYR  54           HH       TYR  54 -51.467   3.436 -12.835
  428    H    SER  55           H        SER  55 -46.493   4.474 -19.560
  429    HA   SER  55           HA       SER  55 -45.439   3.340 -22.023
  430    HB2  SER  55           2HB      SER  55 -47.466   4.405 -22.912
  431    HB3  SER  55           3HB      SER  55 -47.042   5.928 -22.115
  432    HG   SER  55           HG       SER  55 -46.426   5.777 -24.378
  433    H    ARG  56           H        ARG  56 -43.549   4.409 -22.681
  434    HA   ARG  56           HA       ARG  56 -41.834   5.512 -20.638
  435    HB2  ARG  56           2HB      ARG  56 -41.554   5.743 -23.676
  436    HB3  ARG  56           3HB      ARG  56 -40.270   5.908 -22.482
  437    HG2  ARG  56           2HG      ARG  56 -40.743   3.461 -21.815
  438    HG3  ARG  56           3HG      ARG  56 -41.806   3.383 -23.230
  439    HD2  ARG  56           2HD      ARG  56 -39.814   4.199 -24.612
  440    HD3  ARG  56           3HD      ARG  56 -38.813   3.903 -23.176
  441    HE   ARG  56           HE       ARG  56 -40.351   1.554 -23.751
  442   HH11  ARG  56          1HH1      ARG  56 -37.630   3.290 -25.117
  443   HH12  ARG  56          2HH1      ARG  56 -37.090   1.905 -26.024
  444   HH21  ARG  56          1HH2      ARG  56 -39.597  -0.184 -24.899
  445   HH22  ARG  56          2HH2      ARG  56 -38.173  -0.003 -25.898
  446    H    ALA  57           H        ALA  57 -43.802   7.126 -23.106
  447    HA   ALA  57           HA       ALA  57 -42.880   9.791 -22.662
  448    HB1  ALA  57           3HB      ALA  57 -44.153   9.048 -24.643
  449    HB2  ALA  57           1HB      ALA  57 -45.586   8.761 -23.625
  450    HB3  ALA  57           2HB      ALA  57 -44.958  10.409 -23.839
  451    H    GLU  58           H        GLU  58 -44.926   7.782 -20.659
  452    HA   GLU  58           HA       GLU  58 -46.128  10.002 -19.162
  453    HB2  GLU  58           2HB      GLU  58 -46.137   7.021 -18.572
  454    HB3  GLU  58           3HB      GLU  58 -47.134   8.240 -17.818
  455    HG2  GLU  58           2HG      GLU  58 -47.272   7.680 -20.814
  456    HG3  GLU  58           3HG      GLU  58 -48.207   6.791 -19.647
  457    H    VAL  59           H        VAL  59 -43.159   8.172 -19.059
  458    HA   VAL  59           HA       VAL  59 -42.603   9.142 -16.285
  459    HB   VAL  59           HB       VAL  59 -40.744   7.491 -16.261
  460   HG11  VAL  59          1HG1      VAL  59 -43.538   6.327 -16.548
  461   HG12  VAL  59          2HG1      VAL  59 -42.177   5.673 -15.601
  462   HG13  VAL  59          3HG1      VAL  59 -42.939   7.188 -15.113
  463   HG21  VAL  59          3HG2      VAL  59 -42.147   6.225 -18.600
  464   HG22  VAL  59          1HG2      VAL  59 -40.563   7.049 -18.670
  465   HG23  VAL  59          2HG2      VAL  59 -40.768   5.590 -17.678
  466    H    MET  60           H        MET  60 -41.584   9.658 -19.590
  467    HA   MET  60           HA       MET  60 -38.994  10.504 -19.360
  468    HB2  MET  60           2HB      MET  60 -41.291  11.719 -20.946
  469    HB3  MET  60           3HB      MET  60 -39.654  12.344 -21.055
  470    HG2  MET  60           2HG      MET  60 -40.520   9.560 -21.826
  471    HG3  MET  60           3HG      MET  60 -40.133  10.884 -22.892
  472    HE1  MET  60           3HE      MET  60 -38.543   8.467 -20.103
  473    HE2  MET  60           1HE      MET  60 -39.027   7.699 -21.628
  474    HE3  MET  60           2HE      MET  60 -37.312   7.800 -21.199
  475    H    GLN  61           H        GLN  61 -38.096  11.604 -17.858
  476    HA   GLN  61           HA       GLN  61 -37.331  13.321 -16.703
  477    HB2  GLN  61           2HB      GLN  61 -39.146  15.097 -18.336
  478    HB3  GLN  61           3HB      GLN  61 -37.660  15.564 -17.525
  479    HG2  GLN  61           2HG      GLN  61 -36.300  14.694 -19.176
  480    HG3  GLN  61           3HG      GLN  61 -37.328  13.313 -19.493
  481   HE21  GLN  61          2HE2      GLN  61 -37.515  13.357 -21.681
  482   HE22  GLN  61          1HE2      GLN  61 -38.358  14.642 -22.517
  483    H    ARG  62           H        ARG  62 -39.944  11.915 -15.795
  484    HA   ARG  62           HA       ARG  62 -40.934  13.841 -13.795
  485    HB2  ARG  62           2HB      ARG  62 -41.405  10.899 -14.457
  486    HB3  ARG  62           3HB      ARG  62 -41.767  11.476 -12.848
  487    HG2  ARG  62           2HG      ARG  62 -43.774  11.645 -13.831
  488    HG3  ARG  62           3HG      ARG  62 -43.188  13.306 -13.917
  489    HD2  ARG  62           2HD      ARG  62 -43.041  11.312 -16.204
  490    HD3  ARG  62           3HD      ARG  62 -44.449  12.331 -15.940
  491    HE   ARG  62           HE       ARG  62 -41.977  13.065 -17.197
  492   HH11  ARG  62          1HH1      ARG  62 -44.547  14.579 -15.345
  493   HH12  ARG  62          2HH1      ARG  62 -44.227  16.135 -16.064
  494   HH21  ARG  62          1HH2      ARG  62 -41.672  14.945 -18.064
  495   HH22  ARG  62          2HH2      ARG  62 -42.601  16.352 -17.582
  496    HA   PRO  63           HA       PRO  63 -37.925  12.949 -10.603
  497    HB2  PRO  63           2HB      PRO  63 -40.221  12.312  -8.760
  498    HB3  PRO  63           3HB      PRO  63 -38.825  13.400  -8.495
  499    HG2  PRO  63           2HG      PRO  63 -41.264  14.425  -9.089
  500    HG3  PRO  63           3HG      PRO  63 -39.796  15.098  -9.870
  501    HD2  PRO  63           2HD      PRO  63 -41.756  13.078 -10.999
  502    HD3  PRO  63           3HD      PRO  63 -41.080  14.549 -11.765
  503    H    CYS  64           H        CYS  64 -36.765  11.138 -10.026
  504    HA   CYS  64           HA       CYS  64 -37.674   8.451 -10.546
  505    HB2  CYS  64           2HB      CYS  64 -35.325   9.328 -10.670
  506    HB3  CYS  64           3HB      CYS  64 -35.309   9.455  -8.907
  507    HG   CYS  64           HG       CYS  64 -36.066   6.843  -8.622
  508    H    THR  65           H        THR  65 -38.193  10.526  -7.828
  509    HA   THR  65           HA       THR  65 -38.479   8.704  -5.716
  510    HB   THR  65           HB       THR  65 -40.179  11.200  -5.939
  511    HG1  THR  65           HG1      THR  65 -38.427  12.373  -5.217
  512   HG21  THR  65          1HG2      THR  65 -39.636  11.286  -3.517
  513   HG22  THR  65          2HG2      THR  65 -40.383   9.734  -3.937
  514   HG23  THR  65          3HG2      THR  65 -38.631   9.823  -3.701
  515    H    CYS  66           H        CYS  66 -39.557   6.962  -6.208
  516    HA   CYS  66           HA       CYS  66 -41.865   6.472  -7.593
  517    HB2  CYS  66           2HB      CYS  66 -42.069   4.405  -6.292
  518    HB3  CYS  66           3HB      CYS  66 -40.359   4.752  -6.614
  519    HG   CYS  66           HG       CYS  66 -40.601   3.816  -4.172
  520    H    ASP  67           H        ASP  67 -41.889   8.147  -4.587
  521    HA   ASP  67           HA       ASP  67 -44.535   7.892  -3.620
  522    HB2  ASP  67           2HB      ASP  67 -42.734   9.246  -2.580
  523    HB3  ASP  67           3HB      ASP  67 -42.791  10.372  -3.931
  524    H    PHE  68           H        PHE  68 -43.279   9.778  -6.374
  525    HA   PHE  68           HA       PHE  68 -45.568  11.221  -7.142
  526    HB2  PHE  68           2HB      PHE  68 -43.094  11.345  -7.873
  527    HB3  PHE  68           3HB      PHE  68 -43.457  10.045  -8.994
  528    HD1  PHE  68           HD1      PHE  68 -45.022  10.485 -10.932
  529    HD2  PHE  68           HD2      PHE  68 -43.791  13.603  -8.222
  530    HE1  PHE  68           HE1      PHE  68 -45.796  12.202 -12.553
  531    HE2  PHE  68           HE2      PHE  68 -44.528  15.320  -9.862
  532    HZ   PHE  68           HZ       PHE  68 -45.535  14.622 -12.027
  533    H    LEU  69           H        LEU  69 -44.915   7.815  -7.519
  534    HA   LEU  69           HA       LEU  69 -47.417   7.435  -9.066
  535    HB2  LEU  69           2HB      LEU  69 -46.366   5.596 -10.316
  536    HB3  LEU  69           3HB      LEU  69 -45.696   7.180 -10.639
  537    HG   LEU  69           HG       LEU  69 -43.729   6.619  -9.148
  538   HD11  LEU  69          1HD1      LEU  69 -44.857   3.791  -9.323
  539   HD12  LEU  69          2HD1      LEU  69 -43.234   4.236  -8.744
  540   HD13  LEU  69          3HD1      LEU  69 -44.654   4.728  -7.836
  541   HD21  LEU  69          3HD2      LEU  69 -44.224   4.801 -11.536
  542   HD22  LEU  69          1HD2      LEU  69 -43.634   6.475 -11.601
  543   HD23  LEU  69          2HD2      LEU  69 -42.641   5.222 -10.846
  544    H    HIS  70           H        HIS  70 -46.713   7.248  -6.044
  545    HA   HIS  70           HA       HIS  70 -46.914   4.449  -5.461
  546    HB2  HIS  70           2HB      HIS  70 -47.030   4.994  -3.221
  547    HB3  HIS  70           3HB      HIS  70 -45.947   6.153  -3.946
  548    HD2  HIS  70           HD2      HIS  70 -48.729   8.025  -4.870
  549    HE1  HIS  70           HE1      HIS  70 -48.730   8.745  -0.673
  550    HE2  HIS  70           HE2      HIS  70 -49.610   9.548  -2.920
  551    H    GLY  71           H        GLY  71 -48.582   3.204  -4.506
  552    HA2  GLY  71           HA2      GLY  71 -51.328   3.934  -5.478
  553    HA3  GLY  71           HA3      GLY  71 -50.546   2.391  -5.794
  554    HA   PRO  72           HA       PRO  72 -53.438   2.371  -2.162
  555    HB2  PRO  72           2HB      PRO  72 -54.529  -0.068  -3.556
  556    HB3  PRO  72           3HB      PRO  72 -55.411   1.265  -2.750
  557    HG2  PRO  72           2HG      PRO  72 -55.263   1.182  -5.445
  558    HG3  PRO  72           3HG      PRO  72 -55.000   2.742  -4.593
  559    HD2  PRO  72           2HD      PRO  72 -52.909   0.795  -5.623
  560    HD3  PRO  72           3HD      PRO  72 -53.023   2.560  -5.873
  561    H    ARG  73           H        ARG  73 -51.204  -0.018  -3.251
  562    HA   ARG  73           HA       ARG  73 -51.241  -1.356  -0.570
  563    HB2  ARG  73           2HB      ARG  73 -51.527  -2.692  -2.822
  564    HB3  ARG  73           3HB      ARG  73 -49.775  -2.498  -2.947
  565    HG2  ARG  73           2HG      ARG  73 -49.666  -3.516  -0.564
  566    HG3  ARG  73           3HG      ARG  73 -51.386  -3.853  -0.729
  567    HD2  ARG  73           2HD      ARG  73 -49.145  -4.887  -2.516
  568    HD3  ARG  73           3HD      ARG  73 -49.928  -5.808  -1.239
  569    HE   ARG  73           HE       ARG  73 -50.925  -5.322  -3.937
  570   HH11  ARG  73          1HH2      ARG  73 -52.088  -6.161  -0.730
  571   HH12  ARG  73          2HH2      ARG  73 -53.505  -6.935  -1.386
  572   HH21  ARG  73          1HH1      ARG  73 -52.635  -6.293  -4.666
  573   HH22  ARG  73          2HH1      ARG  73 -53.829  -6.998  -3.591
  574    H    THR  74           H        THR  74 -49.595   1.144  -2.116
  575    HA   THR  74           HA       THR  74 -46.896   0.323  -1.328
  576    HB   THR  74           HB       THR  74 -47.678   3.163  -1.924
  577    HG1  THR  74           HG1      THR  74 -46.777   1.494  -3.969
  578   HG21  THR  74          1HG2      THR  74 -45.381   3.162  -2.961
  579   HG22  THR  74          2HG2      THR  74 -45.371   2.861  -1.220
  580   HG23  THR  74          3HG2      THR  74 -45.158   1.510  -2.350
  581    H    GLN  75           H        GLN  75 -45.765   0.798   0.469
  582    HA   GLN  75           HA       GLN  75 -47.239   2.019   2.714
  583    HB2  GLN  75           2HB      GLN  75 -44.408   0.959   2.653
  584    HB3  GLN  75           3HB      GLN  75 -45.287   1.532   4.067
  585    HG2  GLN  75           2HG      GLN  75 -45.983  -0.917   2.403
  586    HG3  GLN  75           3HG      GLN  75 -45.272  -0.889   4.016
  587   HE21  GLN  75          2HE2      GLN  75 -46.665   0.047   5.834
  588   HE22  GLN  75          1HE2      GLN  75 -48.403  -0.123   5.655
  589    H    ARG  76           H        ARG  76 -47.011   3.974   3.439
  590    HA   ARG  76           HA       ARG  76 -45.795   5.993   1.726
  591    HB2  ARG  76           2HB      ARG  76 -46.883   6.449   4.488
  592    HB3  ARG  76           3HB      ARG  76 -46.766   7.610   3.166
  593    HG2  ARG  76           2HG      ARG  76 -48.688   5.261   3.417
  594    HG3  ARG  76           3HG      ARG  76 -49.096   6.967   3.420
  595    HD2  ARG  76           2HD      ARG  76 -48.688   7.187   1.070
  596    HD3  ARG  76           3HD      ARG  76 -47.847   5.631   0.986
  597    HE   ARG  76           HE       ARG  76 -50.597   5.376   1.901
  598   HH11  ARG  76          1HH1      ARG  76 -48.791   5.626  -1.117
  599   HH12  ARG  76          2HH1      ARG  76 -49.780   4.371  -1.859
  600   HH21  ARG  76          1HH2      ARG  76 -51.840   3.882   0.763
  601   HH22  ARG  76          2HH2      ARG  76 -51.389   3.500  -0.885
  602    H    ARG  77           H        ARG  77 -44.945   4.542   4.837
  603    HA   ARG  77           HA       ARG  77 -42.513   5.924   5.379
  604    HB2  ARG  77           2HB      ARG  77 -41.826   3.945   6.589
  605    HB3  ARG  77           3HB      ARG  77 -43.463   4.481   6.986
  606    HG2  ARG  77           2HG      ARG  77 -44.497   2.641   6.112
  607    HG3  ARG  77           3HG      ARG  77 -43.202   2.250   4.981
  608    HD2  ARG  77           2HD      ARG  77 -42.733   2.053   7.960
  609    HD3  ARG  77           3HD      ARG  77 -43.559   0.781   7.082
  610    HE   ARG  77           HE       ARG  77 -40.710   1.546   6.835
  611   HH11  ARG  77          1HH1      ARG  77 -43.223  -0.629   5.600
  612   HH12  ARG  77          2HH1      ARG  77 -41.994  -1.591   4.769
  613   HH21  ARG  77          1HH2      ARG  77 -39.313   0.131   5.714
  614   HH22  ARG  77          2HH2      ARG  77 -40.053  -1.217   4.844
  615    H    ALA  78           H        ALA  78 -43.098   3.261   3.133
  616    HA   ALA  78           HA       ALA  78 -40.330   2.822   2.432
  617    HB1  ALA  78           3HB      ALA  78 -42.092   1.095   2.141
  618    HB2  ALA  78           1HB      ALA  78 -42.885   2.084   0.883
  619    HB3  ALA  78           2HB      ALA  78 -41.292   1.474   0.624
  620    H    ALA  79           H        ALA  79 -43.027   4.621   0.859
  621    HA   ALA  79           HA       ALA  79 -41.388   5.618  -1.312
  622    HB1  ALA  79           3HB      ALA  79 -43.298   7.120  -1.699
  623    HB2  ALA  79           1HB      ALA  79 -43.878   5.478  -1.360
  624    HB3  ALA  79           2HB      ALA  79 -43.961   6.739  -0.100
  625    H    ALA  80           H        ALA  80 -42.092   6.887   1.929
  626    HA   ALA  80           HA       ALA  80 -40.837   9.419   1.603
  627    HB1  ALA  80           3HB      ALA  80 -40.962   9.461   4.081
  628    HB2  ALA  80           1HB      ALA  80 -42.486   8.924   3.339
  629    HB3  ALA  80           2HB      ALA  80 -41.388   7.733   4.074
  630    H    GLN  81           H        GLN  81 -39.546   6.397   3.186
  631    HA   GLN  81           HA       GLN  81 -36.907   7.207   3.624
  632    HB2  GLN  81           2HB      GLN  81 -38.019   5.067   4.342
  633    HB3  GLN  81           3HB      GLN  81 -37.844   4.478   2.691
  634    HG2  GLN  81           2HG      GLN  81 -36.044   3.573   4.007
  635    HG3  GLN  81           3HG      GLN  81 -35.333   4.767   2.928
  636   HE21  GLN  81          2HE2      GLN  81 -36.393   4.217   6.330
  637   HE22  GLN  81          1HE2      GLN  81 -35.348   5.466   6.991
  638    H    ILE  82           H        ILE  82 -38.354   5.980   0.542
  639    HA   ILE  82           HA       ILE  82 -35.887   6.163  -0.932
  640    HB   ILE  82           HB       ILE  82 -38.799   6.060  -1.691
  641   HG12  ILE  82          2HG1      ILE  82 -36.430   4.239  -2.342
  642   HG13  ILE  82          3HG1      ILE  82 -37.333   4.112  -0.828
  643   HG21  ILE  82          1HG2      ILE  82 -38.024   5.936  -4.098
  644   HG22  ILE  82          2HG2      ILE  82 -37.866   7.536  -3.363
  645   HG23  ILE  82          3HG2      ILE  82 -36.428   6.510  -3.552
  646   HD11  ILE  82          3HD1      ILE  82 -39.420   3.774  -2.047
  647   HD12  ILE  82          1HD1      ILE  82 -38.499   3.740  -3.584
  648   HD13  ILE  82          2HD1      ILE  82 -38.188   2.513  -2.342
  649    H    ALA  83           H        ALA  83 -38.601   8.521  -0.621
  650    HA   ALA  83           HA       ALA  83 -37.438  10.624  -2.054
  651    HB1  ALA  83           3HB      ALA  83 -39.747  10.544  -1.069
  652    HB2  ALA  83           1HB      ALA  83 -39.031  10.923   0.514
  653    HB3  ALA  83           2HB      ALA  83 -38.884  12.083  -0.810
  654    H    GLN  84           H        GLN  84 -36.665   9.615   1.269
  655    HA   GLN  84           HA       GLN  84 -34.879  11.862   1.827
  656    HB2  GLN  84           2HB      GLN  84 -34.720   9.141   3.157
  657    HB3  GLN  84           3HB      GLN  84 -34.123  10.685   3.726
  658    HG2  GLN  84           2HG      GLN  84 -36.911   9.626   3.729
  659    HG3  GLN  84           3HG      GLN  84 -35.997  10.251   5.047
  660   HE21  GLN  84          1HE2      GLN  84 -38.339  10.978   2.671
  661   HE22  GLN  84          2HE2      GLN  84 -38.444  12.717   2.981
  662    H    ALA  85           H        ALA  85 -34.468   8.561   0.430
  663    HA   ALA  85           HA       ALA  85 -31.580   8.641   0.438
  664    HB1  ALA  85           3HB      ALA  85 -33.513   6.961  -1.223
  665    HB2  ALA  85           1HB      ALA  85 -31.783   6.654  -0.991
  666    HB3  ALA  85           2HB      ALA  85 -32.890   6.539   0.390
  667    H    LEU  86           H        LEU  86 -34.074   9.717  -1.840
  668    HA   LEU  86           HA       LEU  86 -32.111  10.443  -3.883
  669    HB2  LEU  86           2HB      LEU  86 -34.994  11.323  -3.807
  670    HB3  LEU  86           3HB      LEU  86 -33.896  11.224  -5.171
  671    HG   LEU  86           HG       LEU  86 -35.527   9.082  -3.839
  672   HD11  LEU  86          1HD1      LEU  86 -35.969   8.462  -6.140
  673   HD12  LEU  86          2HD1      LEU  86 -36.115  10.225  -5.985
  674   HD13  LEU  86          3HD1      LEU  86 -34.669   9.528  -6.723
  675   HD21  LEU  86          3HD2      LEU  86 -33.007   8.382  -5.422
  676   HD22  LEU  86          1HD2      LEU  86 -33.293   7.971  -3.718
  677   HD23  LEU  86          2HD2      LEU  86 -34.307   7.262  -4.949
  678    H    LEU  87           H        LEU  87 -33.834  12.156  -1.272
  679    HA   LEU  87           HA       LEU  87 -32.896  14.794  -1.713
  680    HB2  LEU  87           2HB      LEU  87 -34.689  14.549  -0.315
  681    HB3  LEU  87           3HB      LEU  87 -34.092  13.084   0.415
  682    HG   LEU  87           HG       LEU  87 -32.772  15.576   1.143
  683   HD11  LEU  87          1HD1      LEU  87 -34.418  15.868   2.993
  684   HD12  LEU  87          2HD1      LEU  87 -35.166  16.042   1.398
  685   HD13  LEU  87          3HD1      LEU  87 -35.368  14.527   2.304
  686   HD21  LEU  87          3HD2      LEU  87 -31.777  13.546   2.060
  687   HD22  LEU  87          1HD2      LEU  87 -32.462  14.546   3.330
  688   HD23  LEU  87          2HD2      LEU  87 -33.334  13.104   2.789
  689    H    GLY  88           H        GLY  88 -31.377  11.944  -0.260
  690    HA2  GLY  88           HA2      GLY  88 -29.014  11.673  -0.684
  691    HA3  GLY  88           HA3      GLY  88 -28.745  13.385  -0.372
  692    H    ALA  89           H        ALA  89 -30.849  11.610   1.845
  693    HA   ALA  89           HA       ALA  89 -29.223  12.170   4.122
  694    HB1  ALA  89           3HB      ALA  89 -31.469  10.138   3.725
  695    HB2  ALA  89           1HB      ALA  89 -30.809  10.657   5.290
  696    HB3  ALA  89           2HB      ALA  89 -31.645  11.827   4.256
  697    H    GLU  90           H        GLU  90 -29.784   9.129   2.347
  698    HA   GLU  90           HA       GLU  90 -27.037   8.359   2.295
  699    HB2  GLU  90           2HB      GLU  90 -27.281   6.166   3.403
  700    HB3  GLU  90           3HB      GLU  90 -27.381   7.506   4.535
  701    HG2  GLU  90           2HG      GLU  90 -29.875   7.277   4.571
  702    HG3  GLU  90           3HG      GLU  90 -29.747   5.895   3.478
  703    H    GLU  91           H        GLU  91 -26.714   6.810   0.600
  704    HA   GLU  91           HA       GLU  91 -29.129   6.112  -1.027
  705    HB2  GLU  91           2HB      GLU  91 -26.139   5.862  -1.532
  706    HB3  GLU  91           3HB      GLU  91 -27.358   5.019  -2.470
  707    HG2  GLU  91           2HG      GLU  91 -27.196   6.944  -3.743
  708    HG3  GLU  91           3HG      GLU  91 -28.549   7.328  -2.716
  709    H    ARG  92           H        ARG  92 -30.133   4.356  -0.755
  710    HA   ARG  92           HA       ARG  92 -28.972   1.889   0.394
  711    HB2  ARG  92           2HB      ARG  92 -29.594   3.566   2.278
  712    HB3  ARG  92           3HB      ARG  92 -31.260   3.378   1.773
  713    HG2  ARG  92           2HG      ARG  92 -30.905   1.986   3.684
  714    HG3  ARG  92           3HG      ARG  92 -31.100   0.919   2.305
  715    HD2  ARG  92           2HD      ARG  92 -29.320   0.077   3.691
  716    HD3  ARG  92           3HD      ARG  92 -28.599   0.669   2.188
  717    HE   ARG  92           HE       ARG  92 -28.632   2.728   4.252
  718   HH11  ARG  92          2HH2      ARG  92 -26.733  -0.088   3.324
  719   HH12  ARG  92          1HH2      ARG  92 -25.321   0.532   4.140
  720   HH21  ARG  92          1HH1      ARG  92 -26.960   3.393   5.207
  721   HH22  ARG  92          2HH1      ARG  92 -25.426   2.511   5.221
  722    H    LYS  93           H        LYS  93 -30.301   0.051   0.094
  723    HA   LYS  93           HA       LYS  93 -32.412   0.243  -1.935
  724    HB2  LYS  93           2HB      LYS  93 -30.779  -1.667  -1.734
  725    HB3  LYS  93           3HB      LYS  93 -31.653  -2.176  -0.277
  726    HG2  LYS  93           2HG      LYS  93 -33.761  -2.143  -1.853
  727    HG3  LYS  93           3HG      LYS  93 -32.581  -2.080  -3.155
  728    HD2  LYS  93           2HD      LYS  93 -32.869  -4.251  -1.040
  729    HD3  LYS  93           3HD      LYS  93 -33.274  -4.377  -2.755
  730    HE2  LYS  93           2HE      LYS  93 -30.807  -3.819  -3.223
  731    HE3  LYS  93           3HE      LYS  93 -30.516  -4.088  -1.495
  732    HZ1  LYS  93           HZ1      LYS  93 -31.451  -6.015  -3.529
  733    HZ2  LYS  93           HZ2      LYS  93 -30.097  -6.127  -2.634
  734    HZ3  LYS  93           HZ3      LYS  93 -31.549  -6.368  -1.912
  735    H    VAL  94           H        VAL  94 -34.539   0.265  -1.584
  736    HA   VAL  94           HA       VAL  94 -35.686  -0.411   1.090
  737    HB   VAL  94           HB       VAL  94 -36.881   1.813  -0.561
  738   HG11  VAL  94          1HG1      VAL  94 -36.994   1.217   2.431
  739   HG12  VAL  94          2HG1      VAL  94 -37.872   2.505   1.574
  740   HG13  VAL  94          3HG1      VAL  94 -38.273   0.834   1.259
  741   HG21  VAL  94          3HG2      VAL  94 -34.810   2.233   1.637
  742   HG22  VAL  94          1HG2      VAL  94 -34.655   2.707  -0.074
  743   HG23  VAL  94          2HG2      VAL  94 -35.848   3.503   0.949
  744    H    GLU  95           H        GLU  95 -37.832  -1.200   0.981
  745    HA   GLU  95           HA       GLU  95 -38.552  -2.619  -1.507
  746    HB2  GLU  95           2HB      GLU  95 -40.222  -3.670  -0.136
  747    HB3  GLU  95           3HB      GLU  95 -38.697  -3.653   0.783
  748    HG2  GLU  95           2HG      GLU  95 -39.552  -1.528   1.939
  749    HG3  GLU  95           3HG      GLU  95 -41.112  -1.815   1.168
  750    H    ILE  96           H        ILE  96 -40.824  -2.299  -2.388
  751    HA   ILE  96           HA       ILE  96 -42.522  -0.335  -1.411
  752    HB   ILE  96           HB       ILE  96 -42.464   0.952  -3.847
  753   HG12  ILE  96          2HG1      ILE  96 -40.360   1.893  -4.369
  754   HG13  ILE  96          3HG1      ILE  96 -39.559   1.043  -3.047
  755   HG21  ILE  96          1HG2      ILE  96 -42.827   1.910  -1.570
  756   HG22  ILE  96          2HG2      ILE  96 -41.067   2.149  -1.487
  757   HG23  ILE  96          3HG2      ILE  96 -42.015   2.933  -2.750
  758   HD11  ILE  96          3HD1      ILE  96 -39.256   0.198  -5.478
  759   HD12  ILE  96          1HD1      ILE  96 -39.459  -0.943  -4.156
  760   HD13  ILE  96          2HD1      ILE  96 -40.838  -0.577  -5.227
  761    H    ALA  97           H        ALA  97 -44.511  -0.242  -2.445
  762    HA   ALA  97           HA       ALA  97 -45.000  -2.511  -4.281
  763    HB1  ALA  97           3HB      ALA  97 -47.286  -2.383  -3.755
  764    HB2  ALA  97           1HB      ALA  97 -46.484  -2.050  -2.214
  765    HB3  ALA  97           2HB      ALA  97 -47.166  -0.729  -3.196
  766    H    PHE  98           H        PHE  98 -45.939  -2.340  -6.271
  767    HA   PHE  98           HA       PHE  98 -46.265   0.360  -7.513
  768    HB2  PHE  98           2HB      PHE  98 -45.104  -2.164  -8.683
  769    HB3  PHE  98           3HB      PHE  98 -45.901  -0.991  -9.714
  770    HD1  PHE  98           HD2      PHE  98 -43.066  -1.341  -7.247
  771    HD2  PHE  98           HD1      PHE  98 -44.855   0.974 -10.420
  772    HE1  PHE  98           HE2      PHE  98 -41.071   0.152  -7.316
  773    HE2  PHE  98           HE1      PHE  98 -42.851   2.426 -10.499
  774    HZ   PHE  98           HZ       PHE  98 -40.990   2.057  -8.899
  775    H    TYR  99           H        TYR  99 -47.909   0.520  -9.149
  776    HA   TYR  99           HA       TYR  99 -49.890  -1.641  -9.174
  777    HB2  TYR  99           2HB      TYR  99 -51.776  -0.377  -8.797
  778    HB3  TYR  99           3HB      TYR  99 -50.673   0.128  -7.531
  779    HD1  TYR  99           HD2      TYR  99 -49.407   2.393  -7.848
  780    HD2  TYR  99           HD1      TYR  99 -52.770   1.169 -10.265
  781    HE1  TYR  99           HE2      TYR  99 -49.857   4.769  -8.451
  782    HE2  TYR  99           HE1      TYR  99 -53.192   3.538 -10.882
  783    HH   TYR  99           HH       TYR  99 -52.530   5.718 -10.634
  784    H    ARG 100           H        ARG 100 -50.831  -2.024 -11.061
  785    HA   ARG 100           HA       ARG 100 -49.608  -0.822 -13.428
  786    HB2  ARG 100           2HB      ARG 100 -51.344  -3.242 -12.877
  787    HB3  ARG 100           3HB      ARG 100 -51.165  -2.656 -14.538
  788    HG2  ARG 100           2HG      ARG 100 -48.770  -2.803 -14.448
  789    HG3  ARG 100           3HG      ARG 100 -48.792  -3.250 -12.734
  790    HD2  ARG 100           2HD      ARG 100 -49.860  -5.369 -13.238
  791    HD3  ARG 100           3HD      ARG 100 -50.087  -4.902 -14.938
  792    HE   ARG 100           HE       ARG 100 -47.345  -4.649 -14.449
  793   HH11  ARG 100          1HH1      ARG 100 -49.524  -7.378 -14.134
  794   HH12  ARG 100          2HH1      ARG 100 -48.340  -8.511 -14.724
  795   HH21  ARG 100          2HH2      ARG 100 -46.053  -6.096 -15.552
  796   HH22  ARG 100          1HH2      ARG 100 -46.365  -7.806 -15.399
  797    H    LYS 101           H        LYS 101 -50.689  -0.177 -15.269
  798    HA   LYS 101           HA       LYS 101 -52.736   1.767 -15.137
  799    HB2  LYS 101           2HB      LYS 101 -51.085   1.594 -16.881
  800    HB3  LYS 101           3HB      LYS 101 -51.635   0.002 -17.362
  801    HG2  LYS 101           2HG      LYS 101 -53.615   2.279 -17.510
  802    HG3  LYS 101           3HG      LYS 101 -52.296   2.232 -18.686
  803    HD2  LYS 101           2HD      LYS 101 -52.881   0.002 -19.409
  804    HD3  LYS 101           3HD      LYS 101 -54.147  -0.136 -18.186
  805    HE2  LYS 101           2HE      LYS 101 -55.379   1.749 -19.197
  806    HE3  LYS 101           3HE      LYS 101 -54.105   1.953 -20.410
  807    HZ1  LYS 101           HZ1      LYS 101 -54.632  -0.281 -21.237
  808    HZ2  LYS 101           HZ2      LYS 101 -55.810  -0.467 -20.118
  809    HZ3  LYS 101           HZ3      LYS 101 -55.962   0.660 -21.287
  810    H    ASP 102           H        ASP 102 -53.049  -1.724 -15.496
  811    HA   ASP 102           HA       ASP 102 -55.895  -1.697 -16.041
  812    HB2  ASP 102           2HB      ASP 102 -54.228  -3.457 -16.741
  813    HB3  ASP 102           3HB      ASP 102 -54.138  -3.975 -15.058
  814    H    GLY 103           H        GLY 103 -54.214  -1.076 -13.160
  815    HA2  GLY 103           HA2      GLY 103 -55.254  -0.368 -11.200
  816    HA3  GLY 103           HA3      GLY 103 -56.664  -1.366 -11.532
  817    H    SER 104           H        SER 104 -53.847  -3.254 -11.896
  818    HA   SER 104           HA       SER 104 -54.370  -4.639  -9.327
  819    HB2  SER 104           2HB      SER 104 -52.519  -5.359 -11.625
  820    HB3  SER 104           3HB      SER 104 -52.847  -6.360 -10.199
  821    HG   SER 104           HG       SER 104 -54.173  -6.935 -11.996
  822    H    CYS 105           H        CYS 105 -53.070  -4.565  -7.536
  823    HA   CYS 105           HA       CYS 105 -50.470  -3.122  -7.735
  824    HB2  CYS 105           2HB      CYS 105 -51.008  -2.081  -5.568
  825    HB3  CYS 105           3HB      CYS 105 -52.183  -1.668  -6.828
  826    HG   CYS 105           HG       CYS 105 -53.474  -1.938  -4.581
  827    H    PHE 106           H        PHE 106 -48.729  -3.767  -6.600
  828    HA   PHE 106           HA       PHE 106 -48.828  -6.206  -4.905
  829    HB2  PHE 106           2HB      PHE 106 -47.051  -7.192  -6.495
  830    HB3  PHE 106           3HB      PHE 106 -48.739  -7.272  -6.955
  831    HD1  PHE 106           HD2      PHE 106 -45.520  -5.516  -7.670
  832    HD2  PHE 106           HD1      PHE 106 -49.613  -6.127  -8.884
  833    HE1  PHE 106           HE2      PHE 106 -45.078  -4.315  -9.798
  834    HE2  PHE 106           HE1      PHE 106 -49.170  -4.913 -10.995
  835    HZ   PHE 106           HZ       PHE 106 -46.892  -4.009 -11.461
  836    H    LEU 107           H        LEU 107 -47.188  -6.427  -3.487
  837    HA   LEU 107           HA       LEU 107 -44.858  -4.564  -3.529
  838    HB2  LEU 107           2HB      LEU 107 -46.478  -4.344  -1.624
  839    HB3  LEU 107           3HB      LEU 107 -46.200  -6.017  -1.215
  840    HG   LEU 107           HG       LEU 107 -45.117  -4.527   0.312
  841   HD11  LEU 107          1HD1      LEU 107 -43.877  -6.716  -0.373
  842   HD12  LEU 107          2HD1      LEU 107 -42.745  -5.607  -1.191
  843   HD13  LEU 107          3HD1      LEU 107 -42.992  -5.461   0.533
  844   HD21  LEU 107          3HD2      LEU 107 -43.204  -3.129  -0.231
  845   HD22  LEU 107          1HD2      LEU 107 -43.439  -3.503  -1.950
  846   HD23  LEU 107          2HD2      LEU 107 -44.683  -2.596  -1.029
  847    H    CYS 108           H        CYS 108 -42.867  -5.467  -3.605
  848    HA   CYS 108           HA       CYS 108 -42.388  -8.272  -2.838
  849    HB2  CYS 108           2HB      CYS 108 -42.172  -7.180  -5.632
  850    HB3  CYS 108           3HB      CYS 108 -40.891  -8.268  -5.084
  851    HG   CYS 108           HG       CYS 108 -44.103  -8.864  -4.636
  852    H    LEU 109           H        LEU 109 -39.846  -8.657  -3.136
  853    HA   LEU 109           HA       LEU 109 -38.527  -6.589  -1.513
  854    HB2  LEU 109           2HB      LEU 109 -37.567  -9.284  -2.567
  855    HB3  LEU 109           3HB      LEU 109 -36.639  -8.214  -1.539
  856    HG   LEU 109           HG       LEU 109 -37.437  -9.950  -0.195
  857   HD11  LEU 109          1HD1      LEU 109 -38.650  -8.810   1.556
  858   HD12  LEU 109          2HD1      LEU 109 -37.488  -7.689   0.825
  859   HD13  LEU 109          3HD1      LEU 109 -39.219  -7.564   0.429
  860   HD21  LEU 109          3HD2      LEU 109 -40.337  -9.344  -0.850
  861   HD22  LEU 109          1HD2      LEU 109 -39.392 -10.655  -1.600
  862   HD23  LEU 109          2HD2      LEU 109 -39.679 -10.646   0.149
  863    H    VAL 110           H        VAL 110 -39.080  -5.172  -3.451
  864    HA   VAL 110           HA       VAL 110 -37.788  -5.343  -5.929
  865    HB   VAL 110           HB       VAL 110 -38.878  -2.937  -4.477
  866   HG11  VAL 110          1HG1      VAL 110 -38.204  -3.348  -7.409
  867   HG12  VAL 110          2HG1      VAL 110 -39.167  -1.985  -6.808
  868   HG13  VAL 110          3HG1      VAL 110 -37.472  -2.139  -6.337
  869   HG21  VAL 110          3HG2      VAL 110 -40.874  -3.288  -5.895
  870   HG22  VAL 110          1HG2      VAL 110 -40.117  -4.710  -6.633
  871   HG23  VAL 110          2HG2      VAL 110 -40.577  -4.719  -4.920
  872    H    ASP 111           H        ASP 111 -36.000  -4.125  -6.907
  873    HA   ASP 111           HA       ASP 111 -33.791  -4.021  -4.881
  874    HB2  ASP 111           2HB      ASP 111 -33.889  -5.794  -6.722
  875    HB3  ASP 111           3HB      ASP 111 -33.413  -4.504  -7.828
  876    H    VAL 112           H        VAL 112 -34.565  -1.784  -4.433
  877    HA   VAL 112           HA       VAL 112 -34.195   0.228  -6.494
  878    HB   VAL 112           HB       VAL 112 -34.840   0.574  -3.541
  879   HG11  VAL 112          1HG1      VAL 112 -35.619   2.310  -5.916
  880   HG12  VAL 112          2HG1      VAL 112 -35.971   2.611  -4.209
  881   HG13  VAL 112          3HG1      VAL 112 -34.302   2.698  -4.772
  882   HG21  VAL 112          3HG2      VAL 112 -37.213   0.579  -4.323
  883   HG22  VAL 112          1HG2      VAL 112 -36.650   0.052  -5.934
  884   HG23  VAL 112          2HG2      VAL 112 -36.445  -0.993  -4.518
  885    H    VAL 113           H        VAL 113 -31.936  -0.467  -6.791
  886    HA   VAL 113           HA       VAL 113 -30.047   0.725  -4.788
  887    HB   VAL 113           HB       VAL 113 -29.537  -1.502  -6.793
  888   HG11  VAL 113          1HG1      VAL 113 -27.443  -0.293  -6.303
  889   HG12  VAL 113          2HG1      VAL 113 -27.782  -0.379  -4.556
  890   HG13  VAL 113          3HG1      VAL 113 -27.446  -1.852  -5.489
  891   HG21  VAL 113          3HG2      VAL 113 -31.022  -2.225  -4.972
  892   HG22  VAL 113          1HG2      VAL 113 -29.419  -2.933  -4.784
  893   HG23  VAL 113          2HG2      VAL 113 -29.889  -1.547  -3.773
  894    HA   PRO 114           HA       PRO 114 -28.999   3.531  -8.258
  895    HB2  PRO 114           2HB      PRO 114 -27.288   5.221  -6.969
  896    HB3  PRO 114           3HB      PRO 114 -29.027   5.196  -6.632
  897    HG2  PRO 114           2HG      PRO 114 -26.812   3.852  -5.113
  898    HG3  PRO 114           3HG      PRO 114 -28.161   4.868  -4.485
  899    HD2  PRO 114           2HD      PRO 114 -28.286   2.144  -4.452
  900    HD3  PRO 114           3HD      PRO 114 -29.717   3.179  -4.756
  901    H    VAL 115           H        VAL 115 -26.859   4.648  -9.127
  902    HA   VAL 115           HA       VAL 115 -24.607   2.693  -9.181
  903    HB   VAL 115           HB       VAL 115 -24.270   3.210 -11.569
  904   HG11  VAL 115          1HG1      VAL 115 -25.917   1.597 -12.365
  905   HG12  VAL 115          2HG1      VAL 115 -25.245   1.096 -10.805
  906   HG13  VAL 115          3HG1      VAL 115 -26.873   1.801 -10.882
  907   HG21  VAL 115          3HG2      VAL 115 -25.659   5.234 -11.736
  908   HG22  VAL 115          1HG2      VAL 115 -26.049   4.021 -12.956
  909   HG23  VAL 115          2HG2      VAL 115 -27.118   4.238 -11.544
  910    H    LYS 116           H        LYS 116 -22.654   3.374  -9.127
  911    HA   LYS 116           HA       LYS 116 -22.157   6.261  -8.613
  912    HB2  LYS 116           2HB      LYS 116 -20.698   3.977  -7.231
  913    HB3  LYS 116           3HB      LYS 116 -20.673   5.664  -6.839
  914    HG2  LYS 116           2HG      LYS 116 -22.040   4.953  -5.203
  915    HG3  LYS 116           3HG      LYS 116 -23.275   5.332  -6.404
  916    HD2  LYS 116           2HD      LYS 116 -23.318   2.897  -7.065
  917    HD3  LYS 116           3HD      LYS 116 -22.082   2.559  -5.849
  918    HE2  LYS 116           2HE      LYS 116 -23.575   3.129  -4.054
  919    HE3  LYS 116           3HE      LYS 116 -24.756   3.828  -5.169
  920    HZ1  LYS 116           HZ1      LYS 116 -25.177   1.623  -6.078
  921    HZ2  LYS 116           HZ2      LYS 116 -24.007   0.948  -5.143
  922    HZ3  LYS 116           HZ3      LYS 116 -25.353   1.544  -4.446
  923    H    ASN 117           H        ASN 117 -19.889   6.821  -8.599
  924    HA   ASN 117           HA       ASN 117 -18.378   5.613 -10.903
  925    HB2  ASN 117           2HB      ASN 117 -17.320   7.632 -11.296
  926    HB3  ASN 117           3HB      ASN 117 -18.971   8.099 -10.962
  927   HD21  ASN 117          2HD2      ASN 117 -19.384   8.981  -8.645
  928   HD22  ASN 117          1HD2      ASN 117 -18.013   9.819  -7.931
  929    H    GLU 118           H        GLU 118 -15.834   6.024 -10.507
  930    HA   GLU 118           HA       GLU 118 -15.062   4.081  -8.594
  931    HB2  GLU 118           2HB      GLU 118 -12.792   4.580  -9.260
  932    HB3  GLU 118           3HB      GLU 118 -13.854   4.514 -10.664
  933    HG2  GLU 118           2HG      GLU 118 -13.925   7.014 -10.716
  934    HG3  GLU 118           3HG      GLU 118 -12.839   7.064  -9.325
  935    H    ASP 119           H        ASP 119 -15.408   7.542  -8.107
  936    HA   ASP 119           HA       ASP 119 -13.920   7.676  -5.630
  937    HB2  ASP 119           2HB      ASP 119 -14.624   9.590  -7.192
  938    HB3  ASP 119           3HB      ASP 119 -16.226   9.459  -6.467
  939    H    GLY 120           H        GLY 120 -16.990   6.288  -6.407
  940    HA2  GLY 120           HA2      GLY 120 -18.306   4.994  -4.972
  941    HA3  GLY 120           HA3      GLY 120 -17.665   5.831  -3.558
  942    H    ALA 121           H        ALA 121 -18.537   8.143  -5.879
  943    HA   ALA 121           HA       ALA 121 -21.029   8.765  -4.431
  944    HB1  ALA 121           3HB      ALA 121 -19.565  10.426  -6.521
  945    HB2  ALA 121           1HB      ALA 121 -20.838  10.970  -5.421
  946    HB3  ALA 121           2HB      ALA 121 -19.250  10.512  -4.769
  947    H    VAL 122           H        VAL 122 -23.006   8.903  -5.221
  948    HA   VAL 122           HA       VAL 122 -23.718   7.332  -7.517
  949    HB   VAL 122           HB       VAL 122 -25.080   7.206  -5.582
  950   HG11  VAL 122          1HG1      VAL 122 -26.601   8.941  -4.842
  951   HG12  VAL 122          2HG1      VAL 122 -24.922   9.479  -4.638
  952   HG13  VAL 122          3HG1      VAL 122 -25.922  10.105  -5.972
  953   HG21  VAL 122          3HG2      VAL 122 -26.081   6.853  -7.790
  954   HG22  VAL 122          1HG2      VAL 122 -27.272   7.492  -6.632
  955   HG23  VAL 122          2HG2      VAL 122 -26.573   8.544  -7.864
  956    H    ILE 123           H        ILE 123 -23.089   8.079  -9.407
  957    HA   ILE 123           HA       ILE 123 -23.739  10.852 -10.156
  958    HB   ILE 123           HB       ILE 123 -22.454  10.750 -11.975
  959   HG12  ILE 123          2HG1      ILE 123 -23.193   8.855 -13.184
  960   HG13  ILE 123          3HG1      ILE 123 -21.451   8.841 -13.067
  961   HG21  ILE 123          1HG2      ILE 123 -21.203  10.670  -9.831
  962   HG22  ILE 123          2HG2      ILE 123 -20.979   8.930 -10.059
  963   HG23  ILE 123          3HG2      ILE 123 -20.280  10.077 -11.224
  964   HD11  ILE 123          3HD1      ILE 123 -23.389   7.024 -11.602
  965   HD12  ILE 123          1HD1      ILE 123 -22.235   6.592 -12.857
  966   HD13  ILE 123          2HD1      ILE 123 -21.641   7.084 -11.261
  967    H    MET 124           H        MET 124 -25.040   7.609 -10.666
  968    HA   MET 124           HA       MET 124 -27.384   8.993 -11.846
  969    HB2  MET 124           2HB      MET 124 -25.897   6.790 -13.234
  970    HB3  MET 124           3HB      MET 124 -27.657   6.768 -13.268
  971    HG2  MET 124           2HG      MET 124 -27.503   8.070 -15.043
  972    HG3  MET 124           3HG      MET 124 -27.206   9.380 -13.918
  973    HE1  MET 124           3HE      MET 124 -24.346  10.868 -15.704
  974    HE2  MET 124           1HE      MET 124 -26.128  10.834 -15.762
  975    HE3  MET 124           2HE      MET 124 -25.286  10.939 -14.200
  976    H    PHE 125           H        PHE 125 -29.255   8.163 -11.662
  977    HA   PHE 125           HA       PHE 125 -29.729   6.279  -9.388
  978    HB2  PHE 125           2HB      PHE 125 -31.158   8.752 -10.354
  979    HB3  PHE 125           3HB      PHE 125 -32.122   7.461  -9.657
  980    HD1  PHE 125           HD1      PHE 125 -30.464   6.496  -7.413
  981    HD2  PHE 125           HD2      PHE 125 -31.391  10.467  -8.746
  982    HE1  PHE 125           HE1      PHE 125 -29.898   7.367  -5.157
  983    HE2  PHE 125           HE2      PHE 125 -30.847  11.348  -6.483
  984    HZ   PHE 125           HZ       PHE 125 -30.055   9.806  -4.702
  985    H    ILE 126           H        ILE 126 -29.284   4.528 -10.759
  986    HA   ILE 126           HA       ILE 126 -31.513   3.868 -12.637
  987    HB   ILE 126           HB       ILE 126 -28.900   2.398 -12.237
  988   HG12  ILE 126          2HG1      ILE 126 -29.892   4.336 -14.382
  989   HG13  ILE 126          3HG1      ILE 126 -28.557   4.599 -13.276
  990   HG21  ILE 126          1HG2      ILE 126 -29.568   0.986 -14.062
  991   HG22  ILE 126          2HG2      ILE 126 -30.982   1.024 -13.017
  992   HG23  ILE 126          3HG2      ILE 126 -30.953   2.016 -14.460
  993   HD11  ILE 126          3HD1      ILE 126 -28.671   2.594 -15.525
  994   HD12  ILE 126          1HD1      ILE 126 -27.617   4.018 -15.356
  995   HD13  ILE 126          2HD1      ILE 126 -27.412   2.607 -14.269
  996    H    LEU 127           H        LEU 127 -32.834   3.990 -10.735
  997    HA   LEU 127           HA       LEU 127 -32.519   1.844  -8.736
  998    HB2  LEU 127           2HB      LEU 127 -34.676   3.988  -8.895
  999    HB3  LEU 127           3HB      LEU 127 -34.363   2.867  -7.579
 1000    HG   LEU 127           HG       LEU 127 -32.562   5.128  -8.524
 1001   HD11  LEU 127          1HD1      LEU 127 -34.229   5.844  -6.857
 1002   HD12  LEU 127          2HD1      LEU 127 -33.656   4.576  -5.742
 1003   HD13  LEU 127          3HD1      LEU 127 -32.574   5.882  -6.191
 1004   HD21  LEU 127          3HD2      LEU 127 -31.028   4.341  -6.665
 1005   HD22  LEU 127          1HD2      LEU 127 -31.981   2.852  -6.624
 1006   HD23  LEU 127          2HD2      LEU 127 -31.104   3.312  -8.104
 1007    H    ASN 128           H        ASN 128 -32.502   0.155 -10.055
 1008    HA   ASN 128           HA       ASN 128 -34.454  -0.744 -11.763
 1009    HB2  ASN 128           2HB      ASN 128 -33.043  -2.656  -9.868
 1010    HB3  ASN 128           3HB      ASN 128 -33.536  -2.941 -11.527
 1011   HD21  ASN 128          2HD2      ASN 128 -31.059  -1.751  -9.417
 1012   HD22  ASN 128          1HD2      ASN 128 -29.937  -1.252 -10.672
 1013    H    PHE 129           H        PHE 129 -36.680  -0.666 -11.351
 1014    HA   PHE 129           HA       PHE 129 -37.598  -1.440  -8.703
 1015    HB2  PHE 129           2HB      PHE 129 -39.184  -0.484 -11.094
 1016    HB3  PHE 129           3HB      PHE 129 -39.779  -0.807  -9.461
 1017    HD1  PHE 129           HD2      PHE 129 -38.259   0.450  -7.545
 1018    HD2  PHE 129           HD1      PHE 129 -38.937   1.817 -11.574
 1019    HE1  PHE 129           HE2      PHE 129 -37.839   2.788  -6.819
 1020    HE2  PHE 129           HE1      PHE 129 -38.532   4.154 -10.842
 1021    HZ   PHE 129           HZ       PHE 129 -37.969   4.644  -8.472
 1022    H    GLU 130           H        GLU 130 -36.406  -3.554  -9.549
 1023    HA   GLU 130           HA       GLU 130 -38.202  -5.349 -11.031
 1024    HB2  GLU 130           2HB      GLU 130 -36.412  -7.024 -10.644
 1025    HB3  GLU 130           3HB      GLU 130 -36.001  -5.572 -11.593
 1026    HG2  GLU 130           2HG      GLU 130 -34.794  -4.581  -9.849
 1027    HG3  GLU 130           3HG      GLU 130 -35.436  -5.675  -8.642
 1028    H    VAL 131           H        VAL 131 -39.833  -5.945 -10.116
 1029    HA   VAL 131           HA       VAL 131 -40.472  -6.776  -7.445
 1030    HB   VAL 131           HB       VAL 131 -41.572  -7.410 -10.188
 1031   HG11  VAL 131          1HG1      VAL 131 -42.958  -8.135  -7.592
 1032   HG12  VAL 131          2HG1      VAL 131 -43.599  -8.316  -9.228
 1033   HG13  VAL 131          3HG1      VAL 131 -42.235  -9.312  -8.716
 1034   HG21  VAL 131          3HG2      VAL 131 -43.384  -5.908  -9.523
 1035   HG22  VAL 131          1HG2      VAL 131 -42.680  -5.717  -7.902
 1036   HG23  VAL 131          2HG2      VAL 131 -41.833  -5.081  -9.323
 1037    H    VAL 132           H        VAL 132 -39.440  -8.344  -6.339
 1038    HA   VAL 132           HA       VAL 132 -39.163 -10.979  -7.623
 1039    HB   VAL 132           HB       VAL 132 -37.011 -10.014  -8.066
 1040   HG11  VAL 132          1HG1      VAL 132 -36.644  -9.641  -5.072
 1041   HG12  VAL 132          2HG1      VAL 132 -35.408  -9.408  -6.325
 1042   HG13  VAL 132          3HG1      VAL 132 -36.818  -8.349  -6.281
 1043   HG21  VAL 132          3HG2      VAL 132 -36.729 -12.078  -5.853
 1044   HG22  VAL 132          1HG2      VAL 132 -37.156 -12.432  -7.546
 1045   HG23  VAL 132          2HG2      VAL 132 -35.583 -11.725  -7.156
 1046    H    MET 133           H        MET 133 -39.441 -12.685  -6.300
 1047    HA   MET 133           HA       MET 133 -39.454 -12.348  -3.373
 1048    HB2  MET 133           2HB      MET 133 -41.574 -13.532  -3.105
 1049    HB3  MET 133           3HB      MET 133 -41.796 -12.001  -3.951
 1050    HG2  MET 133           2HG      MET 133 -42.050 -13.139  -6.084
 1051    HG3  MET 133           3HG      MET 133 -41.559 -14.677  -5.377
 1052    HE1  MET 133           3HE      MET 133 -44.187 -11.975  -3.973
 1053    HE2  MET 133           1HE      MET 133 -44.416 -12.026  -5.738
 1054    HE3  MET 133           2HE      MET 133 -45.674 -12.661  -4.656
 1055    H    GLU 134           H        GLU 134 -39.217 -14.322  -2.212
 1056    HA   GLU 134           HA       GLU 134 -37.634 -16.369  -3.561
 1057    HB2  GLU 134           2HB      GLU 134 -38.702 -16.253  -0.713
 1058    HB3  GLU 134           3HB      GLU 134 -37.540 -17.426  -1.346
 1059    HG2  GLU 134           2HG      GLU 134 -36.004 -15.506  -1.920
 1060    HG3  GLU 134           3HG      GLU 134 -37.118 -14.416  -1.097
 1061    H    LYS 135           H        LYS 135 -38.154 -18.500  -3.984
 1062    HA   LYS 135           HA       LYS 135 -40.984 -19.402  -3.748
 1063    HB2  LYS 135           2HB      LYS 135 -39.104 -19.492  -6.135
 1064    HB3  LYS 135           3HB      LYS 135 -40.572 -20.438  -6.030
 1065    HG2  LYS 135           2HG      LYS 135 -40.600 -17.387  -5.795
 1066    HG3  LYS 135           3HG      LYS 135 -40.637 -18.224  -7.344
 1067    HD2  LYS 135           2HD      LYS 135 -42.698 -19.421  -6.711
 1068    HD3  LYS 135           3HD      LYS 135 -42.692 -18.601  -5.134
 1069    HE2  LYS 135           2HE      LYS 135 -42.802 -16.399  -6.294
 1070    HE3  LYS 135           3HE      LYS 135 -42.853 -17.230  -7.855
 1071    HZ1  LYS 135           HZ1      LYS 135 -44.949 -18.266  -7.154
 1072    HZ2  LYS 135           HZ2      LYS 135 -44.899 -17.493  -5.713
 1073    HZ3  LYS 135           HZ3      LYS 135 -45.082 -16.641  -7.092
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  -0.923 -44.457 -17.674
    2    H2   MET   1           2H       MET   1  -2.299 -43.632 -18.014
    3    H3   MET   1           3H       MET   1  -2.380 -45.102 -17.305
    4    HA   MET   1           HA       MET   1  -1.342 -44.290 -15.304
    5    HB2  MET   1           2HB      MET   1  -1.291 -41.671 -16.846
    6    HB3  MET   1           3HB      MET   1  -1.168 -41.727 -15.091
    7    HG2  MET   1           2HG      MET   1   0.735 -43.310 -16.863
    8    HG3  MET   1           3HG      MET   1   1.002 -41.623 -16.438
    9    HE1  MET   1           3HE      MET   1   3.372 -42.197 -15.469
   10    HE2  MET   1           1HE      MET   1   3.660 -43.445 -14.237
   11    HE3  MET   1           2HE      MET   1   3.118 -43.913 -15.863
   12    HA   PRO   2           HA       PRO   2  -5.552 -43.647 -14.068
   13    HB2  PRO   2           2HB      PRO   2  -5.293 -42.975 -11.433
   14    HB3  PRO   2           3HB      PRO   2  -4.924 -44.612 -12.059
   15    HG2  PRO   2           2HG      PRO   2  -2.975 -42.336 -11.548
   16    HG3  PRO   2           3HG      PRO   2  -2.856 -44.038 -10.992
   17    HD2  PRO   2           2HD      PRO   2  -1.574 -43.176 -13.222
   18    HD3  PRO   2           3HD      PRO   2  -2.312 -44.805 -13.158
   19    H    VAL   3           H        VAL   3  -7.075 -42.034 -13.381
   20    HA   VAL   3           HA       VAL   3  -6.206 -39.187 -13.421
   21    HB   VAL   3           HB       VAL   3  -8.057 -38.603 -14.934
   22   HG11  VAL   3          1HG1      VAL   3  -7.000 -39.240 -17.016
   23   HG12  VAL   3          2HG1      VAL   3  -5.756 -38.883 -15.805
   24   HG13  VAL   3          3HG1      VAL   3  -6.130 -40.570 -16.225
   25   HG21  VAL   3          3HG2      VAL   3  -8.327 -41.590 -15.491
   26   HG22  VAL   3          1HG2      VAL   3  -9.528 -40.579 -14.653
   27   HG23  VAL   3          2HG2      VAL   3  -9.145 -40.272 -16.350
   28    H    ARG   4           H        ARG   4  -7.785 -37.695 -12.605
   29    HA   ARG   4           HA       ARG   4  -9.211 -38.735 -10.282
   30    HB2  ARG   4           2HB      ARG   4  -9.563 -36.455  -9.642
   31    HB3  ARG   4           3HB      ARG   4  -7.879 -36.885  -9.906
   32    HG2  ARG   4           2HG      ARG   4  -7.801 -35.672 -12.009
   33    HG3  ARG   4           3HG      ARG   4  -9.549 -35.401 -11.984
   34    HD2  ARG   4           2HD      ARG   4  -8.414 -33.420 -11.309
   35    HD3  ARG   4           3HD      ARG   4  -9.341 -34.034  -9.953
   36    HE   ARG   4           HE       ARG   4  -6.359 -34.217 -10.286
   37   HH11  ARG   4          2HH2      ARG   4  -9.076 -34.098  -8.028
   38   HH12  ARG   4          1HH2      ARG   4  -8.014 -34.234  -6.656
   39   HH21  ARG   4          1HH1      ARG   4  -5.109 -34.319  -8.474
   40   HH22  ARG   4          2HH1      ARG   4  -5.846 -34.308  -6.899
   41    H    ARG   5           H        ARG   5 -10.534 -40.011 -11.936
   42    HA   ARG   5           HA       ARG   5 -12.823 -38.832 -13.192
   43    HB2  ARG   5           2HB      ARG   5 -11.831 -41.187 -13.488
   44    HB3  ARG   5           3HB      ARG   5 -12.722 -41.646 -12.031
   45    HG2  ARG   5           2HG      ARG   5 -14.849 -40.962 -13.159
   46    HG3  ARG   5           3HG      ARG   5 -13.925 -40.475 -14.593
   47    HD2  ARG   5           2HD      ARG   5 -13.118 -42.798 -14.868
   48    HD3  ARG   5           3HD      ARG   5 -14.019 -43.304 -13.441
   49    HE   ARG   5           HE       ARG   5 -15.074 -42.674 -16.124
   50   HH11  ARG   5          1HH2      ARG   5 -16.011 -43.300 -12.800
   51   HH12  ARG   5          2HH2      ARG   5 -17.653 -43.676 -13.245
   52   HH21  ARG   5          1HH1      ARG   5 -17.176 -43.169 -16.611
   53   HH22  ARG   5          2HH1      ARG   5 -18.287 -43.603 -15.346
   54    H    GLY   6           H        GLY   6 -14.790 -38.224 -12.485
   55    HA2  GLY   6           HA2      GLY   6 -16.584 -37.825 -11.081
   56    HA3  GLY   6           HA3      GLY   6 -15.900 -38.920  -9.881
   57    H    HIS   7           H        HIS   7 -13.633 -36.476 -10.760
   58    HA   HIS   7           HA       HIS   7 -13.716 -35.150  -8.210
   59    HB2  HIS   7           2HB      HIS   7 -11.692 -35.388  -9.549
   60    HB3  HIS   7           3HB      HIS   7 -12.378 -34.386 -10.833
   61    HD2  HIS   7           HD2      HIS   7 -12.410 -31.729 -10.436
   62    HE1  HIS   7           HE1      HIS   7 -10.250 -31.682  -6.759
   63    HE2  HIS   7           HE2      HIS   7 -11.192 -30.243  -8.638
   64    H    VAL   8           H        VAL   8 -14.372 -33.069  -7.630
   65    HA   VAL   8           HA       VAL   8 -16.819 -32.178  -8.968
   66    HB   VAL   8           HB       VAL   8 -15.517 -31.060  -6.458
   67   HG11  VAL   8          1HG1      VAL   8 -17.826 -30.278  -5.957
   68   HG12  VAL   8          2HG1      VAL   8 -17.193 -29.530  -7.418
   69   HG13  VAL   8          3HG1      VAL   8 -18.366 -30.858  -7.548
   70   HG21  VAL   8          3HG2      VAL   8 -17.198 -32.437  -5.243
   71   HG22  VAL   8          1HG2      VAL   8 -17.671 -33.201  -6.776
   72   HG23  VAL   8          2HG2      VAL   8 -16.040 -33.441  -6.111
   73    H    ALA   9           H        ALA   9 -16.952 -30.635 -10.445
   74    HA   ALA   9           HA       ALA   9 -14.799 -29.012 -11.375
   75    HB1  ALA   9           3HB      ALA   9 -17.831 -28.764 -11.700
   76    HB2  ALA   9           1HB      ALA   9 -16.633 -27.942 -12.712
   77    HB3  ALA   9           2HB      ALA   9 -16.736 -29.710 -12.738
   78    HA   PRO  10           HA       PRO  10 -14.778 -25.449  -8.701
   79    HB2  PRO  10           2HB      PRO  10 -14.754 -23.268 -10.437
   80    HB3  PRO  10           3HB      PRO  10 -13.352 -24.271  -9.986
   81    HG2  PRO  10           2HG      PRO  10 -15.127 -24.531 -12.436
   82    HG3  PRO  10           3HG      PRO  10 -13.337 -24.575 -12.356
   83    HD2  PRO  10           2HD      PRO  10 -14.764 -26.844 -12.507
   84    HD3  PRO  10           3HD      PRO  10 -13.360 -26.758 -11.407
   85    H    GLN  11           H        GLN  11 -16.554 -25.338  -7.552
   86    HA   GLN  11           HA       GLN  11 -19.146 -25.319  -8.585
   87    HB2  GLN  11           2HB      GLN  11 -19.916 -25.347  -6.366
   88    HB3  GLN  11           3HB      GLN  11 -18.428 -26.274  -6.416
   89    HG2  GLN  11           2HG      GLN  11 -18.789 -23.450  -5.313
   90    HG3  GLN  11           3HG      GLN  11 -18.595 -24.927  -4.381
   91   HE21  GLN  11          2HE2      GLN  11 -16.924 -22.281  -4.789
   92   HE22  GLN  11          1HE2      GLN  11 -15.297 -22.952  -4.928
   93    H    ASN  12           H        ASN  12 -17.179 -22.517  -7.830
   94    HA   ASN  12           HA       ASN  12 -19.375 -20.660  -7.416
   95    HB2  ASN  12           2HB      ASN  12 -16.391 -20.362  -7.999
   96    HB3  ASN  12           3HB      ASN  12 -17.474 -18.976  -7.948
   97   HD21  ASN  12          2HD2      ASN  12 -15.773 -18.468  -6.204
   98   HD22  ASN  12          1HD2      ASN  12 -16.230 -18.964  -4.581
   99    H    THR  13           H        THR  13 -17.267 -21.335 -10.234
  100    HA   THR  13           HA       THR  13 -18.784 -19.597 -12.015
  101    HB   THR  13           HB       THR  13 -16.316 -20.168 -12.088
  102    HG1  THR  13           HG1      THR  13 -16.315 -19.918 -14.328
  103   HG21  THR  13          1HG2      THR  13 -17.259 -22.572 -13.680
  104   HG22  THR  13          2HG2      THR  13 -15.579 -22.050 -13.387
  105   HG23  THR  13          3HG2      THR  13 -16.585 -22.627 -12.045
  106    H    PHE  14           H        PHE  14 -18.670 -23.107 -11.378
  107    HA   PHE  14           HA       PHE  14 -20.446 -23.984 -13.416
  108    HB2  PHE  14           2HB      PHE  14 -19.057 -25.382 -11.921
  109    HB3  PHE  14           3HB      PHE  14 -20.068 -24.945 -10.559
  110    HD1  PHE  14           HD2      PHE  14 -19.926 -26.871 -13.729
  111    HD2  PHE  14           HD1      PHE  14 -22.276 -25.951 -10.230
  112    HE1  PHE  14           HE2      PHE  14 -21.448 -28.768 -14.249
  113    HE2  PHE  14           HE1      PHE  14 -23.797 -27.845 -10.755
  114    HZ   PHE  14           HZ       PHE  14 -23.384 -29.254 -12.764
  115    H    LEU  15           H        LEU  15 -21.067 -22.658 -10.151
  116    HA   LEU  15           HA       LEU  15 -23.957 -22.716 -10.469
  117    HB2  LEU  15           2HB      LEU  15 -23.029 -22.763  -8.246
  118    HB3  LEU  15           3HB      LEU  15 -22.184 -21.230  -8.509
  119    HG   LEU  15           HG       LEU  15 -24.283 -20.022  -8.665
  120   HD11  LEU  15          1HD1      LEU  15 -26.459 -21.068  -8.148
  121   HD12  LEU  15          2HD1      LEU  15 -25.783 -21.754  -9.612
  122   HD13  LEU  15          3HD1      LEU  15 -25.686 -22.679  -8.108
  123   HD21  LEU  15          3HD2      LEU  15 -24.210 -21.829  -6.219
  124   HD22  LEU  15          1HD2      LEU  15 -23.258 -20.347  -6.453
  125   HD23  LEU  15          2HD2      LEU  15 -25.023 -20.252  -6.335
  126    H    ASP  16           H        ASP  16 -21.554 -20.036 -10.837
  127    HA   ASP  16           HA       ASP  16 -23.179 -17.933 -11.602
  128    HB2  ASP  16           2HB      ASP  16 -20.703 -17.922 -11.387
  129    HB3  ASP  16           3HB      ASP  16 -20.582 -18.727 -12.945
  130    H    THR  17           H        THR  17 -22.238 -20.662 -13.624
  131    HA   THR  17           HA       THR  17 -23.513 -19.769 -16.081
  132    HB   THR  17           HB       THR  17 -22.986 -22.619 -15.145
  133    HG1  THR  17           HG1      THR  17 -21.097 -21.422 -15.283
  134   HG21  THR  17          1HG2      THR  17 -22.953 -23.134 -17.580
  135   HG22  THR  17          2HG2      THR  17 -24.552 -22.621 -17.026
  136   HG23  THR  17          3HG2      THR  17 -23.519 -21.481 -17.923
  137    H    ILE  18           H        ILE  18 -24.749 -21.631 -13.309
  138    HA   ILE  18           HA       ILE  18 -27.399 -22.047 -14.446
  139    HB   ILE  18           HB       ILE  18 -26.526 -22.127 -11.553
  140   HG12  ILE  18          2HG1      ILE  18 -25.165 -23.718 -12.777
  141   HG13  ILE  18          3HG1      ILE  18 -26.256 -24.487 -11.655
  142   HG21  ILE  18          1HG2      ILE  18 -28.907 -22.026 -11.645
  143   HG22  ILE  18          2HG2      ILE  18 -28.989 -23.248 -12.926
  144   HG23  ILE  18          3HG2      ILE  18 -28.480 -23.693 -11.279
  145   HD11  ILE  18          3HD1      ILE  18 -26.066 -25.697 -13.835
  146   HD12  ILE  18          1HD1      ILE  18 -27.729 -25.146 -13.572
  147   HD13  ILE  18          2HD1      ILE  18 -26.663 -24.263 -14.692
  148    H    ILE  19           H        ILE  19 -25.865 -19.589 -12.325
  149    HA   ILE  19           HA       ILE  19 -28.182 -18.097 -11.771
  150    HB   ILE  19           HB       ILE  19 -25.425 -16.950 -12.373
  151   HG12  ILE  19          2HG1      ILE  19 -25.062 -18.397 -10.520
  152   HG13  ILE  19          3HG1      ILE  19 -25.165 -16.781  -9.877
  153   HG21  ILE  19          1HG2      ILE  19 -27.842 -15.761 -10.976
  154   HG22  ILE  19          2HG2      ILE  19 -26.218 -15.034 -10.971
  155   HG23  ILE  19          3HG2      ILE  19 -27.095 -15.214 -12.489
  156   HD11  ILE  19          3HD1      ILE  19 -27.278 -18.958  -9.764
  157   HD12  ILE  19          1HD1      ILE  19 -26.335 -18.288  -8.426
  158   HD13  ILE  19          2HD1      ILE  19 -27.570 -17.278  -9.238
  159    H    ARG  20           H        ARG  20 -25.927 -17.758 -14.576
  160    HA   ARG  20           HA       ARG  20 -27.563 -15.871 -16.031
  161    HB2  ARG  20           2HB      ARG  20 -25.389 -17.817 -16.825
  162    HB3  ARG  20           3HB      ARG  20 -26.230 -16.821 -18.024
  163    HG2  ARG  20           2HG      ARG  20 -25.600 -14.765 -16.934
  164    HG3  ARG  20           3HG      ARG  20 -24.892 -15.623 -15.554
  165    HD2  ARG  20           2HD      ARG  20 -23.938 -15.941 -18.421
  166    HD3  ARG  20           3HD      ARG  20 -23.253 -14.781 -17.270
  167    HE   ARG  20           HE       ARG  20 -22.911 -16.858 -15.755
  168   HH11  ARG  20          1HH1      ARG  20 -22.663 -17.284 -19.235
  169   HH12  ARG  20          2HH1      ARG  20 -21.367 -18.438 -19.060
  170   HH21  ARG  20          1HH2      ARG  20 -21.117 -17.960 -15.662
  171   HH22  ARG  20          2HH2      ARG  20 -20.603 -18.969 -17.013
  172    H    LYS  21           H        LYS  21 -27.742 -19.332 -15.784
  173    HA   LYS  21           HA       LYS  21 -29.657 -19.755 -17.916
  174    HB2  LYS  21           2HB      LYS  21 -28.333 -21.511 -16.402
  175    HB3  LYS  21           3HB      LYS  21 -29.794 -21.403 -15.402
  176    HG2  LYS  21           2HG      LYS  21 -30.131 -23.251 -16.794
  177    HG3  LYS  21           3HG      LYS  21 -31.139 -21.972 -17.480
  178    HD2  LYS  21           2HD      LYS  21 -29.362 -21.556 -19.219
  179    HD3  LYS  21           3HD      LYS  21 -28.359 -22.792 -18.452
  180    HE2  LYS  21           2HE      LYS  21 -29.374 -23.796 -20.362
  181    HE3  LYS  21           3HE      LYS  21 -30.116 -24.501 -18.924
  182    HZ1  LYS  21           HZ1      LYS  21 -31.324 -22.349 -20.591
  183    HZ2  LYS  21           HZ2      LYS  21 -31.769 -23.918 -20.615
  184    HZ3  LYS  21           HZ3      LYS  21 -32.031 -23.024 -19.278
  185    H    PHE  22           H        PHE  22 -30.205 -18.973 -14.449
  186    HA   PHE  22           HA       PHE  22 -33.073 -18.520 -15.121
  187    HB2  PHE  22           2HB      PHE  22 -33.664 -18.853 -12.890
  188    HB3  PHE  22           3HB      PHE  22 -32.627 -20.162 -13.390
  189    HD1  PHE  22           HD2      PHE  22 -32.672 -16.959 -11.392
  190    HD2  PHE  22           HD1      PHE  22 -30.774 -20.768 -12.057
  191    HE1  PHE  22           HE2      PHE  22 -31.341 -16.650  -9.333
  192    HE2  PHE  22           HE1      PHE  22 -29.457 -20.467  -9.967
  193    HZ   PHE  22           HZ       PHE  22 -29.740 -18.408  -8.605
  194    H    GLU  23           H        GLU  23 -30.462 -16.570 -14.957
  195    HA   GLU  23           HA       GLU  23 -30.804 -14.586 -13.218
  196    HB2  GLU  23           2HB      GLU  23 -28.869 -14.817 -14.707
  197    HB3  GLU  23           3HB      GLU  23 -29.835 -14.333 -16.095
  198    HG2  GLU  23           2HG      GLU  23 -30.020 -12.062 -15.238
  199    HG3  GLU  23           3HG      GLU  23 -29.316 -12.547 -13.687
  200    H    GLY  24           H        GLY  24 -32.777 -14.831 -16.138
  201    HA2  GLY  24           HA2      GLY  24 -34.753 -13.798 -16.726
  202    HA3  GLY  24           HA3      GLY  24 -34.827 -13.180 -15.072
  203    H    GLN  25           H        GLN  25 -32.832 -12.536 -17.980
  204    HA   GLN  25           HA       GLN  25 -32.081  -9.924 -17.287
  205    HB2  GLN  25           2HB      GLN  25 -32.065 -11.369 -19.962
  206    HB3  GLN  25           3HB      GLN  25 -31.264  -9.819 -19.663
  207    HG2  GLN  25           2HG      GLN  25 -29.887 -10.849 -17.880
  208    HG3  GLN  25           3HG      GLN  25 -30.624 -12.419 -18.199
  209   HE21  GLN  25          1HE2      GLN  25 -27.932 -12.339 -18.329
  210   HE22  GLN  25          2HE2      GLN  25 -27.403 -12.401 -20.020
  211    H    SER  26           H        SER  26 -35.165 -10.735 -18.280
  212    HA   SER  26           HA       SER  26 -35.901  -8.228 -19.592
  213    HB2  SER  26           2HB      SER  26 -38.204  -9.104 -19.308
  214    HB3  SER  26           3HB      SER  26 -37.123 -10.244 -20.122
  215    HG   SER  26           HG       SER  26 -38.371 -11.270 -18.490
  216    H    ARG  27           H        ARG  27 -34.658  -8.526 -16.693
  217    HA   ARG  27           HA       ARG  27 -36.349  -7.367 -14.776
  218    HB2  ARG  27           2HB      ARG  27 -33.402  -6.762 -15.094
  219    HB3  ARG  27           3HB      ARG  27 -34.403  -6.468 -13.665
  220    HG2  ARG  27           2HG      ARG  27 -34.971  -9.127 -14.119
  221    HG3  ARG  27           3HG      ARG  27 -33.303  -8.998 -14.738
  222    HD2  ARG  27           2HD      ARG  27 -32.843  -7.827 -12.486
  223    HD3  ARG  27           3HD      ARG  27 -34.377  -8.526 -11.952
  224    HE   ARG  27           HE       ARG  27 -32.942 -10.626 -13.180
  225   HH11  ARG  27          2HH2      ARG  27 -32.659  -8.824 -10.152
  226   HH12  ARG  27          1HH2      ARG  27 -31.620 -10.053  -9.475
  227   HH21  ARG  27          2HH1      ARG  27 -31.781 -12.106 -12.237
  228   HH22  ARG  27          1HH1      ARG  27 -31.164 -11.908 -10.602
  229    H    LYS  28           H        LYS  28 -36.417  -5.241 -13.879
  230    HA   LYS  28           HA       LYS  28 -37.078  -3.289 -16.065
  231    HB2  LYS  28           2HB      LYS  28 -38.566  -3.686 -13.441
  232    HB3  LYS  28           3HB      LYS  28 -39.036  -2.686 -14.788
  233    HG2  LYS  28           2HG      LYS  28 -40.289  -4.411 -15.439
  234    HG3  LYS  28           3HG      LYS  28 -38.821  -5.124 -16.066
  235    HD2  LYS  28           2HD      LYS  28 -38.605  -6.428 -13.913
  236    HD3  LYS  28           3HD      LYS  28 -40.037  -5.588 -13.303
  237    HE2  LYS  28           2HE      LYS  28 -41.008  -7.534 -14.068
  238    HE3  LYS  28           3HE      LYS  28 -41.240  -6.459 -15.439
  239    HZ1  LYS  28           HZ1      LYS  28 -40.403  -8.556 -16.228
  240    HZ2  LYS  28           HZ2      LYS  28 -39.173  -7.496 -16.424
  241    HZ3  LYS  28           HZ3      LYS  28 -39.154  -8.564 -15.188
  242    H    PHE  29           H        PHE  29 -36.571  -1.140 -15.875
  243    HA   PHE  29           HA       PHE  29 -35.610   0.100 -13.453
  244    HB2  PHE  29           2HB      PHE  29 -33.247   0.289 -14.068
  245    HB3  PHE  29           3HB      PHE  29 -33.691  -1.386 -13.891
  246    HD1  PHE  29           HD1      PHE  29 -33.763  -2.935 -15.791
  247    HD2  PHE  29           HD2      PHE  29 -32.505   1.169 -16.240
  248    HE1  PHE  29           HE1      PHE  29 -32.676  -3.506 -17.945
  249    HE2  PHE  29           HE2      PHE  29 -31.410   0.584 -18.398
  250    HZ   PHE  29           HZ       PHE  29 -31.493  -1.747 -19.249
  251    H    ILE  30           H        ILE  30 -34.646   2.181 -13.715
  252    HA   ILE  30           HA       ILE  30 -35.300   3.590 -16.262
  253    HB   ILE  30           HB       ILE  30 -35.622   5.646 -14.707
  254   HG12  ILE  30          2HG1      ILE  30 -36.621   5.287 -12.551
  255   HG13  ILE  30          3HG1      ILE  30 -36.393   3.540 -12.655
  256   HG21  ILE  30          1HG2      ILE  30 -37.999   5.199 -14.640
  257   HG22  ILE  30          2HG2      ILE  30 -37.256   4.638 -16.156
  258   HG23  ILE  30          3HG2      ILE  30 -37.692   3.462 -14.887
  259   HD11  ILE  30          3HD1      ILE  30 -34.106   5.564 -12.637
  260   HD12  ILE  30          1HD1      ILE  30 -34.717   4.719 -11.207
  261   HD13  ILE  30          2HD1      ILE  30 -33.968   3.792 -12.507
  262    H    ILE  31           H        ILE  31 -34.156   5.708 -16.385
  263    HA   ILE  31           HA       ILE  31 -31.450   5.656 -15.157
  264    HB   ILE  31           HB       ILE  31 -32.027   6.761 -17.908
  265   HG12  ILE  31          2HG1      ILE  31 -32.529   4.307 -18.001
  266   HG13  ILE  31          3HG1      ILE  31 -31.175   4.816 -19.018
  267   HG21  ILE  31          1HG2      ILE  31 -30.087   7.652 -16.775
  268   HG22  ILE  31          2HG2      ILE  31 -29.495   6.033 -16.388
  269   HG23  ILE  31          3HG2      ILE  31 -29.537   6.593 -18.084
  270   HD11  ILE  31          3HD1      ILE  31 -30.742   3.705 -16.243
  271   HD12  ILE  31          1HD1      ILE  31 -30.794   2.685 -17.704
  272   HD13  ILE  31          2HD1      ILE  31 -29.546   3.932 -17.528
  273    H    ALA  32           H        ALA  32 -31.326   7.274 -13.869
  274    HA   ALA  32           HA       ALA  32 -32.638   9.860 -14.598
  275    HB1  ALA  32           3HB      ALA  32 -32.726   8.486 -11.896
  276    HB2  ALA  32           1HB      ALA  32 -33.172  10.174 -12.155
  277    HB3  ALA  32           2HB      ALA  32 -34.087   8.870 -12.955
  278    H    ASN  33           H        ASN  33 -31.745  11.796 -13.954
  279    HA   ASN  33           HA       ASN  33 -28.816  11.629 -13.527
  280    HB2  ASN  33           2HB      ASN  33 -28.864  14.105 -13.793
  281    HB3  ASN  33           3HB      ASN  33 -29.349  13.182 -15.193
  282   HD21  ASN  33          2HD2      ASN  33 -29.956  15.618 -15.540
  283   HD22  ASN  33          1HD2      ASN  33 -31.661  15.917 -15.233
  284    H    ALA  34           H        ALA  34 -28.205  11.140 -11.534
  285    HA   ALA  34           HA       ALA  34 -29.697  11.864  -9.196
  286    HB1  ALA  34           3HB      ALA  34 -28.348   9.786  -9.441
  287    HB2  ALA  34           1HB      ALA  34 -26.864  10.768  -9.449
  288    HB3  ALA  34           2HB      ALA  34 -27.890  10.713  -8.006
  289    H    ARG  35           H        ARG  35 -27.662  13.796 -10.978
  290    HA   ARG  35           HA       ARG  35 -26.678  15.392  -8.658
  291    HB2  ARG  35           2HB      ARG  35 -25.941  15.748 -11.574
  292    HB3  ARG  35           3HB      ARG  35 -25.116  16.386 -10.161
  293    HG2  ARG  35           2HG      ARG  35 -25.150  13.549 -11.213
  294    HG3  ARG  35           3HG      ARG  35 -23.784  14.618 -10.980
  295    HD2  ARG  35           2HD      ARG  35 -25.349  13.088  -8.881
  296    HD3  ARG  35           3HD      ARG  35 -23.652  12.912  -9.331
  297    HE   ARG  35           HE       ARG  35 -23.826  15.515  -8.403
  298   HH11  ARG  35          1HH1      ARG  35 -24.410  12.329  -7.016
  299   HH12  ARG  35          2HH1      ARG  35 -24.127  12.905  -5.391
  300   HH21  ARG  35          1HH2      ARG  35 -23.456  16.149  -6.299
  301   HH22  ARG  35          2HH2      ARG  35 -23.565  14.992  -5.007
  302    H    VAL  36           H        VAL  36 -29.402  15.478 -10.525
  303    HA   VAL  36           HA       VAL  36 -29.567  18.447 -10.627
  304    HB   VAL  36           HB       VAL  36 -30.096  16.843 -12.634
  305   HG11  VAL  36          1HG1      VAL  36 -32.464  16.375 -12.947
  306   HG12  VAL  36          2HG1      VAL  36 -31.853  15.502 -11.526
  307   HG13  VAL  36          3HG1      VAL  36 -32.849  16.970 -11.343
  308   HG21  VAL  36          3HG2      VAL  36 -31.880  19.214 -12.012
  309   HG22  VAL  36          1HG2      VAL  36 -30.234  19.276 -12.700
  310   HG23  VAL  36          2HG2      VAL  36 -31.533  18.497 -13.608
  311    H    GLU  37           H        GLU  37 -31.112  19.600  -9.465
  312    HA   GLU  37           HA       GLU  37 -31.760  18.653  -6.932
  313    HB2  GLU  37           2HB      GLU  37 -33.089  20.658  -6.667
  314    HB3  GLU  37           3HB      GLU  37 -31.590  21.002  -7.531
  315    HG2  GLU  37           2HG      GLU  37 -32.862  21.012  -9.690
  316    HG3  GLU  37           3HG      GLU  37 -34.353  20.718  -8.794
  317    H    ASN  38           H        ASN  38 -33.762  18.242  -9.784
  318    HA   ASN  38           HA       ASN  38 -36.043  17.212  -8.205
  319    HB2  ASN  38           2HB      ASN  38 -36.300  18.786 -10.161
  320    HB3  ASN  38           3HB      ASN  38 -35.736  17.491 -11.222
  321   HD21  ASN  38          2HD2      ASN  38 -38.262  18.233  -8.745
  322   HD22  ASN  38          1HD2      ASN  38 -39.483  17.239  -9.524
  323    H    CYS  39           H        CYS  39 -33.204  15.827  -9.420
  324    HA   CYS  39           HA       CYS  39 -32.531  13.753 -10.103
  325    HB2  CYS  39           2HB      CYS  39 -34.382  13.178  -7.774
  326    HB3  CYS  39           3HB      CYS  39 -33.295  11.963  -8.462
  327    HG   CYS  39           HG       CYS  39 -32.242  15.004  -7.684
  328    H    ALA  40           H        ALA  40 -33.927  14.312 -12.194
  329    HA   ALA  40           HA       ALA  40 -36.320  12.632 -12.376
  330    HB1  ALA  40           3HB      ALA  40 -36.428  15.026 -12.938
  331    HB2  ALA  40           1HB      ALA  40 -35.337  14.735 -14.316
  332    HB3  ALA  40           2HB      ALA  40 -36.950  13.976 -14.255
  333    H    VAL  41           H        VAL  41 -36.924  11.464 -14.200
  334    HA   VAL  41           HA       VAL  41 -35.013   9.485 -15.057
  335    HB   VAL  41           HB       VAL  41 -37.993   9.855 -15.567
  336   HG11  VAL  41          1HG1      VAL  41 -37.033   8.399 -17.325
  337   HG12  VAL  41          2HG1      VAL  41 -36.216   7.436 -16.078
  338   HG13  VAL  41          3HG1      VAL  41 -37.989   7.451 -16.188
  339   HG21  VAL  41          3HG2      VAL  41 -38.275   8.077 -13.904
  340   HG22  VAL  41          1HG2      VAL  41 -36.514   7.987 -13.656
  341   HG23  VAL  41          2HG2      VAL  41 -37.421   9.434 -13.178
  342    H    ILE  42           H        ILE  42 -33.611  10.430 -16.407
  343    HA   ILE  42           HA       ILE  42 -34.324  11.981 -18.770
  344    HB   ILE  42           HB       ILE  42 -31.926  11.776 -19.306
  345   HG12  ILE  42          2HG1      ILE  42 -31.669  10.135 -16.742
  346   HG13  ILE  42          3HG1      ILE  42 -31.565   9.463 -18.372
  347   HG21  ILE  42          1HG2      ILE  42 -31.131  13.163 -17.484
  348   HG22  ILE  42          2HG2      ILE  42 -32.837  13.531 -17.745
  349   HG23  ILE  42          3HG2      ILE  42 -32.353  12.509 -16.375
  350   HD11  ILE  42          3HD1      ILE  42 -29.611  10.938 -18.811
  351   HD12  ILE  42          1HD1      ILE  42 -29.656  11.427 -17.090
  352   HD13  ILE  42          2HD1      ILE  42 -29.370   9.735 -17.529
  353    H    TYR  43           H        TYR  43 -34.011   8.595 -18.031
  354    HA   TYR  43           HA       TYR  43 -34.991   7.860 -20.680
  355    HB2  TYR  43           2HB      TYR  43 -32.355   8.049 -20.838
  356    HB3  TYR  43           3HB      TYR  43 -32.375   6.525 -19.997
  357    HD1  TYR  43           HD2      TYR  43 -33.822   8.249 -22.991
  358    HD2  TYR  43           HD1      TYR  43 -32.654   4.496 -21.201
  359    HE1  TYR  43           HE2      TYR  43 -34.267   7.073 -25.148
  360    HE2  TYR  43           HE1      TYR  43 -33.099   3.331 -23.351
  361    HH   TYR  43           HH       TYR  43 -33.777   3.542 -25.531
  362    H    CYS  44           H        CYS  44 -35.477   5.494 -20.906
  363    HA   CYS  44           HA       CYS  44 -35.858   4.182 -18.285
  364    HB2  CYS  44           2HB      CYS  44 -38.250   3.833 -18.800
  365    HB3  CYS  44           3HB      CYS  44 -37.848   5.552 -18.623
  366    HG   CYS  44           HG       CYS  44 -39.642   5.205 -20.548
  367    H    ASN  45           H        ASN  45 -36.243   1.929 -18.321
  368    HA   ASN  45           HA       ASN  45 -35.642   0.609 -20.908
  369    HB2  ASN  45           2HB      ASN  45 -34.466  -0.073 -18.789
  370    HB3  ASN  45           3HB      ASN  45 -35.985  -0.788 -18.244
  371   HD21  ASN  45          2HD2      ASN  45 -35.691  -3.050 -18.538
  372   HD22  ASN  45          1HD2      ASN  45 -35.088  -3.725 -20.029
  373    H    ASP  46           H        ASP  46 -36.943  -0.951 -21.804
  374    HA   ASP  46           HA       ASP  46 -39.744  -0.290 -21.831
  375    HB2  ASP  46           2HB      ASP  46 -38.336  -1.234 -23.731
  376    HB3  ASP  46           3HB      ASP  46 -38.441  -2.809 -22.938
  377    H    GLY  47           H        GLY  47 -37.890  -2.794 -20.144
  378    HA2  GLY  47           HA2      GLY  47 -39.886  -4.446 -19.103
  379    HA3  GLY  47           HA3      GLY  47 -38.415  -3.970 -18.240
  380    H    PHE  48           H        PHE  48 -38.803  -1.266 -17.659
  381    HA   PHE  48           HA       PHE  48 -40.766  -1.461 -15.552
  382    HB2  PHE  48           2HB      PHE  48 -39.350  -0.090 -14.648
  383    HB3  PHE  48           3HB      PHE  48 -38.562   0.250 -16.165
  384    HD1  PHE  48           HD1      PHE  48 -39.157   2.253 -17.521
  385    HD2  PHE  48           HD2      PHE  48 -41.019   1.426 -13.723
  386    HE1  PHE  48           HE1      PHE  48 -39.897   4.616 -17.339
  387    HE2  PHE  48           HE2      PHE  48 -41.777   3.775 -13.570
  388    HZ   PHE  48           HZ       PHE  48 -41.206   5.383 -15.377
  389    H    CYS  49           H        CYS  49 -40.853  -0.193 -18.785
  390    HA   CYS  49           HA       CYS  49 -43.288   1.361 -18.591
  391    HB2  CYS  49           2HB      CYS  49 -41.559   1.452 -20.452
  392    HB3  CYS  49           3HB      CYS  49 -42.198  -0.103 -21.027
  393    HG   CYS  49           HG       CYS  49 -43.177   1.718 -22.541
  394    H    GLU  50           H        GLU  50 -42.577  -2.117 -19.205
  395    HA   GLU  50           HA       GLU  50 -45.429  -2.814 -19.442
  396    HB2  GLU  50           2HB      GLU  50 -42.997  -4.596 -19.048
  397    HB3  GLU  50           3HB      GLU  50 -44.626  -5.121 -19.480
  398    HG2  GLU  50           2HG      GLU  50 -44.489  -3.714 -21.561
  399    HG3  GLU  50           3HG      GLU  50 -42.801  -3.386 -21.188
  400    H    LEU  51           H        LEU  51 -43.000  -2.846 -16.869
  401    HA   LEU  51           HA       LEU  51 -44.294  -4.245 -14.822
  402    HB2  LEU  51           2HB      LEU  51 -42.020  -3.367 -14.733
  403    HB3  LEU  51           3HB      LEU  51 -42.638  -1.731 -14.757
  404    HG   LEU  51           HG       LEU  51 -43.689  -1.964 -12.593
  405   HD11  LEU  51          1HD1      LEU  51 -42.134  -4.581 -12.421
  406   HD12  LEU  51          2HD1      LEU  51 -43.023  -3.780 -11.104
  407   HD13  LEU  51          3HD1      LEU  51 -43.909  -4.427 -12.489
  408   HD21  LEU  51          3HD2      LEU  51 -40.696  -2.477 -12.715
  409   HD22  LEU  51          1HD2      LEU  51 -41.511  -0.900 -12.832
  410   HD23  LEU  51          2HD2      LEU  51 -41.577  -1.815 -11.319
  411    H    CYS  52           H        CYS  52 -44.466  -0.717 -15.511
  412    HA   CYS  52           HA       CYS  52 -46.751  -0.373 -13.724
  413    HB2  CYS  52           2HB      CYS  52 -45.583   1.605 -15.727
  414    HB3  CYS  52           3HB      CYS  52 -46.582   1.951 -14.299
  415    HG   CYS  52           HG       CYS  52 -43.485   0.841 -14.571
  416    H    GLY  53           H        GLY  53 -46.284  -0.816 -17.178
  417    HA2  GLY  53           HA2      GLY  53 -47.798  -1.636 -18.727
  418    HA3  GLY  53           HA3      GLY  53 -49.125  -1.429 -17.588
  419    H    TYR  54           H        TYR  54 -47.120   1.366 -18.227
  420    HA   TYR  54           HA       TYR  54 -49.398   2.663 -19.644
  421    HB2  TYR  54           2HB      TYR  54 -47.154   3.914 -18.051
  422    HB3  TYR  54           3HB      TYR  54 -48.464   4.780 -18.850
  423    HD1  TYR  54           HD1      TYR  54 -50.929   3.959 -18.234
  424    HD2  TYR  54           HD2      TYR  54 -47.432   3.445 -15.766
  425    HE1  TYR  54           HE1      TYR  54 -52.383   3.657 -16.230
  426    HE2  TYR  54           HE2      TYR  54 -48.887   3.108 -13.769
  427    HH   TYR  54           HH       TYR  54 -51.033   3.007 -12.979
  428    H    SER  55           H        SER  55 -46.673   4.583 -20.073
  429    HA   SER  55           HA       SER  55 -45.698   3.398 -22.573
  430    HB2  SER  55           2HB      SER  55 -47.838   4.388 -23.305
  431    HB3  SER  55           3HB      SER  55 -47.358   5.952 -22.614
  432    HG   SER  55           HG       SER  55 -46.935   5.706 -24.913
  433    H    ARG  56           H        ARG  56 -43.779   4.291 -23.221
  434    HA   ARG  56           HA       ARG  56 -42.163   5.637 -21.312
  435    HB2  ARG  56           2HB      ARG  56 -40.434   5.549 -22.971
  436    HB3  ARG  56           3HB      ARG  56 -41.391   4.076 -23.071
  437    HG2  ARG  56           2HG      ARG  56 -42.675   5.402 -25.010
  438    HG3  ARG  56           3HG      ARG  56 -41.227   6.410 -24.990
  439    HD2  ARG  56           2HD      ARG  56 -40.765   4.825 -26.635
  440    HD3  ARG  56           3HD      ARG  56 -39.899   4.187 -25.243
  441    HE   ARG  56           HE       ARG  56 -42.500   3.211 -26.386
  442   HH11  ARG  56          2HH1      ARG  56 -39.770   2.398 -24.271
  443   HH12  ARG  56          1HH1      ARG  56 -40.389   0.744 -24.131
  444   HH21  ARG  56          2HH2      ARG  56 -43.085   1.062 -26.046
  445   HH22  ARG  56          1HH2      ARG  56 -42.040   0.080 -25.015
  446    H    ALA  57           H        ALA  57 -44.056   6.975 -23.942
  447    HA   ALA  57           HA       ALA  57 -42.978   9.618 -24.004
  448    HB1  ALA  57           3HB      ALA  57 -45.108  10.149 -25.141
  449    HB2  ALA  57           1HB      ALA  57 -44.420   8.633 -25.756
  450    HB3  ALA  57           2HB      ALA  57 -45.789   8.593 -24.618
  451    H    GLU  58           H        GLU  58 -44.832   8.059 -21.526
  452    HA   GLU  58           HA       GLU  58 -45.764  10.602 -20.331
  453    HB2  GLU  58           2HB      GLU  58 -46.369   7.718 -19.579
  454    HB3  GLU  58           3HB      GLU  58 -47.029   9.163 -18.832
  455    HG2  GLU  58           2HG      GLU  58 -48.032   9.831 -21.026
  456    HG3  GLU  58           3HG      GLU  58 -47.453   8.322 -21.732
  457    H    VAL  59           H        VAL  59 -43.109   8.298 -20.027
  458    HA   VAL  59           HA       VAL  59 -42.756   8.974 -17.145
  459    HB   VAL  59           HB       VAL  59 -41.212   7.282 -16.934
  460   HG11  VAL  59          1HG1      VAL  59 -43.191   6.192 -18.970
  461   HG12  VAL  59          2HG1      VAL  59 -42.360   5.288 -17.704
  462   HG13  VAL  59          3HG1      VAL  59 -43.556   6.513 -17.259
  463   HG21  VAL  59          3HG2      VAL  59 -39.642   7.478 -18.660
  464   HG22  VAL  59          1HG2      VAL  59 -40.404   5.906 -18.944
  465   HG23  VAL  59          2HG2      VAL  59 -40.858   7.282 -19.931
  466    H    MET  60           H        MET  60 -41.544   9.985 -20.183
  467    HA   MET  60           HA       MET  60 -38.922  10.778 -19.691
  468    HB2  MET  60           2HB      MET  60 -41.083  12.201 -21.308
  469    HB3  MET  60           3HB      MET  60 -39.377  12.650 -21.325
  470    HG2  MET  60           2HG      MET  60 -40.522  10.015 -22.253
  471    HG3  MET  60           3HG      MET  60 -39.951  11.329 -23.253
  472    HE1  MET  60           3HE      MET  60 -38.670   8.717 -20.458
  473    HE2  MET  60           1HE      MET  60 -39.161   7.957 -21.987
  474    HE3  MET  60           2HE      MET  60 -37.454   7.951 -21.496
  475    H    GLN  61           H        GLN  61 -38.129  11.791 -18.084
  476    HA   GLN  61           HA       GLN  61 -37.504  13.408 -16.716
  477    HB2  GLN  61           2HB      GLN  61 -39.507  15.313 -17.899
  478    HB3  GLN  61           3HB      GLN  61 -37.972  15.690 -17.147
  479    HG2  GLN  61           2HG      GLN  61 -36.749  15.245 -19.039
  480    HG3  GLN  61           3HG      GLN  61 -37.751  13.944 -19.599
  481   HE21  GLN  61          1HE2      GLN  61 -40.142  14.651 -20.172
  482   HE22  GLN  61          2HE2      GLN  61 -40.147  15.976 -21.324
  483    H    ARG  62           H        ARG  62 -39.977  11.636 -15.959
  484    HA   ARG  62           HA       ARG  62 -41.165  13.225 -13.796
  485    HB2  ARG  62           2HB      ARG  62 -41.053  10.290 -14.593
  486    HB3  ARG  62           3HB      ARG  62 -41.432  10.680 -12.929
  487    HG2  ARG  62           2HG      ARG  62 -43.461  10.388 -14.033
  488    HG3  ARG  62           3HG      ARG  62 -43.319  12.102 -13.643
  489    HD2  ARG  62           2HD      ARG  62 -42.705  10.940 -16.374
  490    HD3  ARG  62           3HD      ARG  62 -44.325  11.447 -15.877
  491    HE   ARG  62           HE       ARG  62 -42.245  13.481 -15.561
  492   HH11  ARG  62          1HH2      ARG  62 -44.474  12.173 -17.892
  493   HH12  ARG  62          2HH2      ARG  62 -44.681  13.709 -18.713
  494   HH21  ARG  62          1HH1      ARG  62 -42.541  15.424 -16.628
  495   HH22  ARG  62          2HH1      ARG  62 -43.568  15.486 -18.028
  496    HA   PRO  63           HA       PRO  63 -37.877  12.905 -10.778
  497    HB2  PRO  63           2HB      PRO  63 -39.236  12.651  -8.423
  498    HB3  PRO  63           3HB      PRO  63 -39.147  14.188  -9.335
  499    HG2  PRO  63           2HG      PRO  63 -41.374  12.122  -9.385
  500    HG3  PRO  63           3HG      PRO  63 -41.516  13.897  -9.170
  501    HD2  PRO  63           2HD      PRO  63 -41.883  12.722 -11.589
  502    HD3  PRO  63           3HD      PRO  63 -41.056  14.303 -11.456
  503    H    CYS  64           H        CYS  64 -36.654  11.182 -10.033
  504    HA   CYS  64           HA       CYS  64 -37.490   8.488 -10.513
  505    HB2  CYS  64           2HB      CYS  64 -35.158   9.423 -10.604
  506    HB3  CYS  64           3HB      CYS  64 -35.154   9.491  -8.837
  507    HG   CYS  64           HG       CYS  64 -35.883   6.863  -8.653
  508    H    THR  65           H        THR  65 -38.162  10.512  -7.773
  509    HA   THR  65           HA       THR  65 -38.643   8.519  -5.809
  510    HB   THR  65           HB       THR  65 -40.466  10.818  -5.642
  511    HG1  THR  65           HG1      THR  65 -38.886  12.356  -5.374
  512   HG21  THR  65          1HG2      THR  65 -38.130   9.914  -3.924
  513   HG22  THR  65          2HG2      THR  65 -39.394  11.078  -3.471
  514   HG23  THR  65          3HG2      THR  65 -39.817   9.380  -3.742
  515    H    CYS  66           H        CYS  66 -39.517   6.835  -6.858
  516    HA   CYS  66           HA       CYS  66 -41.709   6.580  -8.464
  517    HB2  CYS  66           2HB      CYS  66 -41.815   4.235  -7.635
  518    HB3  CYS  66           3HB      CYS  66 -40.190   4.780  -8.072
  519    HG   CYS  66           HG       CYS  66 -39.973   3.250  -5.987
  520    H    ASP  67           H        ASP  67 -41.974   7.624  -5.241
  521    HA   ASP  67           HA       ASP  67 -44.579   6.992  -4.443
  522    HB2  ASP  67           2HB      ASP  67 -42.926   8.343  -3.183
  523    HB3  ASP  67           3HB      ASP  67 -43.146   9.660  -4.332
  524    H    PHE  68           H        PHE  68 -43.567   9.137  -7.120
  525    HA   PHE  68           HA       PHE  68 -46.079  10.333  -7.628
  526    HB2  PHE  68           2HB      PHE  68 -45.265  11.004  -9.665
  527    HB3  PHE  68           3HB      PHE  68 -43.811  10.833  -8.714
  528    HD1  PHE  68           HD1      PHE  68 -45.878   9.326 -11.433
  529    HD2  PHE  68           HD2      PHE  68 -42.052   9.314  -9.456
  530    HE1  PHE  68           HE1      PHE  68 -44.941   7.917 -13.245
  531    HE2  PHE  68           HE2      PHE  68 -41.120   7.897 -11.255
  532    HZ   PHE  68           HZ       PHE  68 -42.562   7.190 -13.158
  533    H    LEU  69           H        LEU  69 -45.248   6.996  -8.090
  534    HA   LEU  69           HA       LEU  69 -47.908   6.481  -9.289
  535    HB2  LEU  69           2HB      LEU  69 -46.996   4.651 -10.616
  536    HB3  LEU  69           3HB      LEU  69 -46.398   6.233 -11.060
  537    HG   LEU  69           HG       LEU  69 -44.226   5.746  -9.916
  538   HD11  LEU  69          1HD1      LEU  69 -43.654   3.372  -9.438
  539   HD12  LEU  69          2HD1      LEU  69 -44.868   3.976  -8.315
  540   HD13  LEU  69          3HD1      LEU  69 -45.359   2.921  -9.656
  541   HD21  LEU  69          3HD2      LEU  69 -45.100   3.719 -12.011
  542   HD22  LEU  69          1HD2      LEU  69 -44.572   5.379 -12.338
  543   HD23  LEU  69          2HD2      LEU  69 -43.430   4.214 -11.657
  544    H    HIS  70           H        HIS  70 -46.862   6.392  -6.372
  545    HA   HIS  70           HA       HIS  70 -47.190   3.610  -5.633
  546    HB2  HIS  70           2HB      HIS  70 -47.256   6.212  -4.095
  547    HB3  HIS  70           3HB      HIS  70 -47.650   4.678  -3.332
  548    HD2  HIS  70           HD2      HIS  70 -45.301   5.788  -1.997
  549    HE1  HIS  70           HE1      HIS  70 -42.727   3.568  -4.580
  550    HE2  HIS  70           HE2      HIS  70 -42.860   4.846  -2.378
  551    H    GLY  71           H        GLY  71 -48.849   2.623  -4.439
  552    HA2  GLY  71           HA2      GLY  71 -51.611   3.438  -5.297
  553    HA3  GLY  71           HA3      GLY  71 -50.977   1.806  -5.445
  554    HA   PRO  72           HA       PRO  72 -53.398   2.522  -1.505
  555    HB2  PRO  72           2HB      PRO  72 -55.227   0.467  -1.721
  556    HB3  PRO  72           3HB      PRO  72 -55.407   2.064  -2.506
  557    HG2  PRO  72           2HG      PRO  72 -54.276  -0.483  -3.721
  558    HG3  PRO  72           3HG      PRO  72 -55.553   0.587  -4.389
  559    HD2  PRO  72           2HD      PRO  72 -53.002   0.847  -5.202
  560    HD3  PRO  72           3HD      PRO  72 -53.979   2.306  -4.873
  561    H    ARG  73           H        ARG  73 -51.497  -0.161  -2.575
  562    HA   ARG  73           HA       ARG  73 -51.426  -1.387   0.143
  563    HB2  ARG  73           2HB      ARG  73 -51.626  -2.849  -1.834
  564    HB3  ARG  73           3HB      ARG  73 -50.144  -2.175  -2.504
  565    HG2  ARG  73           2HG      ARG  73 -49.827  -4.417  -1.567
  566    HG3  ARG  73           3HG      ARG  73 -48.786  -3.212  -0.832
  567    HD2  ARG  73           2HD      ARG  73 -50.447  -3.096   1.115
  568    HD3  ARG  73           3HD      ARG  73 -51.326  -4.418   0.350
  569    HE   ARG  73           HE       ARG  73 -49.722  -5.903   1.106
  570   HH11  ARG  73          1HH2      ARG  73 -48.302  -2.696   1.386
  571   HH12  ARG  73          2HH2      ARG  73 -46.973  -3.292   2.355
  572   HH21  ARG  73          1HH1      ARG  73 -47.990  -6.570   2.315
  573   HH22  ARG  73          2HH1      ARG  73 -46.801  -5.425   2.851
  574    H    THR  74           H        THR  74 -49.797   1.148  -1.475
  575    HA   THR  74           HA       THR  74 -47.159   0.428  -0.529
  576    HB   THR  74           HB       THR  74 -47.833   3.150  -1.642
  577    HG1  THR  74           HG1      THR  74 -46.991   1.410  -3.503
  578   HG21  THR  74          1HG2      THR  74 -45.558   3.041  -1.061
  579   HG22  THR  74          2HG2      THR  74 -45.410   1.323  -1.469
  580   HG23  THR  74          3HG2      THR  74 -45.523   2.518  -2.751
  581    H    GLN  75           H        GLN  75 -45.878   1.233   1.004
  582    HA   GLN  75           HA       GLN  75 -47.249   2.692   3.183
  583    HB2  GLN  75           2HB      GLN  75 -44.528   1.362   3.253
  584    HB3  GLN  75           3HB      GLN  75 -45.503   1.937   4.606
  585    HG2  GLN  75           2HG      GLN  75 -46.108  -0.456   2.833
  586    HG3  GLN  75           3HG      GLN  75 -45.536  -0.457   4.497
  587   HE21  GLN  75          2HE2      GLN  75 -48.432  -0.315   2.481
  588   HE22  GLN  75          1HE2      GLN  75 -49.528  -0.124   3.839
  589    H    ARG  76           H        ARG  76 -46.682   4.602   3.961
  590    HA   ARG  76           HA       ARG  76 -45.145   6.371   2.247
  591    HB2  ARG  76           2HB      ARG  76 -46.229   7.018   4.979
  592    HB3  ARG  76           3HB      ARG  76 -45.739   8.146   3.714
  593    HG2  ARG  76           2HG      ARG  76 -48.176   6.357   3.805
  594    HG3  ARG  76           3HG      ARG  76 -48.116   8.106   3.659
  595    HD2  ARG  76           2HD      ARG  76 -47.410   6.030   1.533
  596    HD3  ARG  76           3HD      ARG  76 -48.843   7.036   1.565
  597    HE   ARG  76           HE       ARG  76 -46.302   7.705   0.432
  598   HH11  ARG  76          1HH1      ARG  76 -48.899   9.354   2.120
  599   HH12  ARG  76          2HH1      ARG  76 -48.638  10.824   1.222
  600   HH21  ARG  76          2HH2      ARG  76 -46.156   9.506  -0.771
  601   HH22  ARG  76          1HH2      ARG  76 -47.078  10.921  -0.335
  602    H    ARG  77           H        ARG  77 -44.451   4.817   5.366
  603    HA   ARG  77           HA       ARG  77 -41.849   5.885   5.780
  604    HB2  ARG  77           2HB      ARG  77 -41.372   3.900   7.055
  605    HB3  ARG  77           3HB      ARG  77 -43.009   4.493   7.392
  606    HG2  ARG  77           2HG      ARG  77 -43.905   2.688   5.899
  607    HG3  ARG  77           3HG      ARG  77 -42.259   2.045   5.733
  608    HD2  ARG  77           2HD      ARG  77 -42.137   1.732   8.179
  609    HD3  ARG  77           3HD      ARG  77 -43.770   2.379   8.359
  610    HE   ARG  77           HE       ARG  77 -42.992  -0.290   7.444
  611   HH11  ARG  77          1HH1      ARG  77 -45.673   1.978   7.569
  612   HH12  ARG  77          2HH1      ARG  77 -46.817   0.753   7.071
  613   HH21  ARG  77          1HH2      ARG  77 -44.577  -1.830   7.139
  614   HH22  ARG  77          2HH2      ARG  77 -46.249  -1.342   7.079
  615    H    ALA  78           H        ALA  78 -42.817   3.302   3.559
  616    HA   ALA  78           HA       ALA  78 -40.156   2.587   2.687
  617    HB1  ALA  78           3HB      ALA  78 -42.109   1.089   2.377
  618    HB2  ALA  78           1HB      ALA  78 -42.835   2.234   1.221
  619    HB3  ALA  78           2HB      ALA  78 -41.330   1.462   0.852
  620    H    ALA  79           H        ALA  79 -42.718   4.715   1.327
  621    HA   ALA  79           HA       ALA  79 -41.199   5.738  -0.871
  622    HB1  ALA  79           3HB      ALA  79 -43.013   7.315  -1.053
  623    HB2  ALA  79           1HB      ALA  79 -43.723   5.805  -0.423
  624    HB3  ALA  79           2HB      ALA  79 -43.418   7.164   0.667
  625    H    ALA  80           H        ALA  80 -41.470   6.902   2.458
  626    HA   ALA  80           HA       ALA  80 -40.048   9.348   2.157
  627    HB1  ALA  80           3HB      ALA  80 -40.562   7.587   4.586
  628    HB2  ALA  80           1HB      ALA  80 -40.006   9.277   4.632
  629    HB3  ALA  80           2HB      ALA  80 -41.614   8.888   3.984
  630    H    GLN  81           H        GLN  81 -38.912   6.144   3.493
  631    HA   GLN  81           HA       GLN  81 -36.190   6.799   3.696
  632    HB2  GLN  81           2HB      GLN  81 -37.270   4.721   4.515
  633    HB3  GLN  81           3HB      GLN  81 -37.368   4.133   2.854
  634    HG2  GLN  81           2HG      GLN  81 -35.474   3.127   4.027
  635    HG3  GLN  81           3HG      GLN  81 -34.886   4.140   2.717
  636   HE21  GLN  81          2HE2      GLN  81 -33.811   6.149   3.218
  637   HE22  GLN  81          1HE2      GLN  81 -33.156   6.397   4.838
  638    H    ILE  82           H        ILE  82 -37.995   5.790   0.745
  639    HA   ILE  82           HA       ILE  82 -35.671   5.857  -0.966
  640    HB   ILE  82           HB       ILE  82 -38.640   6.029  -1.442
  641   HG12  ILE  82          2HG1      ILE  82 -36.520   4.042  -2.381
  642   HG13  ILE  82          3HG1      ILE  82 -37.320   3.916  -0.810
  643   HG21  ILE  82          1HG2      ILE  82 -38.129   5.970  -3.911
  644   HG22  ILE  82          2HG2      ILE  82 -37.732   7.505  -3.134
  645   HG23  ILE  82          3HG2      ILE  82 -36.433   6.355  -3.515
  646   HD11  ILE  82          3HD1      ILE  82 -38.697   3.798  -3.491
  647   HD12  ILE  82          1HD1      ILE  82 -38.457   2.488  -2.320
  648   HD13  ILE  82          2HD1      ILE  82 -39.518   3.865  -1.904
  649    H    ALA  83           H        ALA  83 -38.135   8.416  -0.309
  650    HA   ALA  83           HA       ALA  83 -36.931  10.485  -1.767
  651    HB1  ALA  83           3HB      ALA  83 -38.094  11.999  -0.252
  652    HB2  ALA  83           1HB      ALA  83 -39.134  10.597  -0.627
  653    HB3  ALA  83           2HB      ALA  83 -38.301  10.712   0.941
  654    H    GLN  84           H        GLN  84 -36.029   9.265   1.452
  655    HA   GLN  84           HA       GLN  84 -34.043  11.281   2.029
  656    HB2  GLN  84           2HB      GLN  84 -33.977   8.481   3.126
  657    HB3  GLN  84           3HB      GLN  84 -33.209   9.921   3.744
  658    HG2  GLN  84           2HG      GLN  84 -36.052   9.086   3.991
  659    HG3  GLN  84           3HG      GLN  84 -34.949   9.578   5.219
  660   HE21  GLN  84          1HE2      GLN  84 -37.420  10.632   3.070
  661   HE22  GLN  84          2HE2      GLN  84 -37.361  12.345   3.511
  662    H    ALA  85           H        ALA  85 -33.928   8.125   0.322
  663    HA   ALA  85           HA       ALA  85 -31.053   8.239  -0.083
  664    HB1  ALA  85           3HB      ALA  85 -31.463   6.371  -1.641
  665    HB2  ALA  85           1HB      ALA  85 -32.317   6.108  -0.105
  666    HB3  ALA  85           2HB      ALA  85 -33.207   6.646  -1.545
  667    H    LEU  86           H        LEU  86 -33.802   9.563  -1.846
  668    HA   LEU  86           HA       LEU  86 -32.158  10.216  -4.150
  669    HB2  LEU  86           2HB      LEU  86 -34.920  11.276  -3.524
  670    HB3  LEU  86           3HB      LEU  86 -34.069  11.287  -5.059
  671    HG   LEU  86           HG       LEU  86 -35.563   9.079  -3.700
  672   HD11  LEU  86          1HD1      LEU  86 -35.066   9.784  -6.610
  673   HD12  LEU  86          2HD1      LEU  86 -36.276   8.648  -5.968
  674   HD13  LEU  86          3HD1      LEU  86 -36.401  10.388  -5.616
  675   HD21  LEU  86          3HD2      LEU  86 -34.537   7.335  -5.128
  676   HD22  LEU  86          1HD2      LEU  86 -33.249   8.467  -5.611
  677   HD23  LEU  86          2HD2      LEU  86 -33.391   7.896  -3.934
  678    H    LEU  87           H        LEU  87 -33.384  12.135  -1.396
  679    HA   LEU  87           HA       LEU  87 -31.986  14.544  -2.274
  680    HB2  LEU  87           2HB      LEU  87 -32.272  15.376   0.009
  681    HB3  LEU  87           3HB      LEU  87 -33.762  14.901  -0.804
  682    HG   LEU  87           HG       LEU  87 -33.178  12.650   0.658
  683   HD11  LEU  87          1HD1      LEU  87 -31.290  13.746   1.835
  684   HD12  LEU  87          2HD1      LEU  87 -32.402  15.010   2.401
  685   HD13  LEU  87          3HD1      LEU  87 -32.637  13.329   2.922
  686   HD21  LEU  87          3HD2      LEU  87 -34.924  13.459   2.231
  687   HD22  LEU  87          1HD2      LEU  87 -34.725  15.107   1.597
  688   HD23  LEU  87          2HD2      LEU  87 -35.361  13.818   0.555
  689    H    GLY  88           H        GLY  88 -30.988  11.677  -0.455
  690    HA2  GLY  88           HA2      GLY  88 -28.728  10.990  -0.831
  691    HA3  GLY  88           HA3      GLY  88 -28.173  12.659  -0.809
  692    H    ALA  89           H        ALA  89 -30.439  11.695   1.703
  693    HA   ALA  89           HA       ALA  89 -28.657  12.206   3.868
  694    HB1  ALA  89           3HB      ALA  89 -30.323  11.016   5.250
  695    HB2  ALA  89           1HB      ALA  89 -31.092  12.157   4.137
  696    HB3  ALA  89           2HB      ALA  89 -31.102  10.411   3.778
  697    H    GLU  90           H        GLU  90 -29.654   9.119   2.399
  698    HA   GLU  90           HA       GLU  90 -26.993   8.038   2.416
  699    HB2  GLU  90           2HB      GLU  90 -27.594   5.893   3.526
  700    HB3  GLU  90           3HB      GLU  90 -27.372   7.252   4.622
  701    HG2  GLU  90           2HG      GLU  90 -29.785   7.496   4.935
  702    HG3  GLU  90           3HG      GLU  90 -30.120   6.266   3.723
  703    H    GLU  91           H        GLU  91 -26.783   6.664   0.676
  704    HA   GLU  91           HA       GLU  91 -29.168   6.136  -1.033
  705    HB2  GLU  91           2HB      GLU  91 -26.202   5.548  -1.352
  706    HB3  GLU  91           3HB      GLU  91 -27.446   4.819  -2.355
  707    HG2  GLU  91           2HG      GLU  91 -27.208   6.656  -3.677
  708    HG3  GLU  91           3HG      GLU  91 -28.287   7.394  -2.523
  709    H    ARG  92           H        ARG  92 -30.409   4.560  -0.746
  710    HA   ARG  92           HA       ARG  92 -29.578   2.070   0.682
  711    HB2  ARG  92           2HB      ARG  92 -30.410   3.922   2.241
  712    HB3  ARG  92           3HB      ARG  92 -31.960   3.839   1.418
  713    HG2  ARG  92           2HG      ARG  92 -32.122   2.626   3.464
  714    HG3  ARG  92           3HG      ARG  92 -32.167   1.438   2.158
  715    HD2  ARG  92           2HD      ARG  92 -29.819   0.853   2.557
  716    HD3  ARG  92           3HD      ARG  92 -29.651   2.147   3.736
  717    HE   ARG  92           HE       ARG  92 -31.051  -0.439   4.073
  718   HH11  ARG  92          1HH2      ARG  92 -30.305   2.668   5.635
  719   HH12  ARG  92          2HH2      ARG  92 -30.797   2.046   7.185
  720   HH21  ARG  92          2HH1      ARG  92 -31.614  -1.098   6.100
  721   HH22  ARG  92          1HH1      ARG  92 -31.498  -0.001   7.443
  722    H    LYS  93           H        LYS  93 -30.557   0.263   0.053
  723    HA   LYS  93           HA       LYS  93 -32.606   0.264  -2.087
  724    HB2  LYS  93           2HB      LYS  93 -30.741  -1.276  -2.238
  725    HB3  LYS  93           3HB      LYS  93 -31.217  -2.022  -0.689
  726    HG2  LYS  93           2HG      LYS  93 -33.489  -2.484  -1.900
  727    HG3  LYS  93           3HG      LYS  93 -32.612  -2.061  -3.374
  728    HD2  LYS  93           2HD      LYS  93 -31.838  -4.241  -1.403
  729    HD3  LYS  93           3HD      LYS  93 -32.678  -4.494  -2.940
  730    HE2  LYS  93           2HE      LYS  93 -30.720  -3.452  -4.127
  731    HE3  LYS  93           3HE      LYS  93 -29.861  -3.364  -2.578
  732    HZ1  LYS  93           HZ1      LYS  93 -30.813  -5.825  -3.933
  733    HZ2  LYS  93           HZ2      LYS  93 -29.252  -5.365  -3.805
  734    HZ3  LYS  93           HZ3      LYS  93 -30.072  -5.825  -2.460
  735    H    VAL  94           H        VAL  94 -34.696   0.025  -1.756
  736    HA   VAL  94           HA       VAL  94 -35.762  -0.748   0.930
  737    HB   VAL  94           HB       VAL  94 -36.933   1.569  -0.623
  738   HG11  VAL  94          1HG1      VAL  94 -38.254   0.562   1.251
  739   HG12  VAL  94          2HG1      VAL  94 -36.928   0.942   2.363
  740   HG13  VAL  94          3HG1      VAL  94 -37.828   2.239   1.544
  741   HG21  VAL  94          3HG2      VAL  94 -35.771   3.178   0.849
  742   HG22  VAL  94          1HG2      VAL  94 -34.751   1.858   1.477
  743   HG23  VAL  94          2HG2      VAL  94 -34.663   2.357  -0.233
  744    H    GLU  95           H        GLU  95 -37.779  -1.628   0.923
  745    HA   GLU  95           HA       GLU  95 -38.760  -2.776  -1.612
  746    HB2  GLU  95           2HB      GLU  95 -40.258  -4.039  -0.166
  747    HB3  GLU  95           3HB      GLU  95 -38.580  -4.170   0.408
  748    HG2  GLU  95           2HG      GLU  95 -39.042  -2.455   2.155
  749    HG3  GLU  95           3HG      GLU  95 -40.707  -2.323   1.608
  750    H    ILE  96           H        ILE  96 -40.961  -2.359  -2.309
  751    HA   ILE  96           HA       ILE  96 -42.575  -0.333  -1.115
  752    HB   ILE  96           HB       ILE  96 -42.474   0.958  -3.541
  753   HG12  ILE  96          2HG1      ILE  96 -40.204   1.689  -4.029
  754   HG13  ILE  96          3HG1      ILE  96 -39.537   0.557  -2.847
  755   HG21  ILE  96          1HG2      ILE  96 -41.607   2.852  -2.445
  756   HG22  ILE  96          2HG2      ILE  96 -42.627   1.983  -1.292
  757   HG23  ILE  96          3HG2      ILE  96 -40.843   1.881  -1.194
  758   HD11  ILE  96          3HD1      ILE  96 -39.315  -0.277  -5.154
  759   HD12  ILE  96          1HD1      ILE  96 -40.350  -1.324  -4.183
  760   HD13  ILE  96          2HD1      ILE  96 -41.094  -0.211  -5.329
  761    H    ALA  97           H        ALA  97 -44.621  -0.215  -2.028
  762    HA   ALA  97           HA       ALA  97 -45.278  -2.456  -3.858
  763    HB1  ALA  97           3HB      ALA  97 -47.192  -0.719  -2.300
  764    HB2  ALA  97           1HB      ALA  97 -47.582  -2.186  -3.166
  765    HB3  ALA  97           2HB      ALA  97 -46.553  -2.266  -1.725
  766    H    PHE  98           H        PHE  98 -46.440  -2.274  -5.732
  767    HA   PHE  98           HA       PHE  98 -46.669   0.462  -6.955
  768    HB2  PHE  98           2HB      PHE  98 -45.832  -2.120  -8.327
  769    HB3  PHE  98           3HB      PHE  98 -46.103  -0.581  -9.126
  770    HD1  PHE  98           HD2      PHE  98 -44.701   1.406  -7.510
  771    HD2  PHE  98           HD1      PHE  98 -43.544  -2.635  -8.519
  772    HE1  PHE  98           HE2      PHE  98 -42.317   2.037  -7.337
  773    HE2  PHE  98           HE1      PHE  98 -41.171  -1.988  -8.364
  774    HZ   PHE  98           HZ       PHE  98 -40.548   0.357  -7.780
  775    H    TYR  99           H        TYR  99 -48.306   0.690  -8.579
  776    HA   TYR  99           HA       TYR  99 -50.265  -1.518  -8.715
  777    HB2  TYR  99           2HB      TYR  99 -52.148  -0.220  -8.689
  778    HB3  TYR  99           3HB      TYR  99 -51.200   0.397  -7.356
  779    HD1  TYR  99           HD1      TYR  99 -49.957   2.629  -7.650
  780    HD2  TYR  99           HD2      TYR  99 -52.862   1.162 -10.481
  781    HE1  TYR  99           HE1      TYR  99 -50.276   4.938  -8.520
  782    HE2  TYR  99           HE2      TYR  99 -53.170   3.473 -11.358
  783    HH   TYR  99           HH       TYR  99 -51.382   6.278 -10.017
  784    H    ARG 100           H        ARG 100 -51.022  -2.043 -10.660
  785    HA   ARG 100           HA       ARG 100 -49.548  -0.965 -13.006
  786    HB2  ARG 100           2HB      ARG 100 -51.226  -3.495 -12.770
  787    HB3  ARG 100           3HB      ARG 100 -50.158  -3.032 -14.101
  788    HG2  ARG 100           2HG      ARG 100 -48.233  -3.040 -12.384
  789    HG3  ARG 100           3HG      ARG 100 -49.366  -3.778 -11.249
  790    HD2  ARG 100           2HD      ARG 100 -48.089  -5.537 -12.253
  791    HD3  ARG 100           3HD      ARG 100 -49.748  -5.638 -12.855
  792    HE   ARG 100           HE       ARG 100 -47.609  -4.227 -14.414
  793   HH11  ARG 100          1HH2      ARG 100 -49.857  -6.929 -14.312
  794   HH12  ARG 100          2HH2      ARG 100 -49.615  -7.312 -15.994
  795   HH21  ARG 100          1HH1      ARG 100 -47.322  -4.817 -16.563
  796   HH22  ARG 100          2HH1      ARG 100 -48.236  -6.148 -17.216
  797    H    LYS 101           H        LYS 101 -50.619  -0.747 -15.036
  798    HA   LYS 101           HA       LYS 101 -52.810   1.019 -15.108
  799    HB2  LYS 101           2HB      LYS 101 -51.066   0.903 -16.759
  800    HB3  LYS 101           3HB      LYS 101 -51.464  -0.748 -17.190
  801    HG2  LYS 101           2HG      LYS 101 -53.617   1.343 -17.531
  802    HG3  LYS 101           3HG      LYS 101 -52.241   1.377 -18.638
  803    HD2  LYS 101           2HD      LYS 101 -52.585  -0.925 -19.299
  804    HD3  LYS 101           3HD      LYS 101 -53.896  -1.132 -18.134
  805    HE2  LYS 101           2HE      LYS 101 -55.233   0.599 -19.282
  806    HE3  LYS 101           3HE      LYS 101 -53.920   0.868 -20.439
  807    HZ1  LYS 101           HZ1      LYS 101 -54.207  -1.432 -21.196
  808    HZ2  LYS 101           HZ2      LYS 101 -55.423  -1.680 -20.130
  809    HZ3  LYS 101           HZ3      LYS 101 -55.610  -0.616 -21.351
  810    H    ASP 102           H        ASP 102 -52.843  -2.494 -15.233
  811    HA   ASP 102           HA       ASP 102 -55.616  -2.756 -16.013
  812    HB2  ASP 102           2HB      ASP 102 -53.765  -4.441 -16.349
  813    HB3  ASP 102           3HB      ASP 102 -53.814  -4.766 -14.616
  814    H    GLY 103           H        GLY 103 -54.274  -1.705 -13.076
  815    HA2  GLY 103           HA2      GLY 103 -55.541  -0.888 -11.298
  816    HA3  GLY 103           HA3      GLY 103 -56.852  -2.006 -11.659
  817    H    SER 104           H        SER 104 -53.852  -3.658 -11.571
  818    HA   SER 104           HA       SER 104 -54.509  -4.867  -8.935
  819    HB2  SER 104           2HB      SER 104 -52.378  -5.591 -10.979
  820    HB3  SER 104           3HB      SER 104 -52.734  -6.482  -9.486
  821    HG   SER 104           HG       SER 104 -53.815  -7.377 -11.314
  822    H    CYS 105           H        CYS 105 -53.271  -4.640  -7.069
  823    HA   CYS 105           HA       CYS 105 -50.781  -3.022  -7.220
  824    HB2  CYS 105           2HB      CYS 105 -52.725  -1.566  -6.678
  825    HB3  CYS 105           3HB      CYS 105 -53.060  -2.565  -5.254
  826    HG   CYS 105           HG       CYS 105 -50.119  -1.181  -5.930
  827    H    PHE 106           H        PHE 106 -49.100  -3.773  -6.076
  828    HA   PHE 106           HA       PHE 106 -49.478  -5.608  -3.794
  829    HB2  PHE 106           2HB      PHE 106 -48.132  -7.412  -4.865
  830    HB3  PHE 106           3HB      PHE 106 -49.718  -7.176  -5.565
  831    HD1  PHE 106           HD1      PHE 106 -46.071  -6.654  -6.121
  832    HD2  PHE 106           HD2      PHE 106 -50.010  -6.495  -7.870
  833    HE1  PHE 106           HE1      PHE 106 -45.066  -6.425  -8.370
  834    HE2  PHE 106           HE2      PHE 106 -49.000  -6.265 -10.123
  835    HZ   PHE 106           HZ       PHE 106 -46.519  -6.222 -10.381
  836    H    LEU 107           H        LEU 107 -47.618  -6.143  -2.623
  837    HA   LEU 107           HA       LEU 107 -45.222  -4.398  -2.936
  838    HB2  LEU 107           2HB      LEU 107 -46.549  -4.370  -0.780
  839    HB3  LEU 107           3HB      LEU 107 -46.181  -6.062  -0.569
  840    HG   LEU 107           HG       LEU 107 -44.861  -4.675   0.884
  841   HD11  LEU 107          1HD1      LEU 107 -43.711  -6.748  -0.123
  842   HD12  LEU 107          2HD1      LEU 107 -42.791  -5.587  -1.109
  843   HD13  LEU 107          3HD1      LEU 107 -42.693  -5.497   0.631
  844   HD21  LEU 107          3HD2      LEU 107 -43.611  -3.423  -1.541
  845   HD22  LEU 107          1HD2      LEU 107 -44.750  -2.621  -0.416
  846   HD23  LEU 107          2HD2      LEU 107 -43.154  -3.129   0.147
  847    H    CYS 108           H        CYS 108 -43.344  -5.299  -3.522
  848    HA   CYS 108           HA       CYS 108 -42.761  -8.155  -3.011
  849    HB2  CYS 108           2HB      CYS 108 -42.596  -6.764  -5.710
  850    HB3  CYS 108           3HB      CYS 108 -41.623  -8.198  -5.325
  851    HG   CYS 108           HG       CYS 108 -44.822  -8.157  -4.595
  852    H    LEU 109           H        LEU 109 -40.289  -8.520  -3.315
  853    HA   LEU 109           HA       LEU 109 -39.032  -6.455  -1.669
  854    HB2  LEU 109           2HB      LEU 109 -38.981  -9.098  -1.476
  855    HB3  LEU 109           3HB      LEU 109 -37.644  -8.976  -2.587
  856    HG   LEU 109           HG       LEU 109 -36.808  -9.131  -0.357
  857   HD11  LEU 109          1HD1      LEU 109 -35.542  -7.525  -1.741
  858   HD12  LEU 109          2HD1      LEU 109 -36.524  -6.190  -1.093
  859   HD13  LEU 109          3HD1      LEU 109 -35.475  -7.132  -0.017
  860   HD21  LEU 109          3HD2      LEU 109 -38.848  -8.385   0.830
  861   HD22  LEU 109          1HD2      LEU 109 -37.372  -7.645   1.467
  862   HD23  LEU 109          2HD2      LEU 109 -38.456  -6.698   0.435
  863    H    VAL 110           H        VAL 110 -39.405  -5.021  -3.643
  864    HA   VAL 110           HA       VAL 110 -37.952  -5.244  -6.020
  865    HB   VAL 110           HB       VAL 110 -38.838  -2.688  -4.699
  866   HG11  VAL 110          1HG1      VAL 110 -37.441  -2.203  -6.660
  867   HG12  VAL 110          2HG1      VAL 110 -38.379  -3.370  -7.622
  868   HG13  VAL 110          3HG1      VAL 110 -39.118  -1.860  -7.049
  869   HG21  VAL 110          3HG2      VAL 110 -40.362  -4.541  -6.604
  870   HG22  VAL 110          1HG2      VAL 110 -40.776  -4.224  -4.907
  871   HG23  VAL 110          2HG2      VAL 110 -40.924  -2.941  -6.081
  872    H    ASP 111           H        ASP 111 -36.109  -4.107  -6.895
  873    HA   ASP 111           HA       ASP 111 -33.991  -3.996  -4.763
  874    HB2  ASP 111           2HB      ASP 111 -34.133  -5.840  -6.607
  875    HB3  ASP 111           3HB      ASP 111 -33.397  -4.623  -7.642
  876    H    VAL 112           H        VAL 112 -34.767  -1.719  -4.485
  877    HA   VAL 112           HA       VAL 112 -34.277   0.177  -6.614
  878    HB   VAL 112           HB       VAL 112 -35.024   0.647  -3.700
  879   HG11  VAL 112          1HG1      VAL 112 -36.097   2.683  -4.471
  880   HG12  VAL 112          2HG1      VAL 112 -34.402   2.729  -4.952
  881   HG13  VAL 112          3HG1      VAL 112 -35.664   2.334  -6.151
  882   HG21  VAL 112          3HG2      VAL 112 -36.627  -0.911  -4.682
  883   HG22  VAL 112          1HG2      VAL 112 -37.361   0.688  -4.575
  884   HG23  VAL 112          2HG2      VAL 112 -36.753   0.083  -6.141
  885    H    VAL 113           H        VAL 113 -31.974  -0.514  -6.807
  886    HA   VAL 113           HA       VAL 113 -30.197   0.855  -4.832
  887    HB   VAL 113           HB       VAL 113 -30.096  -1.568  -4.881
  888   HG11  VAL 113          1HG1      VAL 113 -28.704  -1.348  -7.577
  889   HG12  VAL 113          2HG1      VAL 113 -28.953  -2.806  -6.606
  890   HG13  VAL 113          3HG1      VAL 113 -30.346  -1.989  -7.323
  891   HG21  VAL 113          3HG2      VAL 113 -28.220  -0.262  -4.026
  892   HG22  VAL 113          1HG2      VAL 113 -27.664  -1.752  -4.795
  893   HG23  VAL 113          2HG2      VAL 113 -27.491  -0.208  -5.652
  894    HA   PRO 114           HA       PRO 114 -29.011   3.565  -8.237
  895    HB2  PRO 114           2HB      PRO 114 -27.262   5.194  -6.950
  896    HB3  PRO 114           3HB      PRO 114 -28.982   5.139  -6.501
  897    HG2  PRO 114           2HG      PRO 114 -26.678   3.663  -5.204
  898    HG3  PRO 114           3HG      PRO 114 -27.940   4.696  -4.441
  899    HD2  PRO 114           2HD      PRO 114 -28.197   2.007  -4.519
  900    HD3  PRO 114           3HD      PRO 114 -29.600   3.104  -4.716
  901    H    VAL 115           H        VAL 115 -26.852   4.680  -9.125
  902    HA   VAL 115           HA       VAL 115 -24.591   2.746  -9.056
  903    HB   VAL 115           HB       VAL 115 -24.073   3.307 -11.408
  904   HG11  VAL 115          1HG1      VAL 115 -25.034   1.143 -10.740
  905   HG12  VAL 115          2HG1      VAL 115 -26.674   1.799 -10.933
  906   HG13  VAL 115          3HG1      VAL 115 -25.603   1.643 -12.342
  907   HG21  VAL 115          3HG2      VAL 115 -25.554   5.253 -11.606
  908   HG22  VAL 115          1HG2      VAL 115 -25.772   4.077 -12.911
  909   HG23  VAL 115          2HG2      VAL 115 -26.967   4.186 -11.586
  910    H    LYS 116           H        LYS 116 -22.799   3.447  -8.495
  911    HA   LYS 116           HA       LYS 116 -22.242   6.350  -8.184
  912    HB2  LYS 116           2HB      LYS 116 -21.181   3.990  -6.592
  913    HB3  LYS 116           3HB      LYS 116 -20.734   5.649  -6.309
  914    HG2  LYS 116           2HG      LYS 116 -22.696   6.181  -5.251
  915    HG3  LYS 116           3HG      LYS 116 -23.656   5.032  -6.170
  916    HD2  LYS 116           2HD      LYS 116 -22.788   3.167  -4.891
  917    HD3  LYS 116           3HD      LYS 116 -21.562   4.169  -4.119
  918    HE2  LYS 116           2HE      LYS 116 -24.573   4.483  -3.695
  919    HE3  LYS 116           3HE      LYS 116 -23.485   3.555  -2.660
  920    HZ1  LYS 116           HZ1      LYS 116 -23.334   5.515  -1.571
  921    HZ2  LYS 116           HZ2      LYS 116 -22.219   5.913  -2.705
  922    HZ3  LYS 116           HZ3      LYS 116 -23.775   6.441  -2.826
  923    H    ASN 117           H        ASN 117 -20.018   6.885  -8.061
  924    HA   ASN 117           HA       ASN 117 -18.346   5.550 -10.175
  925    HB2  ASN 117           2HB      ASN 117 -17.232   7.537 -10.572
  926    HB3  ASN 117           3HB      ASN 117 -18.891   8.041 -10.377
  927   HD21  ASN 117          2HD2      ASN 117 -19.448   9.006  -8.104
  928   HD22  ASN 117          1HD2      ASN 117 -18.114   9.862  -7.344
  929    H    GLU 118           H        GLU 118 -15.834   5.954  -9.618
  930    HA   GLU 118           HA       GLU 118 -15.227   4.086  -7.570
  931    HB2  GLU 118           2HB      GLU 118 -12.910   4.510  -8.114
  932    HB3  GLU 118           3HB      GLU 118 -13.882   4.394  -9.578
  933    HG2  GLU 118           2HG      GLU 118 -13.896   6.891  -9.752
  934    HG3  GLU 118           3HG      GLU 118 -12.896   6.987  -8.302
  935    H    ASP 119           H        ASP 119 -15.531   7.573  -7.268
  936    HA   ASP 119           HA       ASP 119 -14.199   7.803  -4.711
  937    HB2  ASP 119           2HB      ASP 119 -14.794   9.653  -6.394
  938    HB3  ASP 119           3HB      ASP 119 -16.438   9.562  -5.759
  939    H    GLY 120           H        GLY 120 -17.211   6.404  -5.620
  940    HA2  GLY 120           HA2      GLY 120 -18.615   5.155  -4.216
  941    HA3  GLY 120           HA3      GLY 120 -18.095   6.079  -2.807
  942    H    ALA 121           H        ALA 121 -18.788   8.290  -5.254
  943    HA   ALA 121           HA       ALA 121 -21.384   8.932  -4.021
  944    HB1  ALA 121           3HB      ALA 121 -19.747  10.553  -6.018
  945    HB2  ALA 121           1HB      ALA 121 -21.090  11.130  -5.022
  946    HB3  ALA 121           2HB      ALA 121 -19.559  10.662  -4.247
  947    H    VAL 122           H        VAL 122 -23.303   9.100  -4.956
  948    HA   VAL 122           HA       VAL 122 -23.818   7.478  -7.271
  949    HB   VAL 122           HB       VAL 122 -25.315   7.378  -5.450
  950   HG11  VAL 122          1HG1      VAL 122 -26.911   9.066  -4.829
  951   HG12  VAL 122          2HG1      VAL 122 -25.281   9.717  -4.588
  952   HG13  VAL 122          3HG1      VAL 122 -26.254  10.223  -5.989
  953   HG21  VAL 122          3HG2      VAL 122 -26.667   8.607  -7.873
  954   HG22  VAL 122          1HG2      VAL 122 -26.106   6.936  -7.730
  955   HG23  VAL 122          2HG2      VAL 122 -27.404   7.534  -6.675
  956    H    ILE 123           H        ILE 123 -23.063   8.187  -9.136
  957    HA   ILE 123           HA       ILE 123 -23.597  10.957  -9.956
  958    HB   ILE 123           HB       ILE 123 -22.187  10.795 -11.668
  959   HG12  ILE 123          2HG1      ILE 123 -22.889   8.913 -12.933
  960   HG13  ILE 123          3HG1      ILE 123 -21.162   8.857 -12.680
  961   HG21  ILE 123          1HG2      ILE 123 -20.912   8.922  -9.653
  962   HG22  ILE 123          2HG2      ILE 123 -20.095  10.048 -10.762
  963   HG23  ILE 123          3HG2      ILE 123 -21.091  10.669  -9.433
  964   HD11  ILE 123          3HD1      ILE 123 -21.990   6.629 -12.532
  965   HD12  ILE 123          1HD1      ILE 123 -21.541   7.104 -10.885
  966   HD13  ILE 123          2HD1      ILE 123 -23.249   7.079 -11.392
  967    H    MET 124           H        MET 124 -24.928   7.709 -10.509
  968    HA   MET 124           HA       MET 124 -27.142   9.082 -11.965
  969    HB2  MET 124           2HB      MET 124 -25.515   6.746 -13.002
  970    HB3  MET 124           3HB      MET 124 -27.220   6.933 -13.433
  971    HG2  MET 124           2HG      MET 124 -24.915   8.779 -13.983
  972    HG3  MET 124           3HG      MET 124 -25.807   7.829 -15.151
  973    HE1  MET 124           3HE      MET 124 -24.955  11.031 -14.017
  974    HE2  MET 124           1HE      MET 124 -25.096  10.786 -15.767
  975    HE3  MET 124           2HE      MET 124 -26.073  12.043 -14.966
  976    H    PHE 125           H        PHE 125 -29.067   8.263 -11.771
  977    HA   PHE 125           HA       PHE 125 -29.572   6.364  -9.520
  978    HB2  PHE 125           2HB      PHE 125 -31.031   8.825 -10.446
  979    HB3  PHE 125           3HB      PHE 125 -31.971   7.497  -9.785
  980    HD1  PHE 125           HD1      PHE 125 -30.322   6.490  -7.548
  981    HD2  PHE 125           HD2      PHE 125 -31.285  10.488  -8.794
  982    HE1  PHE 125           HE1      PHE 125 -29.811   7.314  -5.264
  983    HE2  PHE 125           HE2      PHE 125 -30.759  11.320  -6.508
  984    HZ   PHE 125           HZ       PHE 125 -29.970   9.744  -4.764
  985    H    ILE 126           H        ILE 126 -29.167   4.611 -10.802
  986    HA   ILE 126           HA       ILE 126 -31.347   3.971 -12.743
  987    HB   ILE 126           HB       ILE 126 -28.745   2.502 -12.278
  988   HG12  ILE 126          2HG1      ILE 126 -29.693   4.458 -14.430
  989   HG13  ILE 126          3HG1      ILE 126 -28.376   4.712 -13.299
  990   HG21  ILE 126          1HG2      ILE 126 -29.351   1.098 -14.117
  991   HG22  ILE 126          2HG2      ILE 126 -30.800   1.127 -13.116
  992   HG23  ILE 126          3HG2      ILE 126 -30.731   2.121 -14.558
  993   HD11  ILE 126          3HD1      ILE 126 -28.447   2.715 -15.555
  994   HD12  ILE 126          1HD1      ILE 126 -27.421   4.160 -15.378
  995   HD13  ILE 126          2HD1      ILE 126 -27.199   2.750 -14.287
  996    H    LEU 127           H        LEU 127 -32.703   4.113 -10.849
  997    HA   LEU 127           HA       LEU 127 -32.468   1.939  -8.870
  998    HB2  LEU 127           2HB      LEU 127 -34.583   4.121  -9.054
  999    HB3  LEU 127           3HB      LEU 127 -34.359   2.955  -7.763
 1000    HG   LEU 127           HG       LEU 127 -32.458   5.192  -8.545
 1001   HD11  LEU 127          1HD1      LEU 127 -33.708   4.620  -5.833
 1002   HD12  LEU 127          2HD1      LEU 127 -32.586   5.916  -6.210
 1003   HD13  LEU 127          3HD1      LEU 127 -34.207   5.911  -6.956
 1004   HD21  LEU 127          3HD2      LEU 127 -31.037   4.343  -6.646
 1005   HD22  LEU 127          1HD2      LEU 127 -32.033   2.875  -6.660
 1006   HD23  LEU 127          2HD2      LEU 127 -31.088   3.330  -8.099
 1007    H    ASN 128           H        ASN 128 -32.438   0.269 -10.219
 1008    HA   ASN 128           HA       ASN 128 -34.366  -0.648 -11.925
 1009    HB2  ASN 128           2HB      ASN 128 -32.973  -2.510  -9.965
 1010    HB3  ASN 128           3HB      ASN 128 -33.468  -2.855 -11.612
 1011   HD21  ASN 128          2HD2      ASN 128 -30.981  -1.534  -9.554
 1012   HD22  ASN 128          1HD2      ASN 128 -29.865  -1.128 -10.842
 1013    H    PHE 129           H        PHE 129 -36.601  -0.729 -11.621
 1014    HA   PHE 129           HA       PHE 129 -37.564  -1.427  -8.947
 1015    HB2  PHE 129           2HB      PHE 129 -39.182  -0.583 -11.356
 1016    HB3  PHE 129           3HB      PHE 129 -39.701  -0.783  -9.679
 1017    HD1  PHE 129           HD2      PHE 129 -38.013   0.668  -7.968
 1018    HD2  PHE 129           HD1      PHE 129 -39.112   1.665 -12.016
 1019    HE1  PHE 129           HE2      PHE 129 -37.562   3.066  -7.502
 1020    HE2  PHE 129           HE1      PHE 129 -38.680   4.058 -11.541
 1021    HZ   PHE 129           HZ       PHE 129 -37.880   4.763  -9.291
 1022    H    GLU 130           H        GLU 130 -36.301  -3.505  -9.765
 1023    HA   GLU 130           HA       GLU 130 -38.006  -5.369 -11.246
 1024    HB2  GLU 130           2HB      GLU 130 -36.202  -7.012 -10.682
 1025    HB3  GLU 130           3HB      GLU 130 -35.771  -5.606 -11.700
 1026    HG2  GLU 130           2HG      GLU 130 -34.702  -4.473  -9.900
 1027    HG3  GLU 130           3HG      GLU 130 -35.335  -5.612  -8.724
 1028    H    VAL 131           H        VAL 131 -39.672  -5.954 -10.386
 1029    HA   VAL 131           HA       VAL 131 -40.395  -6.619  -7.683
 1030    HB   VAL 131           HB       VAL 131 -41.484  -7.304 -10.428
 1031   HG11  VAL 131          1HG1      VAL 131 -43.533  -8.196  -9.351
 1032   HG12  VAL 131          2HG1      VAL 131 -42.135  -9.246  -9.125
 1033   HG13  VAL 131          3HG1      VAL 131 -42.679  -8.205  -7.796
 1034   HG21  VAL 131          3HG2      VAL 131 -42.616  -5.670  -8.111
 1035   HG22  VAL 131          1HG2      VAL 131 -41.742  -4.990  -9.496
 1036   HG23  VAL 131          2HG2      VAL 131 -43.288  -5.810  -9.752
 1037    H    VAL 132           H        VAL 132 -39.651  -8.249  -6.439
 1038    HA   VAL 132           HA       VAL 132 -39.240 -10.863  -7.712
 1039    HB   VAL 132           HB       VAL 132 -37.043  -9.966  -7.880
 1040   HG11  VAL 132          1HG1      VAL 132 -36.999  -8.314  -6.109
 1041   HG12  VAL 132          2HG1      VAL 132 -37.056  -9.590  -4.867
 1042   HG13  VAL 132          3HG1      VAL 132 -35.646  -9.433  -5.934
 1043   HG21  VAL 132          3HG2      VAL 132 -37.057 -12.038  -5.657
 1044   HG22  VAL 132          1HG2      VAL 132 -37.311 -12.384  -7.387
 1045   HG23  VAL 132          2HG2      VAL 132 -35.772 -11.713  -6.832
 1046    H    MET 133           H        MET 133 -39.576 -12.609  -6.384
 1047    HA   MET 133           HA       MET 133 -40.311 -12.171  -3.535
 1048    HB2  MET 133           2HB      MET 133 -41.865 -13.856  -5.544
 1049    HB3  MET 133           3HB      MET 133 -42.131 -13.828  -3.798
 1050    HG2  MET 133           2HG      MET 133 -42.666 -11.388  -3.944
 1051    HG3  MET 133           3HG      MET 133 -42.467 -11.479  -5.694
 1052    HE1  MET 133           3HE      MET 133 -44.321 -13.893  -3.037
 1053    HE2  MET 133           1HE      MET 133 -44.706 -12.206  -2.618
 1054    HE3  MET 133           2HE      MET 133 -45.971 -13.278  -3.254
 1055    H    GLU 134           H        GLU 134 -40.007 -13.993  -2.205
 1056    HA   GLU 134           HA       GLU 134 -37.784 -15.727  -2.930
 1057    HB2  GLU 134           2HB      GLU 134 -37.913 -16.559  -0.672
 1058    HB3  GLU 134           3HB      GLU 134 -37.959 -14.799  -0.691
 1059    HG2  GLU 134           2HG      GLU 134 -40.438 -14.873  -0.359
 1060    HG3  GLU 134           3HG      GLU 134 -40.368 -16.635  -0.311
 1061    H    LYS 135           H        LYS 135 -37.744 -18.033  -2.838
 1062    HA   LYS 135           HA       LYS 135 -40.263 -19.449  -3.571
 1063    HB2  LYS 135           2HB      LYS 135 -37.519 -19.525  -4.874
 1064    HB3  LYS 135           3HB      LYS 135 -38.736 -20.746  -5.151
 1065    HG2  LYS 135           2HG      LYS 135 -39.258 -17.774  -5.678
 1066    HG3  LYS 135           3HG      LYS 135 -38.492 -18.814  -6.865
 1067    HD2  LYS 135           2HD      LYS 135 -41.261 -19.309  -5.710
 1068    HD3  LYS 135           3HD      LYS 135 -40.918 -18.510  -7.248
 1069    HE2  LYS 135           2HE      LYS 135 -39.765 -20.566  -8.059
 1070    HE3  LYS 135           3HE      LYS 135 -40.166 -21.382  -6.542
 1071    HZ1  LYS 135           HZ1      LYS 135 -42.524 -21.078  -7.076
 1072    HZ2  LYS 135           HZ2      LYS 135 -42.155 -20.330  -8.481
 1073    HZ3  LYS 135           HZ3      LYS 135 -41.782 -21.904  -8.270
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1 -55.360  -7.518 -57.538
    2    H2   MET   1           2H       MET   1 -56.370  -8.612 -58.206
    3    H3   MET   1           3H       MET   1 -56.499  -7.036 -58.616
    4    HA   MET   1           HA       MET   1 -55.436  -8.275 -60.385
    5    HB2  MET   1           2HB      MET   1 -53.588  -6.332 -58.930
    6    HB3  MET   1           3HB      MET   1 -53.270  -6.987 -60.538
    7    HG2  MET   1           2HG      MET   1 -55.388  -6.017 -61.371
    8    HG3  MET   1           3HG      MET   1 -55.681  -5.297 -59.782
    9    HE1  MET   1           3HE      MET   1 -55.727  -3.664 -62.513
   10    HE2  MET   1           1HE      MET   1 -56.030  -2.937 -60.917
   11    HE3  MET   1           2HE      MET   1 -54.858  -2.193 -62.026
   12    HA   PRO   2           HA       PRO   2 -52.899 -11.670 -59.056
   13    HB2  PRO   2           2HB      PRO   2 -51.945 -12.590 -61.428
   14    HB3  PRO   2           3HB      PRO   2 -53.687 -12.638 -61.025
   15    HG2  PRO   2           2HG      PRO   2 -52.216 -10.523 -62.642
   16    HG3  PRO   2           3HG      PRO   2 -53.697 -11.426 -63.100
   17    HD2  PRO   2           2HD      PRO   2 -53.807  -8.946 -61.977
   18    HD3  PRO   2           3HD      PRO   2 -55.027 -10.201 -61.596
   19    H    VAL   3           H        VAL   3 -50.684 -12.524 -59.183
   20    HA   VAL   3           HA       VAL   3 -48.491 -12.344 -58.691
   21    HB   VAL   3           HB       VAL   3 -47.061 -11.836 -60.587
   22   HG11  VAL   3          1HG1      VAL   3 -47.945 -13.525 -62.078
   23   HG12  VAL   3          2HG1      VAL   3 -48.228 -13.997 -60.396
   24   HG13  VAL   3          3HG1      VAL   3 -49.567 -13.364 -61.379
   25   HG21  VAL   3          3HG2      VAL   3 -48.288  -9.866 -61.548
   26   HG22  VAL   3          1HG2      VAL   3 -47.905 -11.125 -62.732
   27   HG23  VAL   3          2HG2      VAL   3 -49.558 -10.977 -62.110
   28    H    ARG   4           H        ARG   4 -49.760 -10.251 -57.367
   29    HA   ARG   4           HA       ARG   4 -48.111  -7.850 -57.446
   30    HB2  ARG   4           2HB      ARG   4 -50.051  -8.934 -55.359
   31    HB3  ARG   4           3HB      ARG   4 -49.226  -7.376 -55.232
   32    HG2  ARG   4           2HG      ARG   4 -50.279  -6.601 -57.328
   33    HG3  ARG   4           3HG      ARG   4 -51.080  -8.163 -57.520
   34    HD2  ARG   4           2HD      ARG   4 -52.662  -6.588 -56.628
   35    HD3  ARG   4           3HD      ARG   4 -52.324  -7.807 -55.409
   36    HE   ARG   4           HE       ARG   4 -51.361  -4.962 -55.443
   37   HH11  ARG   4          1HH2      ARG   4 -51.826  -7.862 -53.517
   38   HH12  ARG   4          2HH2      ARG   4 -51.443  -7.034 -52.033
   39   HH21  ARG   4          1HH1      ARG   4 -50.901  -3.985 -53.517
   40   HH22  ARG   4          2HH1      ARG   4 -50.941  -4.901 -52.040
   41    H    ARG   5           H        ARG   5 -46.655  -7.108 -55.912
   42    HA   ARG   5           HA       ARG   5 -44.749  -9.067 -54.886
   43    HB2  ARG   5           2HB      ARG   5 -43.373  -7.177 -54.315
   44    HB3  ARG   5           3HB      ARG   5 -44.027  -6.961 -55.936
   45    HG2  ARG   5           2HG      ARG   5 -45.739  -5.379 -55.026
   46    HG3  ARG   5           3HG      ARG   5 -45.055  -5.593 -53.401
   47    HD2  ARG   5           2HD      ARG   5 -42.877  -4.734 -54.204
   48    HD3  ARG   5           3HD      ARG   5 -43.563  -4.516 -55.829
   49    HE   ARG   5           HE       ARG   5 -45.205  -3.124 -53.963
   50   HH11  ARG   5          1HH1      ARG   5 -41.994  -2.797 -55.325
   51   HH12  ARG   5          2HH1      ARG   5 -41.979  -1.067 -55.112
   52   HH21  ARG   5          2HH2      ARG   5 -45.121  -0.915 -53.720
   53   HH22  ARG   5          1HH2      ARG   5 -43.708  -0.037 -54.225
   54    H    GLY   6           H        GLY   6 -43.825  -8.885 -52.696
   55    HA2  GLY   6           HA2      GLY   6 -45.629  -8.101 -50.500
   56    HA3  GLY   6           HA3      GLY   6 -45.270  -9.824 -50.626
   57    H    HIS   7           H        HIS   7 -44.608  -8.552 -48.347
   58    HA   HIS   7           HA       HIS   7 -41.637  -8.495 -48.306
   59    HB2  HIS   7           2HB      HIS   7 -42.313  -6.169 -48.643
   60    HB3  HIS   7           3HB      HIS   7 -43.445  -6.267 -47.295
   61    HD2  HIS   7           HD2      HIS   7 -42.522  -5.778 -44.892
   62    HE1  HIS   7           HE1      HIS   7 -38.374  -5.438 -45.836
   63    HE2  HIS   7           HE2      HIS   7 -40.124  -5.123 -44.012
   64    H    VAL   8           H        VAL   8 -40.704  -8.952 -46.325
   65    HA   VAL   8           HA       VAL   8 -42.439  -9.692 -44.023
   66    HB   VAL   8           HB       VAL   8 -40.071 -11.388 -44.912
   67   HG11  VAL   8          1HG1      VAL   8 -42.202 -11.812 -42.761
   68   HG12  VAL   8          2HG1      VAL   8 -40.945 -12.981 -43.218
   69   HG13  VAL   8          3HG1      VAL   8 -40.484 -11.454 -42.475
   70   HG21  VAL   8          3HG2      VAL   8 -43.054 -11.968 -45.173
   71   HG22  VAL   8          1HG2      VAL   8 -41.895 -11.768 -46.508
   72   HG23  VAL   8          2HG2      VAL   8 -41.751 -13.152 -45.427
   73    H    ALA   9           H        ALA   9 -41.665  -8.948 -42.091
   74    HA   ALA   9           HA       ALA   9 -39.553  -7.011 -42.020
   75    HB1  ALA   9           3HB      ALA   9 -40.062  -7.037 -39.571
   76    HB2  ALA   9           1HB      ALA   9 -41.535  -6.971 -40.551
   77    HB3  ALA   9           2HB      ALA   9 -41.030  -8.501 -39.798
   78    HA   PRO  10           HA       PRO  10 -35.957  -9.466 -41.243
   79    HB2  PRO  10           2HB      PRO  10 -34.507  -8.054 -39.366
   80    HB3  PRO  10           3HB      PRO  10 -34.653  -7.642 -41.093
   81    HG2  PRO  10           2HG      PRO  10 -36.258  -6.521 -38.768
   82    HG3  PRO  10           3HG      PRO  10 -35.475  -5.621 -40.106
   83    HD2  PRO  10           2HD      PRO  10 -38.112  -6.200 -40.141
   84    HD3  PRO  10           3HD      PRO  10 -37.146  -6.301 -41.641
   85    H    GLN  11           H        GLN  11 -36.492 -11.344 -40.445
   86    HA   GLN  11           HA       GLN  11 -37.825 -11.794 -38.012
   87    HB2  GLN  11           2HB      GLN  11 -37.750 -14.088 -38.524
   88    HB3  GLN  11           3HB      GLN  11 -37.947 -13.218 -40.034
   89    HG2  GLN  11           2HG      GLN  11 -35.394 -14.531 -38.997
   90    HG3  GLN  11           3HG      GLN  11 -36.438 -15.125 -40.280
   91   HE21  GLN  11          2HE2      GLN  11 -33.463 -14.094 -40.093
   92   HE22  GLN  11          1HE2      GLN  11 -33.385 -13.090 -41.543
   93    H    ASN  12           H        ASN  12 -34.372 -11.625 -38.574
   94    HA   ASN  12           HA       ASN  12 -33.545 -13.166 -36.261
   95    HB2  ASN  12           2HB      ASN  12 -32.160 -11.182 -38.129
   96    HB3  ASN  12           3HB      ASN  12 -31.361 -11.834 -36.704
   97   HD21  ASN  12          2HD2      ASN  12 -29.881 -12.515 -38.585
   98   HD22  ASN  12          1HD2      ASN  12 -30.207 -14.123 -39.216
   99    H    THR  13           H        THR  13 -33.817  -9.632 -36.841
  100    HA   THR  13           HA       THR  13 -33.234  -8.955 -34.069
  101    HB   THR  13           HB       THR  13 -32.807  -7.598 -36.192
  102    HG1  THR  13           HG1      THR  13 -32.956  -5.703 -34.984
  103   HG21  THR  13          1HG2      THR  13 -35.159  -7.636 -36.991
  104   HG22  THR  13          2HG2      THR  13 -35.613  -6.571 -35.656
  105   HG23  THR  13          3HG2      THR  13 -34.458  -6.007 -36.894
  106    H    PHE  14           H        PHE  14 -36.214  -9.331 -36.005
  107    HA   PHE  14           HA       PHE  14 -38.104  -8.471 -34.065
  108    HB2  PHE  14           2HB      PHE  14 -38.535  -8.998 -36.438
  109    HB3  PHE  14           3HB      PHE  14 -38.235 -10.696 -36.130
  110    HD1  PHE  14           HD1      PHE  14 -40.568  -7.872 -35.451
  111    HD2  PHE  14           HD2      PHE  14 -39.921 -12.125 -35.119
  112    HE1  PHE  14           HE1      PHE  14 -42.957  -8.190 -34.841
  113    HE2  PHE  14           HE2      PHE  14 -42.309 -12.439 -34.507
  114    HZ   PHE  14           HZ       PHE  14 -43.828 -10.472 -34.368
  115    H    LEU  15           H        LEU  15 -36.495 -11.619 -34.548
  116    HA   LEU  15           HA       LEU  15 -37.708 -12.831 -32.192
  117    HB2  LEU  15           2HB      LEU  15 -36.939 -14.290 -33.933
  118    HB3  LEU  15           3HB      LEU  15 -35.301 -13.629 -33.850
  119    HG   LEU  15           HG       LEU  15 -34.972 -14.542 -31.619
  120   HD11  LEU  15          1HD1      LEU  15 -37.733 -15.827 -31.853
  121   HD12  LEU  15          2HD1      LEU  15 -36.550 -16.049 -30.529
  122   HD13  LEU  15          3HD1      LEU  15 -37.330 -14.499 -30.763
  123   HD21  LEU  15          3HD2      LEU  15 -34.420 -15.933 -33.566
  124   HD22  LEU  15          1HD2      LEU  15 -34.938 -16.928 -32.194
  125   HD23  LEU  15          2HD2      LEU  15 -36.055 -16.631 -33.546
  126    H    ASP  16           H        ASP  16 -34.451 -11.341 -32.711
  127    HA   ASP  16           HA       ASP  16 -33.396 -11.516 -30.193
  128    HB2  ASP  16           2HB      ASP  16 -32.404 -10.404 -32.238
  129    HB3  ASP  16           3HB      ASP  16 -33.284  -8.944 -31.783
  130    H    THR  17           H        THR  17 -35.906  -9.245 -31.153
  131    HA   THR  17           HA       THR  17 -36.106  -7.788 -28.645
  132    HB   THR  17           HB       THR  17 -38.273  -8.346 -30.714
  133    HG1  THR  17           HG1      THR  17 -36.489  -7.241 -31.561
  134   HG21  THR  17          1HG2      THR  17 -39.293  -7.539 -28.643
  135   HG22  THR  17          2HG2      THR  17 -38.093  -6.229 -28.527
  136   HG23  THR  17          3HG2      THR  17 -39.288  -6.243 -29.846
  137    H    ILE  18           H        ILE  18 -37.604 -10.824 -29.772
  138    HA   ILE  18           HA       ILE  18 -39.212 -11.205 -27.364
  139    HB   ILE  18           HB       ILE  18 -38.344 -13.233 -29.430
  140   HG12  ILE  18          2HG1      ILE  18 -39.553 -11.473 -30.584
  141   HG13  ILE  18          3HG1      ILE  18 -40.405 -12.993 -30.589
  142   HG21  ILE  18          1HG2      ILE  18 -40.550 -13.331 -27.349
  143   HG22  ILE  18          2HG2      ILE  18 -40.411 -14.475 -28.706
  144   HG23  ILE  18          3HG2      ILE  18 -39.135 -14.389 -27.499
  145   HD11  ILE  18          3HD1      ILE  18 -41.900 -11.015 -30.212
  146   HD12  ILE  18          1HD1      ILE  18 -41.949 -12.112 -28.821
  147   HD13  ILE  18          2HD1      ILE  18 -40.999 -10.609 -28.737
  148    H    ILE  19           H        ILE  19 -35.957 -12.210 -28.488
  149    HA   ILE  19           HA       ILE  19 -35.315 -13.837 -26.280
  150    HB   ILE  19           HB       ILE  19 -33.409 -11.914 -27.668
  151   HG12  ILE  19          2HG1      ILE  19 -34.198 -13.361 -29.392
  152   HG13  ILE  19          3HG1      ILE  19 -32.604 -13.906 -28.924
  153   HG21  ILE  19          1HG2      ILE  19 -32.955 -14.303 -25.851
  154   HG22  ILE  19          2HG2      ILE  19 -31.680 -13.513 -26.806
  155   HG23  ILE  19          3HG2      ILE  19 -32.517 -12.619 -25.536
  156   HD11  ILE  19          3HD1      ILE  19 -33.731 -15.700 -27.525
  157   HD12  ILE  19          1HD1      ILE  19 -35.280 -15.154 -28.224
  158   HD13  ILE  19          2HD1      ILE  19 -34.027 -15.801 -29.291
  159    H    ARG  20           H        ARG  20 -34.833 -10.237 -26.651
  160    HA   ARG  20           HA       ARG  20 -34.207  -9.725 -23.917
  161    HB2  ARG  20           2HB      ARG  20 -35.186  -8.089 -26.270
  162    HB3  ARG  20           3HB      ARG  20 -35.405  -7.416 -24.669
  163    HG2  ARG  20           2HG      ARG  20 -33.392  -6.576 -24.892
  164    HG3  ARG  20           3HG      ARG  20 -32.817  -8.165 -24.418
  165    HD2  ARG  20           2HD      ARG  20 -33.209  -7.281 -27.308
  166    HD3  ARG  20           3HD      ARG  20 -31.707  -7.036 -26.429
  167    HE   ARG  20           HE       ARG  20 -32.609  -9.461 -27.672
  168   HH11  ARG  20          1HH1      ARG  20 -30.758  -8.520 -24.831
  169   HH12  ARG  20          2HH1      ARG  20 -29.668  -9.869 -25.003
  170   HH21  ARG  20          1HH2      ARG  20 -30.943 -10.844 -28.017
  171   HH22  ARG  20          2HH2      ARG  20 -29.848 -11.239 -26.710
  172    H    LYS  21           H        LYS  21 -37.337 -10.318 -25.344
  173    HA   LYS  21           HA       LYS  21 -38.868  -9.422 -23.042
  174    HB2  LYS  21           2HB      LYS  21 -39.710 -10.043 -25.469
  175    HB3  LYS  21           3HB      LYS  21 -39.791 -11.687 -24.809
  176    HG2  LYS  21           2HG      LYS  21 -41.954 -10.821 -24.563
  177    HG3  LYS  21           3HG      LYS  21 -41.256 -10.757 -22.943
  178    HD2  LYS  21           2HD      LYS  21 -40.746  -8.302 -23.334
  179    HD3  LYS  21           3HD      LYS  21 -41.552  -8.441 -24.914
  180    HE2  LYS  21           2HE      LYS  21 -43.651  -9.120 -23.784
  181    HE3  LYS  21           3HE      LYS  21 -42.844  -9.052 -22.211
  182    HZ1  LYS  21           HZ1      LYS  21 -43.249  -6.711 -24.001
  183    HZ2  LYS  21           HZ2      LYS  21 -44.086  -7.008 -22.620
  184    HZ3  LYS  21           HZ3      LYS  21 -42.537  -6.660 -22.517
  185    H    PHE  22           H        PHE  22 -37.545 -12.659 -23.889
  186    HA   PHE  22           HA       PHE  22 -38.297 -13.559 -21.152
  187    HB2  PHE  22           2HB      PHE  22 -38.221 -15.782 -21.854
  188    HB3  PHE  22           3HB      PHE  22 -39.176 -14.862 -22.987
  189    HD1  PHE  22           HD2      PHE  22 -35.778 -16.431 -22.513
  190    HD2  PHE  22           HD1      PHE  22 -38.762 -15.057 -25.302
  191    HE1  PHE  22           HE2      PHE  22 -34.532 -17.496 -24.364
  192    HE2  PHE  22           HE1      PHE  22 -37.519 -16.153 -27.158
  193    HZ   PHE  22           HZ       PHE  22 -35.408 -17.379 -26.689
  194    H    GLU  23           H        GLU  23 -35.572 -12.298 -22.454
  195    HA   GLU  23           HA       GLU  23 -33.445 -13.848 -22.027
  196    HB2  GLU  23           2HB      GLU  23 -33.306 -11.689 -23.087
  197    HB3  GLU  23           3HB      GLU  23 -33.813 -10.874 -21.634
  198    HG2  GLU  23           2HG      GLU  23 -31.492 -10.458 -22.077
  199    HG3  GLU  23           3HG      GLU  23 -31.711 -11.277 -20.548
  200    H    GLY  24           H        GLY  24 -35.178 -12.235 -19.406
  201    HA2  GLY  24           HA2      GLY  24 -35.196 -12.601 -17.135
  202    HA3  GLY  24           HA3      GLY  24 -33.973 -13.853 -17.346
  203    H    GLN  25           H        GLN  25 -32.519 -11.248 -18.680
  204    HA   GLN  25           HA       GLN  25 -31.395 -10.131 -16.136
  205    HB2  GLN  25           2HB      GLN  25 -30.332  -9.967 -18.989
  206    HB3  GLN  25           3HB      GLN  25 -29.565  -9.317 -17.538
  207    HG2  GLN  25           2HG      GLN  25 -29.466 -11.675 -16.613
  208    HG3  GLN  25           3HG      GLN  25 -30.033 -12.262 -18.181
  209   HE21  GLN  25          2HE2      GLN  25 -28.563 -12.050 -20.081
  210   HE22  GLN  25          1HE2      GLN  25 -26.854 -11.737 -19.780
  211    H    SER  26           H        SER  26 -33.297  -9.407 -18.929
  212    HA   SER  26           HA       SER  26 -33.185  -6.539 -18.973
  213    HB2  SER  26           2HB      SER  26 -35.003  -6.937 -20.697
  214    HB3  SER  26           3HB      SER  26 -33.495  -7.817 -20.989
  215    HG   SER  26           HG       SER  26 -35.526  -9.056 -21.136
  216    H    ARG  27           H        ARG  27 -34.086  -7.724 -16.396
  217    HA   ARG  27           HA       ARG  27 -36.902  -7.194 -16.041
  218    HB2  ARG  27           2HB      ARG  27 -36.353  -7.260 -13.585
  219    HB3  ARG  27           3HB      ARG  27 -36.001  -8.692 -14.525
  220    HG2  ARG  27           2HG      ARG  27 -34.304  -8.130 -12.810
  221    HG3  ARG  27           3HG      ARG  27 -33.643  -8.336 -14.430
  222    HD2  ARG  27           2HD      ARG  27 -33.302  -5.985 -14.716
  223    HD3  ARG  27           3HD      ARG  27 -34.357  -5.592 -13.358
  224    HE   ARG  27           HE       ARG  27 -32.704  -6.231 -11.795
  225   HH11  ARG  27          2HH1      ARG  27 -31.327  -6.777 -15.018
  226   HH12  ARG  27          1HH1      ARG  27 -29.716  -6.734 -14.353
  227   HH21  ARG  27          1HH2      ARG  27 -30.825  -6.277 -11.102
  228   HH22  ARG  27          2HH2      ARG  27 -29.400  -6.489 -12.128
  229    H    LYS  28           H        LYS  28 -37.634  -5.628 -14.332
  230    HA   LYS  28           HA       LYS  28 -37.769  -3.188 -15.730
  231    HB2  LYS  28           2HB      LYS  28 -38.685  -3.633 -12.872
  232    HB3  LYS  28           3HB      LYS  28 -39.363  -2.527 -14.029
  233    HG2  LYS  28           2HG      LYS  28 -40.840  -4.059 -14.669
  234    HG3  LYS  28           3HG      LYS  28 -39.592  -5.119 -15.246
  235    HD2  LYS  28           2HD      LYS  28 -39.473  -6.208 -13.016
  236    HD3  LYS  28           3HD      LYS  28 -40.565  -4.988 -12.352
  237    HE2  LYS  28           2HE      LYS  28 -41.889  -6.926 -12.716
  238    HE3  LYS  28           3HE      LYS  28 -42.357  -5.735 -13.928
  239    HZ1  LYS  28           HZ1      LYS  28 -41.005  -6.959 -15.557
  240    HZ2  LYS  28           HZ2      LYS  28 -40.541  -8.048 -14.420
  241    HZ3  LYS  28           HZ3      LYS  28 -42.099  -7.958 -14.883
  242    H    PHE  29           H        PHE  29 -36.819  -1.229 -15.613
  243    HA   PHE  29           HA       PHE  29 -35.731  -0.065 -13.229
  244    HB2  PHE  29           2HB      PHE  29 -33.387   0.058 -13.815
  245    HB3  PHE  29           3HB      PHE  29 -33.868  -1.612 -13.729
  246    HD1  PHE  29           HD2      PHE  29 -33.052   1.124 -16.177
  247    HD2  PHE  29           HD1      PHE  29 -33.381  -3.107 -15.444
  248    HE1  PHE  29           HE2      PHE  29 -31.981   0.655 -18.366
  249    HE2  PHE  29           HE1      PHE  29 -32.310  -3.573 -17.630
  250    HZ   PHE  29           HZ       PHE  29 -31.597  -1.688 -19.093
  251    H    ILE  30           H        ILE  30 -34.698   2.009 -13.541
  252    HA   ILE  30           HA       ILE  30 -35.290   3.355 -16.135
  253    HB   ILE  30           HB       ILE  30 -35.513   5.488 -14.655
  254   HG12  ILE  30          2HG1      ILE  30 -36.601   5.241 -12.518
  255   HG13  ILE  30          3HG1      ILE  30 -36.443   3.484 -12.565
  256   HG21  ILE  30          1HG2      ILE  30 -37.912   5.170 -14.619
  257   HG22  ILE  30          2HG2      ILE  30 -37.173   4.537 -16.106
  258   HG23  ILE  30          3HG2      ILE  30 -37.681   3.414 -14.816
  259   HD11  ILE  30          3HD1      ILE  30 -34.012   3.644 -12.382
  260   HD12  ILE  30          1HD1      ILE  30 -34.078   5.419 -12.553
  261   HD13  ILE  30          2HD1      ILE  30 -34.760   4.626 -11.121
  262    H    ILE  31           H        ILE  31 -34.104   5.382 -16.381
  263    HA   ILE  31           HA       ILE  31 -31.413   5.373 -15.124
  264    HB   ILE  31           HB       ILE  31 -32.001   6.488 -17.870
  265   HG12  ILE  31          2HG1      ILE  31 -32.496   4.050 -17.997
  266   HG13  ILE  31          3HG1      ILE  31 -31.116   4.549 -18.988
  267   HG21  ILE  31          1HG2      ILE  31 -30.067   7.363 -16.691
  268   HG22  ILE  31          2HG2      ILE  31 -29.438   5.743 -16.407
  269   HG23  ILE  31          3HG2      ILE  31 -29.531   6.386 -18.069
  270   HD11  ILE  31          3HD1      ILE  31 -30.762   2.411 -17.673
  271   HD12  ILE  31          1HD1      ILE  31 -29.521   3.654 -17.452
  272   HD13  ILE  31          2HD1      ILE  31 -30.758   3.421 -16.204
  273    H    ALA  32           H        ALA  32 -31.405   6.913 -13.762
  274    HA   ALA  32           HA       ALA  32 -32.667   9.525 -14.495
  275    HB1  ALA  32           3HB      ALA  32 -34.106   8.516 -12.841
  276    HB2  ALA  32           1HB      ALA  32 -32.732   8.206 -11.771
  277    HB3  ALA  32           2HB      ALA  32 -33.211   9.872 -12.100
  278    H    ASN  33           H        ASN  33 -31.738  11.445 -13.667
  279    HA   ASN  33           HA       ASN  33 -28.807  11.200 -13.454
  280    HB2  ASN  33           2HB      ASN  33 -29.898  12.605 -15.092
  281    HB3  ASN  33           3HB      ASN  33 -30.807  13.456 -13.865
  282   HD21  ASN  33          2HD2      ASN  33 -29.486  14.838 -15.626
  283   HD22  ASN  33          1HD2      ASN  33 -28.008  15.535 -14.983
  284    H    ALA  34           H        ALA  34 -27.894  11.039 -11.506
  285    HA   ALA  34           HA       ALA  34 -29.424  11.365  -9.046
  286    HB1  ALA  34           3HB      ALA  34 -27.792   9.536  -9.399
  287    HB2  ALA  34           1HB      ALA  34 -26.479  10.732  -9.512
  288    HB3  ALA  34           2HB      ALA  34 -27.369  10.529  -7.995
  289    H    ARG  35           H        ARG  35 -27.712  13.552 -10.971
  290    HA   ARG  35           HA       ARG  35 -26.686  15.206  -8.708
  291    HB2  ARG  35           2HB      ARG  35 -26.104  15.600 -11.652
  292    HB3  ARG  35           3HB      ARG  35 -25.221  16.230 -10.271
  293    HG2  ARG  35           2HG      ARG  35 -25.254  13.404 -11.362
  294    HG3  ARG  35           3HG      ARG  35 -23.898  14.504 -11.219
  295    HD2  ARG  35           2HD      ARG  35 -25.290  12.988  -8.981
  296    HD3  ARG  35           3HD      ARG  35 -23.661  12.743  -9.607
  297    HE   ARG  35           HE       ARG  35 -23.727  15.390  -8.693
  298   HH11  ARG  35          2HH1      ARG  35 -23.992  12.183  -7.254
  299   HH12  ARG  35          1HH1      ARG  35 -23.486  12.767  -5.689
  300   HH21  ARG  35          1HH2      ARG  35 -23.059  16.030  -6.670
  301   HH22  ARG  35          2HH2      ARG  35 -22.936  14.868  -5.382
  302    H    VAL  36           H        VAL  36 -29.483  15.112 -10.336
  303    HA   VAL  36           HA       VAL  36 -29.911  18.055 -10.533
  304    HB   VAL  36           HB       VAL  36 -31.985  17.359 -11.875
  305   HG11  VAL  36          1HG1      VAL  36 -30.664  17.020 -13.928
  306   HG12  VAL  36          2HG1      VAL  36 -29.964  18.296 -12.916
  307   HG13  VAL  36          3HG1      VAL  36 -29.221  16.683 -12.942
  308   HG21  VAL  36          3HG2      VAL  36 -30.587  14.740 -12.050
  309   HG22  VAL  36          1HG2      VAL  36 -32.089  15.051 -11.166
  310   HG23  VAL  36          2HG2      VAL  36 -32.050  15.253 -12.927
  311    H    GLU  37           H        GLU  37 -31.499  19.078  -9.487
  312    HA   GLU  37           HA       GLU  37 -32.192  18.099  -6.902
  313    HB2  GLU  37           2HB      GLU  37 -31.813  20.471  -7.578
  314    HB3  GLU  37           3HB      GLU  37 -33.361  20.461  -8.431
  315    HG2  GLU  37           2HG      GLU  37 -34.555  20.087  -6.311
  316    HG3  GLU  37           3HG      GLU  37 -33.024  19.919  -5.447
  317    H    ASN  38           H        ASN  38 -34.005  18.007  -9.918
  318    HA   ASN  38           HA       ASN  38 -36.483  17.033  -8.643
  319    HB2  ASN  38           2HB      ASN  38 -35.621  17.449 -11.540
  320    HB3  ASN  38           3HB      ASN  38 -37.186  16.791 -11.074
  321   HD21  ASN  38          2HD2      ASN  38 -37.204  19.011 -12.619
  322   HD22  ASN  38          1HD2      ASN  38 -37.721  20.383 -11.649
  323    H    CYS  39           H        CYS  39 -33.541  15.538  -9.282
  324    HA   CYS  39           HA       CYS  39 -32.812  13.436  -9.782
  325    HB2  CYS  39           2HB      CYS  39 -35.253  12.659  -8.148
  326    HB3  CYS  39           3HB      CYS  39 -33.779  11.707  -8.381
  327    HG   CYS  39           HG       CYS  39 -32.178  13.701  -7.421
  328    H    ALA  40           H        ALA  40 -34.183  14.415 -12.021
  329    HA   ALA  40           HA       ALA  40 -36.385  12.791 -12.702
  330    HB1  ALA  40           3HB      ALA  40 -36.119  15.109 -13.423
  331    HB2  ALA  40           1HB      ALA  40 -34.767  14.626 -14.494
  332    HB3  ALA  40           2HB      ALA  40 -36.428  14.029 -14.779
  333    H    VAL  41           H        VAL  41 -36.818  11.381 -14.276
  334    HA   VAL  41           HA       VAL  41 -34.928   9.308 -14.968
  335    HB   VAL  41           HB       VAL  41 -37.882   9.738 -15.565
  336   HG11  VAL  41          1HG1      VAL  41 -36.964   8.194 -17.264
  337   HG12  VAL  41          2HG1      VAL  41 -36.173   7.254 -15.985
  338   HG13  VAL  41          3HG1      VAL  41 -37.946   7.310 -16.099
  339   HG21  VAL  41          3HG2      VAL  41 -36.526   7.832 -13.604
  340   HG22  VAL  41          1HG2      VAL  41 -37.306   9.356 -13.149
  341   HG23  VAL  41          2HG2      VAL  41 -38.276   8.067 -13.853
  342    H    ILE  42           H        ILE  42 -33.457  10.252 -16.302
  343    HA   ILE  42           HA       ILE  42 -34.085  11.754 -18.697
  344    HB   ILE  42           HB       ILE  42 -31.672  11.490 -19.167
  345   HG12  ILE  42          2HG1      ILE  42 -31.594   9.796 -16.625
  346   HG13  ILE  42          3HG1      ILE  42 -31.401   9.169 -18.270
  347   HG21  ILE  42          1HG2      ILE  42 -32.136  12.217 -16.238
  348   HG22  ILE  42          2HG2      ILE  42 -30.878  12.850 -17.317
  349   HG23  ILE  42          3HG2      ILE  42 -32.568  13.267 -17.606
  350   HD11  ILE  42          3HD1      ILE  42 -29.267   9.345 -17.314
  351   HD12  ILE  42          1HD1      ILE  42 -29.395  10.663 -18.497
  352   HD13  ILE  42          2HD1      ILE  42 -29.555  10.995 -16.740
  353    H    TYR  43           H        TYR  43 -33.968   8.358 -17.978
  354    HA   TYR  43           HA       TYR  43 -34.977   7.686 -20.609
  355    HB2  TYR  43           2HB      TYR  43 -32.347   7.714 -20.842
  356    HB3  TYR  43           3HB      TYR  43 -32.417   6.224 -19.948
  357    HD1  TYR  43           HD2      TYR  43 -33.767   7.908 -23.000
  358    HD2  TYR  43           HD1      TYR  43 -32.864   4.162 -21.052
  359    HE1  TYR  43           HE2      TYR  43 -34.206   6.685 -25.132
  360    HE2  TYR  43           HE1      TYR  43 -33.308   2.948 -23.175
  361    HH   TYR  43           HH       TYR  43 -33.887   3.124 -25.390
  362    H    CYS  44           H        CYS  44 -35.646   5.353 -20.780
  363    HA   CYS  44           HA       CYS  44 -35.932   4.079 -18.129
  364    HB2  CYS  44           2HB      CYS  44 -38.371   3.859 -18.475
  365    HB3  CYS  44           3HB      CYS  44 -37.862   5.553 -18.343
  366    HG   CYS  44           HG       CYS  44 -39.808   5.276 -20.133
  367    H    ASN  45           H        ASN  45 -36.329   1.850 -18.076
  368    HA   ASN  45           HA       ASN  45 -35.987   0.423 -20.641
  369    HB2  ASN  45           2HB      ASN  45 -34.893  -0.305 -18.464
  370    HB3  ASN  45           3HB      ASN  45 -36.483  -0.860 -17.935
  371   HD21  ASN  45          2HD2      ASN  45 -33.954  -1.231 -20.467
  372   HD22  ASN  45          1HD2      ASN  45 -34.471  -2.845 -20.928
  373    H    ASP  46           H        ASP  46 -37.506  -1.059 -21.418
  374    HA   ASP  46           HA       ASP  46 -40.275  -0.163 -21.245
  375    HB2  ASP  46           2HB      ASP  46 -39.053  -2.624 -22.540
  376    HB3  ASP  46           3HB      ASP  46 -40.740  -2.124 -22.700
  377    H    GLY  47           H        GLY  47 -38.402  -2.704 -19.597
  378    HA2  GLY  47           HA2      GLY  47 -40.466  -4.229 -18.458
  379    HA3  GLY  47           HA3      GLY  47 -38.917  -3.870 -17.682
  380    H    PHE  48           H        PHE  48 -39.052  -1.161 -17.066
  381    HA   PHE  48           HA       PHE  48 -40.930  -1.145 -14.866
  382    HB2  PHE  48           2HB      PHE  48 -39.329   0.203 -14.144
  383    HB3  PHE  48           3HB      PHE  48 -38.686   0.455 -15.746
  384    HD1  PHE  48           HD1      PHE  48 -39.379   2.413 -17.146
  385    HD2  PHE  48           HD2      PHE  48 -40.863   1.817 -13.141
  386    HE1  PHE  48           HE1      PHE  48 -40.002   4.811 -16.996
  387    HE2  PHE  48           HE2      PHE  48 -41.487   4.203 -13.009
  388    HZ   PHE  48           HZ       PHE  48 -41.044   5.712 -14.931
  389    H    CYS  49           H        CYS  49 -41.052   0.034 -18.155
  390    HA   CYS  49           HA       CYS  49 -43.292   1.825 -17.908
  391    HB2  CYS  49           2HB      CYS  49 -41.556   1.582 -19.824
  392    HB3  CYS  49           3HB      CYS  49 -42.557   0.221 -20.380
  393    HG   CYS  49           HG       CYS  49 -43.453   3.354 -19.762
  394    H    GLU  50           H        GLU  50 -42.949  -1.702 -18.434
  395    HA   GLU  50           HA       GLU  50 -45.853  -2.162 -18.513
  396    HB2  GLU  50           2HB      GLU  50 -43.538  -4.106 -18.190
  397    HB3  GLU  50           3HB      GLU  50 -45.225  -4.536 -18.479
  398    HG2  GLU  50           2HG      GLU  50 -45.198  -3.285 -20.627
  399    HG3  GLU  50           3HG      GLU  50 -43.498  -2.915 -20.398
  400    H    LEU  51           H        LEU  51 -43.324  -2.151 -16.029
  401    HA   LEU  51           HA       LEU  51 -44.678  -3.449 -13.935
  402    HB2  LEU  51           2HB      LEU  51 -42.329  -2.805 -13.919
  403    HB3  LEU  51           3HB      LEU  51 -42.771  -1.110 -13.816
  404    HG   LEU  51           HG       LEU  51 -43.762  -1.310 -11.694
  405   HD11  LEU  51          1HD1      LEU  51 -42.969  -4.255 -11.790
  406   HD12  LEU  51          2HD1      LEU  51 -43.480  -3.394 -10.320
  407   HD13  LEU  51          3HD1      LEU  51 -44.616  -3.594 -11.655
  408   HD21  LEU  51          3HD2      LEU  51 -41.352  -0.867 -11.883
  409   HD22  LEU  51          1HD2      LEU  51 -41.721  -1.770 -10.399
  410   HD23  LEU  51          2HD2      LEU  51 -41.021  -2.618 -11.798
  411    H    CYS  52           H        CYS  52 -44.625   0.076 -14.722
  412    HA   CYS  52           HA       CYS  52 -46.944   0.580 -12.963
  413    HB2  CYS  52           2HB      CYS  52 -46.768   2.894 -13.787
  414    HB3  CYS  52           3HB      CYS  52 -45.237   2.294 -13.133
  415    HG   CYS  52           HG       CYS  52 -44.042   1.818 -15.363
  416    H    GLY  53           H        GLY  53 -46.377  -0.118 -16.328
  417    HA2  GLY  53           HA2      GLY  53 -47.875  -0.871 -17.943
  418    HA3  GLY  53           HA3      GLY  53 -49.236  -0.558 -16.869
  419    H    TYR  54           H        TYR  54 -46.852   1.948 -17.597
  420    HA   TYR  54           HA       TYR  54 -48.967   3.629 -18.839
  421    HB2  TYR  54           2HB      TYR  54 -46.213   4.386 -17.841
  422    HB3  TYR  54           3HB      TYR  54 -47.465   5.490 -18.400
  423    HD1  TYR  54           HD1      TYR  54 -49.641   3.611 -16.658
  424    HD2  TYR  54           HD2      TYR  54 -46.081   5.949 -15.933
  425    HE1  TYR  54           HE1      TYR  54 -50.377   4.012 -14.328
  426    HE2  TYR  54           HE2      TYR  54 -46.846   6.371 -13.603
  427    HH   TYR  54           HH       TYR  54 -49.918   5.065 -12.325
  428    H    SER  55           H        SER  55 -46.269   5.038 -19.902
  429    HA   SER  55           HA       SER  55 -45.618   3.586 -22.332
  430    HB2  SER  55           2HB      SER  55 -47.805   4.508 -22.988
  431    HB3  SER  55           3HB      SER  55 -47.282   6.130 -22.505
  432    HG   SER  55           HG       SER  55 -47.037   5.683 -24.784
  433    H    ARG  56           H        ARG  56 -43.850   4.665 -23.432
  434    HA   ARG  56           HA       ARG  56 -41.898   5.659 -21.600
  435    HB2  ARG  56           2HB      ARG  56 -41.893   5.860 -24.644
  436    HB3  ARG  56           3HB      ARG  56 -40.497   6.060 -23.576
  437    HG2  ARG  56           2HG      ARG  56 -40.802   3.691 -22.784
  438    HG3  ARG  56           3HG      ARG  56 -42.138   3.507 -23.923
  439    HD2  ARG  56           2HD      ARG  56 -40.211   2.547 -24.967
  440    HD3  ARG  56           3HD      ARG  56 -40.586   4.042 -25.812
  441    HE   ARG  56           HE       ARG  56 -38.574   4.966 -25.091
  442   HH11  ARG  56          2HH1      ARG  56 -38.946   1.886 -23.367
  443   HH12  ARG  56          1HH1      ARG  56 -37.513   2.249 -22.400
  444   HH21  ARG  56          1HH2      ARG  56 -36.640   5.101 -23.951
  445   HH22  ARG  56          2HH2      ARG  56 -36.277   3.857 -22.769
  446    H    ALA  57           H        ALA  57 -43.868   7.439 -23.937
  447    HA   ALA  57           HA       ALA  57 -42.751  10.038 -23.512
  448    HB1  ALA  57           3HB      ALA  57 -44.799  10.783 -24.680
  449    HB2  ALA  57           1HB      ALA  57 -44.082   9.372 -25.482
  450    HB3  ALA  57           2HB      ALA  57 -45.521   9.174 -24.455
  451    H    GLU  58           H        GLU  58 -44.833   8.167 -21.467
  452    HA   GLU  58           HA       GLU  58 -45.907  10.450 -19.957
  453    HB2  GLU  58           2HB      GLU  58 -46.192   7.473 -19.428
  454    HB3  GLU  58           3HB      GLU  58 -47.080   8.766 -18.669
  455    HG2  GLU  58           2HG      GLU  58 -47.246   8.185 -21.659
  456    HG3  GLU  58           3HG      GLU  58 -48.300   7.462 -20.469
  457    H    VAL  59           H        VAL  59 -43.089   8.368 -19.882
  458    HA   VAL  59           HA       VAL  59 -42.624   9.007 -16.983
  459    HB   VAL  59           HB       VAL  59 -40.866   7.227 -17.088
  460   HG11  VAL  59          1HG1      VAL  59 -42.587   5.405 -16.958
  461   HG12  VAL  59          2HG1      VAL  59 -43.095   6.867 -16.095
  462   HG13  VAL  59          3HG1      VAL  59 -43.773   6.485 -17.691
  463   HG21  VAL  59          3HG2      VAL  59 -42.257   6.433 -19.651
  464   HG22  VAL  59          1HG2      VAL  59 -40.592   7.076 -19.560
  465   HG23  VAL  59          2HG2      VAL  59 -41.016   5.520 -18.809
  466    H    MET  60           H        MET  60 -41.410   9.770 -20.158
  467    HA   MET  60           HA       MET  60 -38.777  10.453 -19.723
  468    HB2  MET  60           2HB      MET  60 -40.899  11.902 -21.356
  469    HB3  MET  60           3HB      MET  60 -39.211  12.401 -21.340
  470    HG2  MET  60           2HG      MET  60 -40.246   9.731 -22.305
  471    HG3  MET  60           3HG      MET  60 -39.699  11.071 -23.283
  472    HE1  MET  60           3HE      MET  60 -37.184   7.731 -21.533
  473    HE2  MET  60           1HE      MET  60 -38.502   8.407 -20.555
  474    HE3  MET  60           2HE      MET  60 -38.848   7.715 -22.154
  475    H    GLN  61           H        GLN  61 -37.927  11.406 -18.104
  476    HA   GLN  61           HA       GLN  61 -37.133  13.041 -16.845
  477    HB2  GLN  61           2HB      GLN  61 -38.858  14.968 -18.403
  478    HB3  GLN  61           3HB      GLN  61 -37.408  15.356 -17.489
  479    HG2  GLN  61           2HG      GLN  61 -35.964  14.478 -19.101
  480    HG3  GLN  61           3HG      GLN  61 -37.120  13.296 -19.691
  481   HE21  GLN  61          1HE2      GLN  61 -37.144  13.712 -21.861
  482   HE22  GLN  61          2HE2      GLN  61 -37.730  15.227 -22.515
  483    H    ARG  62           H        ARG  62 -39.777  11.614 -16.046
  484    HA   ARG  62           HA       ARG  62 -40.749  13.520 -14.014
  485    HB2  ARG  62           2HB      ARG  62 -41.275  10.603 -14.738
  486    HB3  ARG  62           3HB      ARG  62 -41.634  11.139 -13.109
  487    HG2  ARG  62           2HG      ARG  62 -43.644  11.443 -14.059
  488    HG3  ARG  62           3HG      ARG  62 -42.974  13.069 -14.184
  489    HD2  ARG  62           2HD      ARG  62 -42.833  11.033 -16.422
  490    HD3  ARG  62           3HD      ARG  62 -44.258  12.041 -16.196
  491    HE   ARG  62           HE       ARG  62 -41.768  12.807 -17.422
  492   HH11  ARG  62          2HH2      ARG  62 -44.420  14.266 -15.640
  493   HH12  ARG  62          1HH2      ARG  62 -44.123  15.826 -16.357
  494   HH21  ARG  62          1HH1      ARG  62 -41.489  14.699 -18.288
  495   HH22  ARG  62          2HH1      ARG  62 -42.468  16.082 -17.835
  496    HA   PRO  63           HA       PRO  63 -37.824  12.660 -10.808
  497    HB2  PRO  63           2HB      PRO  63 -40.148  12.026  -8.989
  498    HB3  PRO  63           3HB      PRO  63 -38.738  13.090  -8.690
  499    HG2  PRO  63           2HG      PRO  63 -41.134  14.170  -9.333
  500    HG3  PRO  63           3HG      PRO  63 -39.643  14.799 -10.110
  501    HD2  PRO  63           2HD      PRO  63 -41.644  12.808 -11.227
  502    HD3  PRO  63           3HD      PRO  63 -40.925  14.249 -12.010
  503    H    CYS  64           H        CYS  64 -36.627  10.903 -10.220
  504    HA   CYS  64           HA       CYS  64 -37.398   8.188 -10.675
  505    HB2  CYS  64           2HB      CYS  64 -35.104   9.164 -10.691
  506    HB3  CYS  64           3HB      CYS  64 -35.187   9.381  -8.941
  507    HG   CYS  64           HG       CYS  64 -35.449   6.573 -10.700
  508    H    THR  65           H        THR  65 -38.039  10.295  -7.979
  509    HA   THR  65           HA       THR  65 -38.492   8.449  -5.902
  510    HB   THR  65           HB       THR  65 -40.100  11.000  -6.191
  511    HG1  THR  65           HG1      THR  65 -38.347  12.126  -5.410
  512   HG21  THR  65          1HG2      THR  65 -39.698  11.102  -3.770
  513   HG22  THR  65          2HG2      THR  65 -40.387   9.522  -4.183
  514   HG23  THR  65          3HG2      THR  65 -38.647   9.668  -3.868
  515    H    CYS  66           H        CYS  66 -39.505   6.702  -6.794
  516    HA   CYS  66           HA       CYS  66 -41.799   6.445  -8.261
  517    HB2  CYS  66           2HB      CYS  66 -41.949   4.160  -7.302
  518    HB3  CYS  66           3HB      CYS  66 -40.293   4.605  -7.754
  519    HG   CYS  66           HG       CYS  66 -40.248   3.212  -5.533
  520    H    ASP  67           H        ASP  67 -41.835   7.649  -5.077
  521    HA   ASP  67           HA       ASP  67 -44.409   7.200  -4.059
  522    HB2  ASP  67           2HB      ASP  67 -42.648   8.585  -3.005
  523    HB3  ASP  67           3HB      ASP  67 -42.786   9.770  -4.298
  524    H    PHE  68           H        PHE  68 -43.415   9.293  -6.846
  525    HA   PHE  68           HA       PHE  68 -45.912  10.581  -7.187
  526    HB2  PHE  68           2HB      PHE  68 -45.056  11.530  -9.033
  527    HB3  PHE  68           3HB      PHE  68 -43.562  11.023  -8.290
  528    HD1  PHE  68           HD2      PHE  68 -45.982  10.420 -11.036
  529    HD2  PHE  68           HD1      PHE  68 -42.142   9.328  -9.416
  530    HE1  PHE  68           HE2      PHE  68 -45.393   9.308 -13.174
  531    HE2  PHE  68           HE1      PHE  68 -41.558   8.215 -11.546
  532    HZ   PHE  68           HZ       PHE  68 -43.176   8.207 -13.435
  533    H    LEU  69           H        LEU  69 -45.097   7.311  -7.950
  534    HA   LEU  69           HA       LEU  69 -47.802   6.887  -9.064
  535    HB2  LEU  69           2HB      LEU  69 -46.951   5.163 -10.595
  536    HB3  LEU  69           3HB      LEU  69 -46.483   6.808 -10.960
  537    HG   LEU  69           HG       LEU  69 -44.191   6.356 -10.030
  538   HD11  LEU  69          1HD1      LEU  69 -43.455   4.003  -9.868
  539   HD12  LEU  69          2HD1      LEU  69 -44.620   4.390  -8.599
  540   HD13  LEU  69          3HD1      LEU  69 -45.143   3.459 -10.016
  541   HD21  LEU  69          3HD2      LEU  69 -43.466   5.073 -11.994
  542   HD22  LEU  69          1HD2      LEU  69 -45.136   4.530 -12.277
  543   HD23  LEU  69          2HD2      LEU  69 -44.712   6.240 -12.442
  544    H    HIS  70           H        HIS  70 -46.798   6.672  -6.255
  545    HA   HIS  70           HA       HIS  70 -46.851   3.889  -5.593
  546    HB2  HIS  70           2HB      HIS  70 -47.117   4.520  -3.365
  547    HB3  HIS  70           3HB      HIS  70 -46.035   5.678  -4.095
  548    HD2  HIS  70           HD2      HIS  70 -48.835   7.406  -5.243
  549    HE1  HIS  70           HE1      HIS  70 -49.034   8.348  -1.095
  550    HE2  HIS  70           HE2      HIS  70 -49.844   9.002  -3.418
  551    H    GLY  71           H        GLY  71 -48.467   2.590  -4.657
  552    HA2  GLY  71           HA2      GLY  71 -51.142   2.971  -5.912
  553    HA3  GLY  71           HA3      GLY  71 -50.378   1.441  -5.493
  554    HA   PRO  72           HA       PRO  72 -53.445   3.009  -2.253
  555    HB2  PRO  72           2HB      PRO  72 -55.470   1.185  -2.519
  556    HB3  PRO  72           3HB      PRO  72 -55.304   2.625  -3.568
  557    HG2  PRO  72           2HG      PRO  72 -54.351  -0.205  -4.141
  558    HG3  PRO  72           3HG      PRO  72 -55.349   0.857  -5.188
  559    HD2  PRO  72           2HD      PRO  72 -52.664   0.675  -5.521
  560    HD3  PRO  72           3HD      PRO  72 -53.501   2.248  -5.697
  561    H    ARG  73           H        ARG  73 -51.776   0.034  -2.789
  562    HA   ARG  73           HA       ARG  73 -51.928  -0.611   0.139
  563    HB2  ARG  73           2HB      ARG  73 -51.329  -2.434  -2.230
  564    HB3  ARG  73           3HB      ARG  73 -51.052  -2.869  -0.541
  565    HG2  ARG  73           2HG      ARG  73 -53.526  -2.192  -0.131
  566    HG3  ARG  73           3HG      ARG  73 -53.714  -2.316  -1.880
  567    HD2  ARG  73           2HD      ARG  73 -52.753  -4.508   0.012
  568    HD3  ARG  73           3HD      ARG  73 -54.385  -4.357  -0.654
  569    HE   ARG  73           HE       ARG  73 -52.573  -4.473  -2.844
  570   HH11  ARG  73          2HH2      ARG  73 -53.840  -6.592  -0.351
  571   HH12  ARG  73          1HH2      ARG  73 -53.591  -8.025  -1.308
  572   HH21  ARG  73          1HH1      ARG  73 -52.185  -6.379  -3.977
  573   HH22  ARG  73          2HH1      ARG  73 -52.717  -7.897  -3.306
  574    H    THR  74           H        THR  74 -49.946   1.156  -1.848
  575    HA   THR  74           HA       THR  74 -47.384   0.071  -0.978
  576    HB   THR  74           HB       THR  74 -47.918   2.878  -1.954
  577    HG1  THR  74           HG1      THR  74 -46.894   1.088  -3.744
  578   HG21  THR  74          1HG2      THR  74 -45.664   2.708  -1.137
  579   HG22  THR  74          2HG2      THR  74 -45.431   1.134  -1.924
  580   HG23  THR  74          3HG2      THR  74 -45.576   2.622  -2.897
  581    H    GLN  75           H        GLN  75 -46.053   0.649   0.648
  582    HA   GLN  75           HA       GLN  75 -47.360   1.989   2.913
  583    HB2  GLN  75           2HB      GLN  75 -44.576   0.840   2.699
  584    HB3  GLN  75           3HB      GLN  75 -45.324   1.485   4.159
  585    HG2  GLN  75           2HG      GLN  75 -47.121  -0.240   3.993
  586    HG3  GLN  75           3HG      GLN  75 -46.290  -0.949   2.605
  587   HE21  GLN  75          2HE2      GLN  75 -46.545  -2.836   4.325
  588   HE22  GLN  75          1HE2      GLN  75 -45.143  -3.037   5.367
  589    H    ARG  76           H        ARG  76 -47.114   3.946   3.523
  590    HA   ARG  76           HA       ARG  76 -45.867   5.896   1.760
  591    HB2  ARG  76           2HB      ARG  76 -47.029   6.399   4.491
  592    HB3  ARG  76           3HB      ARG  76 -46.788   7.576   3.202
  593    HG2  ARG  76           2HG      ARG  76 -48.880   5.365   3.337
  594    HG3  ARG  76           3HG      ARG  76 -49.120   7.109   3.251
  595    HD2  ARG  76           2HD      ARG  76 -48.020   7.013   0.935
  596    HD3  ARG  76           3HD      ARG  76 -48.136   5.257   1.043
  597    HE   ARG  76           HE       ARG  76 -50.521   7.080   1.229
  598   HH11  ARG  76          1HH1      ARG  76 -49.307   4.037  -0.027
  599   HH12  ARG  76          2HH1      ARG  76 -50.473   3.997  -1.323
  600   HH21  ARG  76          1HH2      ARG  76 -52.128   6.829  -0.277
  601   HH22  ARG  76          2HH2      ARG  76 -52.114   5.448  -1.333
  602    H    ARG  77           H        ARG  77 -45.050   4.646   4.975
  603    HA   ARG  77           HA       ARG  77 -42.630   6.086   5.405
  604    HB2  ARG  77           2HB      ARG  77 -42.002   4.324   6.899
  605    HB3  ARG  77           3HB      ARG  77 -43.702   4.780   7.104
  606    HG2  ARG  77           2HG      ARG  77 -44.371   2.756   5.822
  607    HG3  ARG  77           3HG      ARG  77 -42.677   2.245   5.733
  608    HD2  ARG  77           2HD      ARG  77 -44.096   2.841   8.366
  609    HD3  ARG  77           3HD      ARG  77 -44.171   1.268   7.564
  610    HE   ARG  77           HE       ARG  77 -41.435   1.949   7.750
  611   HH11  ARG  77          1HH1      ARG  77 -44.012   1.109   9.969
  612   HH12  ARG  77          2HH1      ARG  77 -42.907   0.460  11.150
  613   HH21  ARG  77          1HH2      ARG  77 -40.080   1.108   9.304
  614   HH22  ARG  77          2HH2      ARG  77 -40.744   0.461  10.774
  615    H    ALA  78           H        ALA  78 -43.168   3.219   3.423
  616    HA   ALA  78           HA       ALA  78 -40.398   2.726   2.770
  617    HB1  ALA  78           3HB      ALA  78 -42.885   1.943   1.155
  618    HB2  ALA  78           1HB      ALA  78 -41.300   1.237   1.097
  619    HB3  ALA  78           2HB      ALA  78 -42.239   1.043   2.554
  620    H    ALA  79           H        ALA  79 -43.060   4.443   1.052
  621    HA   ALA  79           HA       ALA  79 -41.404   5.346  -1.142
  622    HB1  ALA  79           3HB      ALA  79 -43.343   6.759  -1.664
  623    HB2  ALA  79           1HB      ALA  79 -43.892   5.136  -1.203
  624    HB3  ALA  79           2HB      ALA  79 -44.016   6.488  -0.047
  625    H    ALA  80           H        ALA  80 -42.194   6.800   1.991
  626    HA   ALA  80           HA       ALA  80 -41.001   9.334   1.553
  627    HB1  ALA  80           3HB      ALA  80 -42.652   8.891   3.300
  628    HB2  ALA  80           1HB      ALA  80 -41.529   7.768   4.107
  629    HB3  ALA  80           2HB      ALA  80 -41.150   9.506   4.025
  630    H    GLN  81           H        GLN  81 -39.633   6.417   3.279
  631    HA   GLN  81           HA       GLN  81 -36.997   7.338   3.663
  632    HB2  GLN  81           2HB      GLN  81 -38.145   4.604   3.058
  633    HB3  GLN  81           3HB      GLN  81 -36.412   4.857   3.303
  634    HG2  GLN  81           2HG      GLN  81 -36.723   5.695   5.536
  635    HG3  GLN  81           3HG      GLN  81 -38.477   5.739   5.353
  636   HE21  GLN  81          1HE2      GLN  81 -39.585   3.643   4.983
  637   HE22  GLN  81          2HE2      GLN  81 -38.889   2.179   5.707
  638    H    ILE  82           H        ILE  82 -38.438   5.962   0.623
  639    HA   ILE  82           HA       ILE  82 -35.956   6.257  -0.837
  640    HB   ILE  82           HB       ILE  82 -38.840   5.961  -1.626
  641   HG12  ILE  82          2HG1      ILE  82 -36.375   4.306  -2.336
  642   HG13  ILE  82          3HG1      ILE  82 -37.147   4.148  -0.755
  643   HG21  ILE  82          1HG2      ILE  82 -36.499   6.531  -3.495
  644   HG22  ILE  82          2HG2      ILE  82 -38.063   5.862  -4.026
  645   HG23  ILE  82          3HG2      ILE  82 -37.991   7.480  -3.321
  646   HD11  ILE  82          3HD1      ILE  82 -39.279   3.600  -1.762
  647   HD12  ILE  82          1HD1      ILE  82 -38.558   3.719  -3.392
  648   HD13  ILE  82          2HD1      ILE  82 -37.975   2.481  -2.263
  649    H    ALA  83           H        ALA  83 -38.776   8.491  -0.606
  650    HA   ALA  83           HA       ALA  83 -37.707  10.610  -2.090
  651    HB1  ALA  83           3HB      ALA  83 -40.009  10.464  -1.135
  652    HB2  ALA  83           1HB      ALA  83 -39.338  10.847   0.464
  653    HB3  ALA  83           2HB      ALA  83 -39.213  12.034  -0.842
  654    H    GLN  84           H        GLN  84 -36.913   9.712   1.261
  655    HA   GLN  84           HA       GLN  84 -35.231  12.027   1.763
  656    HB2  GLN  84           2HB      GLN  84 -34.953   9.355   3.162
  657    HB3  GLN  84           3HB      GLN  84 -34.414  10.935   3.690
  658    HG2  GLN  84           2HG      GLN  84 -37.153   9.764   3.749
  659    HG3  GLN  84           3HG      GLN  84 -36.257  10.473   5.034
  660   HE21  GLN  84          1HE2      GLN  84 -38.619  11.020   2.612
  661   HE22  GLN  84          2HE2      GLN  84 -38.818  12.758   2.887
  662    H    ALA  85           H        ALA  85 -34.657   8.723   0.475
  663    HA   ALA  85           HA       ALA  85 -31.781   8.926   0.526
  664    HB1  ALA  85           3HB      ALA  85 -33.002   6.773   0.592
  665    HB2  ALA  85           1HB      ALA  85 -33.642   7.077  -1.040
  666    HB3  ALA  85           2HB      ALA  85 -31.902   6.844  -0.798
  667    H    LEU  86           H        LEU  86 -34.263   9.922  -1.762
  668    HA   LEU  86           HA       LEU  86 -32.284  10.403  -3.900
  669    HB2  LEU  86           2HB      LEU  86 -35.228  11.102  -3.906
  670    HB3  LEU  86           3HB      LEU  86 -34.119  11.046  -5.261
  671    HG   LEU  86           HG       LEU  86 -35.570   8.838  -3.864
  672   HD11  LEU  86          1HD1      LEU  86 -36.137   9.793  -6.112
  673   HD12  LEU  86          2HD1      LEU  86 -34.613   9.145  -6.733
  674   HD13  LEU  86          3HD1      LEU  86 -35.866   8.040  -6.126
  675   HD21  LEU  86          3HD2      LEU  86 -33.285   7.937  -3.551
  676   HD22  LEU  86          1HD2      LEU  86 -34.125   7.078  -4.815
  677   HD23  LEU  86          2HD2      LEU  86 -32.898   8.293  -5.249
  678    H    LEU  87           H        LEU  87 -34.230  12.315  -1.579
  679    HA   LEU  87           HA       LEU  87 -33.391  14.924  -2.180
  680    HB2  LEU  87           2HB      LEU  87 -35.153  14.568  -0.622
  681    HB3  LEU  87           3HB      LEU  87 -34.276  13.291   0.161
  682    HG   LEU  87           HG       LEU  87 -32.659  15.248   1.022
  683   HD11  LEU  87          1HD1      LEU  87 -35.498  16.329   0.757
  684   HD12  LEU  87          2HD1      LEU  87 -34.127  17.165   1.551
  685   HD13  LEU  87          3HD1      LEU  87 -34.116  16.871  -0.211
  686   HD21  LEU  87          3HD2      LEU  87 -33.982  15.253   3.092
  687   HD22  LEU  87          1HD2      LEU  87 -35.300  14.400   2.255
  688   HD23  LEU  87          2HD2      LEU  87 -33.714  13.617   2.480
  689    H    GLY  88           H        GLY  88 -31.782  12.321  -0.342
  690    HA2  GLY  88           HA2      GLY  88 -29.391  12.054  -0.811
  691    HA3  GLY  88           HA3      GLY  88 -29.168  13.791  -0.622
  692    H    ALA  89           H        ALA  89 -31.239  12.064   1.678
  693    HA   ALA  89           HA       ALA  89 -29.630  12.754   3.953
  694    HB1  ALA  89           3HB      ALA  89 -31.187  11.269   5.164
  695    HB2  ALA  89           1HB      ALA  89 -32.059  12.356   4.065
  696    HB3  ALA  89           2HB      ALA  89 -31.818  10.649   3.624
  697    H    GLU  90           H        GLU  90 -30.094   9.632   2.243
  698    HA   GLU  90           HA       GLU  90 -27.301   8.992   2.304
  699    HB2  GLU  90           2HB      GLU  90 -27.499   6.818   3.472
  700    HB3  GLU  90           3HB      GLU  90 -27.670   8.197   4.544
  701    HG2  GLU  90           2HG      GLU  90 -30.140   7.882   4.575
  702    HG3  GLU  90           3HG      GLU  90 -29.976   6.498   3.492
  703    H    GLU  91           H        GLU  91 -26.785   7.454   0.713
  704    HA   GLU  91           HA       GLU  91 -28.859   6.547  -1.192
  705    HB2  GLU  91           2HB      GLU  91 -26.661   7.128  -1.986
  706    HB3  GLU  91           3HB      GLU  91 -25.865   6.006  -0.882
  707    HG2  GLU  91           2HG      GLU  91 -27.946   4.926  -2.776
  708    HG3  GLU  91           3HG      GLU  91 -26.414   5.447  -3.458
  709    H    ARG  92           H        ARG  92 -30.135   4.931  -0.733
  710    HA   ARG  92           HA       ARG  92 -29.257   2.539   0.774
  711    HB2  ARG  92           2HB      ARG  92 -30.010   4.268   2.447
  712    HB3  ARG  92           3HB      ARG  92 -31.574   4.328   1.653
  713    HG2  ARG  92           2HG      ARG  92 -31.757   2.985   3.642
  714    HG3  ARG  92           3HG      ARG  92 -31.968   1.944   2.241
  715    HD2  ARG  92           2HD      ARG  92 -30.621   0.816   3.907
  716    HD3  ARG  92           3HD      ARG  92 -29.621   1.141   2.486
  717    HE   ARG  92           HE       ARG  92 -29.358   3.303   4.385
  718   HH11  ARG  92          2HH1      ARG  92 -28.253  -0.024   4.056
  719   HH12  ARG  92          1HH1      ARG  92 -26.862   0.285   5.062
  720   HH21  ARG  92          2HH2      ARG  92 -27.726   3.601   5.577
  721   HH22  ARG  92          1HH2      ARG  92 -26.541   2.338   5.940
  722    H    LYS  93           H        LYS  93 -30.289   0.726   0.203
  723    HA   LYS  93           HA       LYS  93 -32.396   0.712  -1.865
  724    HB2  LYS  93           2HB      LYS  93 -30.550  -0.851  -2.003
  725    HB3  LYS  93           3HB      LYS  93 -31.013  -1.552  -0.430
  726    HG2  LYS  93           2HG      LYS  93 -33.303  -2.012  -1.651
  727    HG3  LYS  93           3HG      LYS  93 -32.368  -1.697  -3.118
  728    HD2  LYS  93           2HD      LYS  93 -31.769  -3.779  -0.993
  729    HD3  LYS  93           3HD      LYS  93 -32.465  -4.091  -2.587
  730    HE2  LYS  93           2HE      LYS  93 -30.356  -3.190  -3.634
  731    HE3  LYS  93           3HE      LYS  93 -29.662  -3.008  -2.014
  732    HZ1  LYS  93           HZ1      LYS  93 -28.987  -5.101  -3.025
  733    HZ2  LYS  93           HZ2      LYS  93 -29.948  -5.442  -1.740
  734    HZ3  LYS  93           HZ3      LYS  93 -30.539  -5.545  -3.275
  735    H    VAL  94           H        VAL  94 -34.480   0.587  -1.480
  736    HA   VAL  94           HA       VAL  94 -35.547  -0.434   1.113
  737    HB   VAL  94           HB       VAL  94 -36.828   1.938  -0.245
  738   HG11  VAL  94          1HG1      VAL  94 -37.762   2.366   2.000
  739   HG12  VAL  94          2HG1      VAL  94 -38.153   0.739   1.470
  740   HG13  VAL  94          3HG1      VAL  94 -36.853   0.987   2.654
  741   HG21  VAL  94          3HG2      VAL  94 -35.797   3.488   1.397
  742   HG22  VAL  94          1HG2      VAL  94 -34.720   2.181   1.943
  743   HG23  VAL  94          2HG2      VAL  94 -34.604   2.825   0.285
  744    H    GLU  95           H        GLU  95 -37.586  -1.353   0.969
  745    HA   GLU  95           HA       GLU  95 -38.353  -2.420  -1.669
  746    HB2  GLU  95           2HB      GLU  95 -39.904  -3.780  -0.365
  747    HB3  GLU  95           3HB      GLU  95 -38.255  -3.881   0.286
  748    HG2  GLU  95           2HG      GLU  95 -38.851  -2.284   2.091
  749    HG3  GLU  95           3HG      GLU  95 -40.486  -2.145   1.458
  750    H    ILE  96           H        ILE  96 -40.623  -2.168  -2.437
  751    HA   ILE  96           HA       ILE  96 -42.431  -0.456  -1.125
  752    HB   ILE  96           HB       ILE  96 -42.508   1.000  -3.506
  753   HG12  ILE  96          2HG1      ILE  96 -40.458   2.216  -3.734
  754   HG13  ILE  96          3HG1      ILE  96 -39.670   1.215  -2.516
  755   HG21  ILE  96          1HG2      ILE  96 -41.318   2.063  -0.970
  756   HG22  ILE  96          2HG2      ILE  96 -42.198   2.936  -2.226
  757   HG23  ILE  96          3HG2      ILE  96 -43.061   1.770  -1.216
  758   HD11  ILE  96          3HD1      ILE  96 -39.139  -0.396  -3.973
  759   HD12  ILE  96          1HD1      ILE  96 -40.693  -0.258  -4.855
  760   HD13  ILE  96          2HD1      ILE  96 -39.363   0.873  -5.179
  761    H    ALA  97           H        ALA  97 -44.488  -0.476  -2.048
  762    HA   ALA  97           HA       ALA  97 -44.921  -2.689  -3.939
  763    HB1  ALA  97           3HB      ALA  97 -46.321  -2.354  -1.809
  764    HB2  ALA  97           1HB      ALA  97 -47.097  -1.020  -2.694
  765    HB3  ALA  97           2HB      ALA  97 -47.209  -2.643  -3.315
  766    H    PHE  98           H        PHE  98 -45.969  -2.573  -5.887
  767    HA   PHE  98           HA       PHE  98 -46.252   0.139  -7.148
  768    HB2  PHE  98           2HB      PHE  98 -45.179  -2.439  -8.349
  769    HB3  PHE  98           3HB      PHE  98 -45.699  -1.062  -9.312
  770    HD1  PHE  98           HD1      PHE  98 -44.594   1.180  -9.043
  771    HD2  PHE  98           HD2      PHE  98 -42.979  -2.409  -7.262
  772    HE1  PHE  98           HE1      PHE  98 -42.423   2.329  -8.674
  773    HE2  PHE  98           HE2      PHE  98 -40.825  -1.248  -6.906
  774    HZ   PHE  98           HZ       PHE  98 -40.564   1.136  -7.561
  775    H    TYR  99           H        TYR  99 -47.902   0.342  -8.756
  776    HA   TYR  99           HA       TYR  99 -49.869  -1.869  -8.821
  777    HB2  TYR  99           2HB      TYR  99 -51.746  -0.571  -8.722
  778    HB3  TYR  99           3HB      TYR  99 -50.749   0.061  -7.429
  779    HD1  TYR  99           HD2      TYR  99 -49.427   2.297  -7.906
  780    HD2  TYR  99           HD1      TYR  99 -52.634   0.799 -10.380
  781    HE1  TYR  99           HE2      TYR  99 -49.821   4.588  -8.809
  782    HE2  TYR  99           HE1      TYR  99 -53.006   3.080 -11.287
  783    HH   TYR  99           HH       TYR  99 -52.379   5.280 -11.220
  784    H    ARG 100           H        ARG 100 -50.689  -2.375 -10.736
  785    HA   ARG 100           HA       ARG 100 -49.418  -1.185 -13.145
  786    HB2  ARG 100           2HB      ARG 100 -51.170  -3.659 -13.084
  787    HB3  ARG 100           3HB      ARG 100 -50.018  -3.140 -14.320
  788    HG2  ARG 100           2HG      ARG 100 -48.198  -3.439 -12.464
  789    HG3  ARG 100           3HG      ARG 100 -49.454  -4.260 -11.548
  790    HD2  ARG 100           2HD      ARG 100 -48.224  -5.965 -12.630
  791    HD3  ARG 100           3HD      ARG 100 -49.754  -5.823 -13.502
  792    HE   ARG 100           HE       ARG 100 -47.377  -4.326 -14.541
  793   HH11  ARG 100          1HH1      ARG 100 -49.271  -7.282 -14.841
  794   HH12  ARG 100          2HH1      ARG 100 -48.783  -7.533 -16.494
  795   HH21  ARG 100          1HH2      ARG 100 -46.951  -4.637 -16.672
  796   HH22  ARG 100          2HH2      ARG 100 -47.462  -6.097 -17.503
  797    H    LYS 101           H        LYS 101 -50.556  -0.240 -14.730
  798    HA   LYS 101           HA       LYS 101 -52.737   1.359 -14.355
  799    HB2  LYS 101           2HB      LYS 101 -51.344   1.785 -16.124
  800    HB3  LYS 101           3HB      LYS 101 -51.449   0.166 -16.785
  801    HG2  LYS 101           2HG      LYS 101 -53.922   1.913 -16.834
  802    HG3  LYS 101           3HG      LYS 101 -52.616   2.199 -17.986
  803    HD2  LYS 101           2HD      LYS 101 -52.687  -0.028 -18.833
  804    HD3  LYS 101           3HD      LYS 101 -53.811  -0.570 -17.606
  805    HE2  LYS 101           2HE      LYS 101 -55.542   0.988 -18.477
  806    HE3  LYS 101           3HE      LYS 101 -54.451   1.425 -19.802
  807    HZ1  LYS 101           HZ1      LYS 101 -55.341  -1.366 -19.235
  808    HZ2  LYS 101           HZ2      LYS 101 -56.044  -0.399 -20.363
  809    HZ3  LYS 101           HZ3      LYS 101 -54.489  -0.873 -20.537
  810    H    ASP 102           H        ASP 102 -53.063  -2.044 -15.240
  811    HA   ASP 102           HA       ASP 102 -55.895  -1.824 -15.859
  812    HB2  ASP 102           2HB      ASP 102 -54.110  -4.231 -15.411
  813    HB3  ASP 102           3HB      ASP 102 -55.800  -4.321 -15.911
  814    H    GLY 103           H        GLY 103 -54.340  -1.778 -12.853
  815    HA2  GLY 103           HA2      GLY 103 -55.665  -1.105 -11.011
  816    HA3  GLY 103           HA3      GLY 103 -56.986  -2.144 -11.522
  817    H    SER 104           H        SER 104 -53.621  -3.280 -11.248
  818    HA   SER 104           HA       SER 104 -54.356  -4.894  -8.812
  819    HB2  SER 104           2HB      SER 104 -52.565  -5.708 -11.125
  820    HB3  SER 104           3HB      SER 104 -52.823  -6.635  -9.635
  821    HG   SER 104           HG       SER 104 -54.184  -7.343 -11.355
  822    H    CYS 105           H        CYS 105 -52.895  -4.908  -7.104
  823    HA   CYS 105           HA       CYS 105 -50.311  -3.508  -7.476
  824    HB2  CYS 105           2HB      CYS 105 -50.685  -2.100  -5.525
  825    HB3  CYS 105           3HB      CYS 105 -51.938  -1.820  -6.744
  826    HG   CYS 105           HG       CYS 105 -53.800  -3.254  -5.681
  827    H    PHE 106           H        PHE 106 -48.610  -4.096  -6.244
  828    HA   PHE 106           HA       PHE 106 -48.897  -6.175  -4.156
  829    HB2  PHE 106           2HB      PHE 106 -47.238  -7.627  -5.480
  830    HB3  PHE 106           3HB      PHE 106 -48.916  -7.622  -5.979
  831    HD1  PHE 106           HD1      PHE 106 -45.582  -6.071  -6.825
  832    HD2  PHE 106           HD2      PHE 106 -49.540  -7.102  -8.193
  833    HE1  PHE 106           HE1      PHE 106 -44.974  -5.367  -9.121
  834    HE2  PHE 106           HE2      PHE 106 -48.919  -6.434 -10.490
  835    HZ   PHE 106           HZ       PHE 106 -46.629  -5.545 -10.962
  836    H    LEU 107           H        LEU 107 -47.136  -6.477  -2.832
  837    HA   LEU 107           HA       LEU 107 -44.775  -4.692  -3.148
  838    HB2  LEU 107           2HB      LEU 107 -46.119  -4.598  -1.011
  839    HB3  LEU 107           3HB      LEU 107 -45.724  -6.277  -0.727
  840    HG   LEU 107           HG       LEU 107 -44.407  -4.790   0.637
  841   HD11  LEU 107          1HD1      LEU 107 -42.175  -5.553   0.321
  842   HD12  LEU 107          2HD1      LEU 107 -43.220  -6.893  -0.211
  843   HD13  LEU 107          3HD1      LEU 107 -42.401  -5.848  -1.393
  844   HD21  LEU 107          3HD2      LEU 107 -43.201  -3.646  -1.860
  845   HD22  LEU 107          1HD2      LEU 107 -44.342  -2.824  -0.744
  846   HD23  LEU 107          2HD2      LEU 107 -42.726  -3.272  -0.192
  847    H    CYS 108           H        CYS 108 -43.058  -5.581  -3.985
  848    HA   CYS 108           HA       CYS 108 -42.440  -8.483  -3.610
  849    HB2  CYS 108           2HB      CYS 108 -42.025  -6.742  -6.075
  850    HB3  CYS 108           3HB      CYS 108 -41.445  -8.421  -5.885
  851    HG   CYS 108           HG       CYS 108 -43.684  -8.197  -7.441
  852    H    LEU 109           H        LEU 109 -39.991  -8.872  -3.781
  853    HA   LEU 109           HA       LEU 109 -38.711  -6.929  -1.991
  854    HB2  LEU 109           2HB      LEU 109 -37.662  -9.547  -3.115
  855    HB3  LEU 109           3HB      LEU 109 -36.973  -8.626  -1.783
  856    HG   LEU 109           HG       LEU 109 -39.693 -10.017  -1.779
  857   HD11  LEU 109          1HD1      LEU 109 -37.098 -10.684  -0.337
  858   HD12  LEU 109          2HD1      LEU 109 -38.644 -11.550  -0.184
  859   HD13  LEU 109          3HD1      LEU 109 -37.776 -11.560  -1.728
  860   HD21  LEU 109          3HD2      LEU 109 -39.767  -8.050  -0.307
  861   HD22  LEU 109          1HD2      LEU 109 -39.692  -9.528   0.656
  862   HD23  LEU 109          2HD2      LEU 109 -38.233  -8.534   0.452
  863    H    VAL 110           H        VAL 110 -39.018  -5.376  -3.889
  864    HA   VAL 110           HA       VAL 110 -37.395  -5.470  -6.197
  865    HB   VAL 110           HB       VAL 110 -38.012  -3.041  -6.417
  866   HG11  VAL 110          1HG1      VAL 110 -39.333  -4.834  -7.448
  867   HG12  VAL 110          2HG1      VAL 110 -40.256  -5.052  -5.946
  868   HG13  VAL 110          3HG1      VAL 110 -40.384  -3.548  -6.874
  869   HG21  VAL 110          3HG2      VAL 110 -39.655  -3.638  -3.902
  870   HG22  VAL 110          1HG2      VAL 110 -38.321  -2.471  -4.045
  871   HG23  VAL 110          2HG2      VAL 110 -39.837  -2.269  -4.969
  872    H    ASP 111           H        ASP 111 -35.550  -4.302  -6.831
  873    HA   ASP 111           HA       ASP 111 -33.675  -4.004  -4.522
  874    HB2  ASP 111           2HB      ASP 111 -33.564  -5.922  -6.278
  875    HB3  ASP 111           3HB      ASP 111 -32.798  -4.720  -7.310
  876    H    VAL 112           H        VAL 112 -34.467  -1.755  -4.352
  877    HA   VAL 112           HA       VAL 112 -33.980   0.085  -6.531
  878    HB   VAL 112           HB       VAL 112 -34.881   0.640  -3.681
  879   HG11  VAL 112          1HG1      VAL 112 -35.615   2.120  -6.227
  880   HG12  VAL 112          2HG1      VAL 112 -36.004   2.570  -4.562
  881   HG13  VAL 112          3HG1      VAL 112 -34.332   2.667  -5.115
  882   HG21  VAL 112          3HG2      VAL 112 -37.182   0.516  -4.722
  883   HG22  VAL 112          1HG2      VAL 112 -36.434  -0.274  -6.137
  884   HG23  VAL 112          2HG2      VAL 112 -36.385  -1.041  -4.541
  885    H    VAL 113           H        VAL 113 -31.639  -0.484  -6.582
  886    HA   VAL 113           HA       VAL 113 -30.061   1.251  -4.702
  887    HB   VAL 113           HB       VAL 113 -29.771  -1.135  -4.320
  888   HG11  VAL 113          1HG1      VAL 113 -28.284  -1.268  -6.969
  889   HG12  VAL 113          2HG1      VAL 113 -28.481  -2.558  -5.771
  890   HG13  VAL 113          3HG1      VAL 113 -29.887  -1.973  -6.669
  891   HG21  VAL 113          3HG2      VAL 113 -27.239   0.264  -5.249
  892   HG22  VAL 113          1HG2      VAL 113 -28.034   0.463  -3.668
  893   HG23  VAL 113          2HG2      VAL 113 -27.346  -1.100  -4.122
  894    HA   PRO 114           HA       PRO 114 -28.941   3.330  -8.497
  895    HB2  PRO 114           2HB      PRO 114 -27.521   5.414  -7.583
  896    HB3  PRO 114           3HB      PRO 114 -29.227   5.201  -7.170
  897    HG2  PRO 114           2HG      PRO 114 -26.800   4.423  -5.539
  898    HG3  PRO 114           3HG      PRO 114 -28.255   5.348  -5.020
  899    HD2  PRO 114           2HD      PRO 114 -27.949   2.635  -4.606
  900    HD3  PRO 114           3HD      PRO 114 -29.538   3.410  -4.856
  901    H    VAL 115           H        VAL 115 -26.664   4.622  -9.280
  902    HA   VAL 115           HA       VAL 115 -24.475   2.601  -9.157
  903    HB   VAL 115           HB       VAL 115 -23.969   3.104 -11.519
  904   HG11  VAL 115          1HG1      VAL 115 -25.612   1.540 -12.422
  905   HG12  VAL 115          2HG1      VAL 115 -25.053   1.019 -10.824
  906   HG13  VAL 115          3HG1      VAL 115 -26.651   1.773 -11.000
  907   HG21  VAL 115          3HG2      VAL 115 -25.656   3.965 -13.011
  908   HG22  VAL 115          1HG2      VAL 115 -26.777   4.237 -11.650
  909   HG23  VAL 115          2HG2      VAL 115 -25.269   5.167 -11.776
  910    H    LYS 116           H        LYS 116 -22.569   3.226  -8.795
  911    HA   LYS 116           HA       LYS 116 -21.902   6.116  -8.516
  912    HB2  LYS 116           2HB      LYS 116 -21.017   3.780  -6.763
  913    HB3  LYS 116           3HB      LYS 116 -20.491   5.432  -6.576
  914    HG2  LYS 116           2HG      LYS 116 -22.338   5.997  -5.399
  915    HG3  LYS 116           3HG      LYS 116 -23.414   5.330  -6.610
  916    HD2  LYS 116           2HD      LYS 116 -23.919   4.224  -4.618
  917    HD3  LYS 116           3HD      LYS 116 -23.053   3.041  -5.608
  918    HE2  LYS 116           2HE      LYS 116 -20.987   3.440  -4.312
  919    HE3  LYS 116           3HE      LYS 116 -21.769   4.764  -3.436
  920    HZ1  LYS 116           HZ1      LYS 116 -22.583   1.915  -3.276
  921    HZ2  LYS 116           HZ2      LYS 116 -21.824   2.762  -2.101
  922    HZ3  LYS 116           HZ3      LYS 116 -23.359   3.151  -2.530
  923    H    ASN 117           H        ASN 117 -19.670   6.610  -8.576
  924    HA   ASN 117           HA       ASN 117 -18.221   5.110 -10.715
  925    HB2  ASN 117           2HB      ASN 117 -17.051   7.045 -11.210
  926    HB3  ASN 117           3HB      ASN 117 -18.661   7.632 -10.858
  927   HD21  ASN 117          1HD2      ASN 117 -18.964   8.662  -8.601
  928   HD22  ASN 117          2HD2      ASN 117 -17.522   9.423  -7.943
  929    H    GLU 118           H        GLU 118 -15.640   5.377 -10.356
  930    HA   GLU 118           HA       GLU 118 -14.973   3.466  -8.372
  931    HB2  GLU 118           2HB      GLU 118 -12.679   3.815  -9.050
  932    HB3  GLU 118           3HB      GLU 118 -13.742   3.756 -10.454
  933    HG2  GLU 118           2HG      GLU 118 -13.674   6.255 -10.594
  934    HG3  GLU 118           3HG      GLU 118 -12.585   6.292  -9.205
  935    H    ASP 119           H        ASP 119 -15.117   6.957  -8.013
  936    HA   ASP 119           HA       ASP 119 -13.631   7.077  -5.529
  937    HB2  ASP 119           2HB      ASP 119 -14.158   8.973  -7.177
  938    HB3  ASP 119           3HB      ASP 119 -15.775   9.005  -6.471
  939    H    GLY 120           H        GLY 120 -16.815   5.914  -6.278
  940    HA2  GLY 120           HA2      GLY 120 -18.218   4.784  -4.783
  941    HA3  GLY 120           HA3      GLY 120 -17.527   5.653  -3.411
  942    H    ALA 121           H        ALA 121 -18.145   7.958  -5.763
  943    HA   ALA 121           HA       ALA 121 -20.614   8.808  -4.423
  944    HB1  ALA 121           3HB      ALA 121 -20.246  10.944  -5.525
  945    HB2  ALA 121           1HB      ALA 121 -18.713  10.400  -4.809
  946    HB3  ALA 121           2HB      ALA 121 -18.995  10.249  -6.563
  947    H    VAL 122           H        VAL 122 -22.564   9.083  -5.240
  948    HA   VAL 122           HA       VAL 122 -23.294   7.357  -7.442
  949    HB   VAL 122           HB       VAL 122 -24.533   7.266  -5.428
  950   HG11  VAL 122          1HG1      VAL 122 -26.062   8.924  -4.624
  951   HG12  VAL 122          2HG1      VAL 122 -24.437   9.623  -4.652
  952   HG13  VAL 122          3HG1      VAL 122 -25.619  10.057  -5.910
  953   HG21  VAL 122          3HG2      VAL 122 -26.254   8.340  -7.675
  954   HG22  VAL 122          1HG2      VAL 122 -25.603   6.694  -7.549
  955   HG23  VAL 122          2HG2      VAL 122 -26.754   7.281  -6.339
  956    H    ILE 123           H        ILE 123 -22.755   8.001  -9.349
  957    HA   ILE 123           HA       ILE 123 -23.324  10.748 -10.217
  958    HB   ILE 123           HB       ILE 123 -21.993  10.515 -11.988
  959   HG12  ILE 123          2HG1      ILE 123 -22.780   8.621 -13.168
  960   HG13  ILE 123          3HG1      ILE 123 -21.046   8.533 -12.992
  961   HG21  ILE 123          1HG2      ILE 123 -19.871   9.751 -11.175
  962   HG22  ILE 123          2HG2      ILE 123 -20.785  10.421  -9.812
  963   HG23  ILE 123          3HG2      ILE 123 -20.644   8.666 -10.002
  964   HD11  ILE 123          3HD1      ILE 123 -21.394   6.832 -11.126
  965   HD12  ILE 123          1HD1      ILE 123 -23.115   6.827 -11.590
  966   HD13  ILE 123          2HD1      ILE 123 -21.895   6.328 -12.749
  967    H    MET 124           H        MET 124 -24.737   7.524 -10.642
  968    HA   MET 124           HA       MET 124 -27.025   8.937 -11.887
  969    HB2  MET 124           2HB      MET 124 -25.542   6.714 -13.252
  970    HB3  MET 124           3HB      MET 124 -27.301   6.695 -13.304
  971    HG2  MET 124           2HG      MET 124 -27.118   7.984 -15.088
  972    HG3  MET 124           3HG      MET 124 -26.833   9.302 -13.967
  973    HE1  MET 124           3HE      MET 124 -25.707  10.746 -15.771
  974    HE2  MET 124           1HE      MET 124 -24.878  10.833 -14.203
  975    HE3  MET 124           2HE      MET 124 -23.926  10.760 -15.698
  976    H    PHE 125           H        PHE 125 -28.935   8.073 -11.750
  977    HA   PHE 125           HA       PHE 125 -29.435   6.276  -9.396
  978    HB2  PHE 125           2HB      PHE 125 -30.811   8.730 -10.532
  979    HB3  PHE 125           3HB      PHE 125 -31.773   7.508  -9.732
  980    HD1  PHE 125           HD1      PHE 125 -28.738   7.557  -7.865
  981    HD2  PHE 125           HD2      PHE 125 -32.317   9.830  -8.660
  982    HE1  PHE 125           HE1      PHE 125 -28.504   8.699  -5.686
  983    HE2  PHE 125           HE2      PHE 125 -32.042  11.001  -6.487
  984    HZ   PHE 125           HZ       PHE 125 -30.138  10.432  -4.997
  985    H    ILE 126           H        ILE 126 -29.032   4.466 -10.730
  986    HA   ILE 126           HA       ILE 126 -31.255   3.846 -12.630
  987    HB   ILE 126           HB       ILE 126 -28.688   2.324 -12.207
  988   HG12  ILE 126          2HG1      ILE 126 -29.640   4.269 -14.370
  989   HG13  ILE 126          3HG1      ILE 126 -28.319   4.540 -13.248
  990   HG21  ILE 126          1HG2      ILE 126 -30.605   1.989 -14.536
  991   HG22  ILE 126          2HG2      ILE 126 -29.377   0.868 -13.920
  992   HG23  ILE 126          3HG2      ILE 126 -30.919   1.109 -13.073
  993   HD11  ILE 126          3HD1      ILE 126 -27.377   3.932 -15.330
  994   HD12  ILE 126          1HD1      ILE 126 -27.157   2.546 -14.210
  995   HD13  ILE 126          2HD1      ILE 126 -28.414   2.493 -15.465
  996    H    LEU 127           H        LEU 127 -32.610   4.000 -10.768
  997    HA   LEU 127           HA       LEU 127 -32.451   1.844  -8.783
  998    HB2  LEU 127           2HB      LEU 127 -34.493   4.088  -9.026
  999    HB3  LEU 127           3HB      LEU 127 -34.319   2.948  -7.708
 1000    HG   LEU 127           HG       LEU 127 -32.283   5.051  -8.556
 1001   HD11  LEU 127          1HD1      LEU 127 -32.345   5.882  -6.288
 1002   HD12  LEU 127          2HD1      LEU 127 -33.984   5.955  -6.990
 1003   HD13  LEU 127          3HD1      LEU 127 -33.543   4.682  -5.817
 1004   HD21  LEU 127          3HD2      LEU 127 -31.008   4.155  -6.525
 1005   HD22  LEU 127          1HD2      LEU 127 -32.078   2.754  -6.610
 1006   HD23  LEU 127          2HD2      LEU 127 -31.023   3.157  -7.987
 1007    H    ASN 128           H        ASN 128 -32.385   0.184 -10.063
 1008    HA   ASN 128           HA       ASN 128 -34.376  -0.928 -11.704
 1009    HB2  ASN 128           2HB      ASN 128 -32.398  -2.182  -9.739
 1010    HB3  ASN 128           3HB      ASN 128 -33.424  -3.141 -10.786
 1011   HD21  ASN 128          2HD2      ASN 128 -30.870  -0.521 -11.076
 1012   HD22  ASN 128          1HD2      ASN 128 -30.256  -1.256 -12.538
 1013    H    PHE 129           H        PHE 129 -36.591  -0.915 -11.133
 1014    HA   PHE 129           HA       PHE 129 -37.302  -1.682  -8.396
 1015    HB2  PHE 129           2HB      PHE 129 -39.107  -1.011 -10.738
 1016    HB3  PHE 129           3HB      PHE 129 -39.530  -1.097  -9.031
 1017    HD1  PHE 129           HD1      PHE 129 -37.942   0.590  -7.510
 1018    HD2  PHE 129           HD2      PHE 129 -39.014   1.124 -11.648
 1019    HE1  PHE 129           HE1      PHE 129 -37.573   3.039  -7.291
 1020    HE2  PHE 129           HE2      PHE 129 -38.662   3.568 -11.423
 1021    HZ   PHE 129           HZ       PHE 129 -37.924   4.529  -9.248
 1022    H    GLU 130           H        GLU 130 -35.974  -3.742  -9.248
 1023    HA   GLU 130           HA       GLU 130 -37.499  -5.464 -11.019
 1024    HB2  GLU 130           2HB      GLU 130 -35.742  -7.166 -10.483
 1025    HB3  GLU 130           3HB      GLU 130 -35.211  -5.634 -11.239
 1026    HG2  GLU 130           2HG      GLU 130 -34.354  -4.787  -9.191
 1027    HG3  GLU 130           3HG      GLU 130 -35.097  -6.069  -8.259
 1028    H    VAL 131           H        VAL 131 -39.240  -6.169 -10.389
 1029    HA   VAL 131           HA       VAL 131 -40.186  -7.070  -7.858
 1030    HB   VAL 131           HB       VAL 131 -40.985  -7.526 -10.706
 1031   HG11  VAL 131          1HG1      VAL 131 -43.195  -8.496  -9.787
 1032   HG12  VAL 131          2HG1      VAL 131 -41.800  -9.569  -9.871
 1033   HG13  VAL 131          3HG1      VAL 131 -42.257  -8.867  -8.318
 1034   HG21  VAL 131          3HG2      VAL 131 -41.428  -5.319  -9.643
 1035   HG22  VAL 131          1HG2      VAL 131 -42.922  -6.152 -10.095
 1036   HG23  VAL 131          2HG2      VAL 131 -42.400  -6.126  -8.397
 1037    H    VAL 132           H        VAL 132 -39.302  -8.648  -6.663
 1038    HA   VAL 132           HA       VAL 132 -38.936 -11.244  -7.981
 1039    HB   VAL 132           HB       VAL 132 -36.733 -10.354  -8.164
 1040   HG11  VAL 132          1HG1      VAL 132 -36.680  -8.731  -6.339
 1041   HG12  VAL 132          2HG1      VAL 132 -36.656 -10.050  -5.145
 1042   HG13  VAL 132          3HG1      VAL 132 -35.299  -9.827  -6.267
 1043   HG21  VAL 132          3HG2      VAL 132 -36.759 -12.460  -5.969
 1044   HG22  VAL 132          1HG2      VAL 132 -37.008 -12.773  -7.706
 1045   HG23  VAL 132          2HG2      VAL 132 -35.465 -12.128  -7.133
 1046    H    MET 133           H        MET 133 -39.418 -12.982  -6.647
 1047    HA   MET 133           HA       MET 133 -39.835 -12.568  -3.745
 1048    HB2  MET 133           2HB      MET 133 -41.978 -13.639  -5.630
 1049    HB3  MET 133           3HB      MET 133 -42.020 -13.781  -3.867
 1050    HG2  MET 133           2HG      MET 133 -41.872 -11.284  -3.710
 1051    HG3  MET 133           3HG      MET 133 -42.059 -11.191  -5.459
 1052    HE1  MET 133           3HE      MET 133 -45.711 -12.263  -6.111
 1053    HE2  MET 133           1HE      MET 133 -44.232 -11.534  -6.770
 1054    HE3  MET 133           2HE      MET 133 -44.245 -13.249  -6.295
 1055    H    GLU 134           H        GLU 134 -39.654 -14.404  -2.504
 1056    HA   GLU 134           HA       GLU 134 -38.052 -16.567  -3.566
 1057    HB2  GLU 134           2HB      GLU 134 -38.005 -17.408  -1.303
 1058    HB3  GLU 134           3HB      GLU 134 -37.657 -15.680  -1.341
 1059    HG2  GLU 134           2HG      GLU 134 -39.989 -15.194  -0.602
 1060    HG3  GLU 134           3HG      GLU 134 -40.334 -16.925  -0.563
 1061    H    LYS 135           H        LYS 135 -38.493 -18.828  -3.467
 1062    HA   LYS 135           HA       LYS 135 -41.325 -19.606  -3.981
 1063    HB2  LYS 135           2HB      LYS 135 -38.828 -20.107  -5.657
 1064    HB3  LYS 135           3HB      LYS 135 -40.405 -20.834  -5.941
 1065    HG2  LYS 135           2HG      LYS 135 -41.403 -18.600  -6.326
 1066    HG3  LYS 135           3HG      LYS 135 -39.844 -17.840  -5.973
 1067    HD2  LYS 135           2HD      LYS 135 -38.840 -19.083  -7.924
 1068    HD3  LYS 135           3HD      LYS 135 -40.465 -19.669  -8.313
 1069    HE2  LYS 135           2HE      LYS 135 -40.046 -17.753  -9.696
 1070    HE3  LYS 135           3HE      LYS 135 -41.247 -17.288  -8.488
 1071    HZ1  LYS 135           HZ1      LYS 135 -39.446 -16.189  -7.228
 1072    HZ2  LYS 135           HZ2      LYS 135 -38.340 -16.660  -8.341
 1073    HZ3  LYS 135           HZ3      LYS 135 -39.508 -15.602  -8.754
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1 -60.848 -41.556 -10.874
    2    H2   MET   1           2H       MET   1 -61.283 -43.071 -11.296
    3    H3   MET   1           3H       MET   1 -60.642 -42.071 -12.418
    4    HA   MET   1           HA       MET   1 -59.004 -43.695 -11.720
    5    HB2  MET   1           2HB      MET   1 -58.421 -40.844 -10.798
    6    HB3  MET   1           3HB      MET   1 -57.209 -42.122 -10.891
    7    HG2  MET   1           2HG      MET   1 -57.626 -42.372 -13.314
    8    HG3  MET   1           3HG      MET   1 -58.791 -41.041 -13.247
    9    HE1  MET   1           3HE      MET   1 -56.303 -41.194 -15.254
   10    HE2  MET   1           1HE      MET   1 -57.483 -39.862 -15.231
   11    HE3  MET   1           2HE      MET   1 -55.741 -39.509 -15.193
   12    HA   PRO   2           HA       PRO   2 -58.969 -45.008  -7.436
   13    HB2  PRO   2           2HB      PRO   2 -56.018 -45.422  -7.881
   14    HB3  PRO   2           3HB      PRO   2 -57.225 -46.547  -7.184
   15    HG2  PRO   2           2HG      PRO   2 -56.361 -46.889  -9.726
   16    HG3  PRO   2           3HG      PRO   2 -58.109 -47.053  -9.352
   17    HD2  PRO   2           2HD      PRO   2 -56.651 -44.643 -10.486
   18    HD3  PRO   2           3HD      PRO   2 -58.162 -45.421 -11.055
   19    H    VAL   3           H        VAL   3 -58.193 -44.336  -5.351
   20    HA   VAL   3           HA       VAL   3 -57.437 -41.533  -5.196
   21    HB   VAL   3           HB       VAL   3 -57.768 -43.588  -2.979
   22   HG11  VAL   3          1HG1      VAL   3 -56.422 -41.701  -2.166
   23   HG12  VAL   3          2HG1      VAL   3 -57.584 -40.540  -2.863
   24   HG13  VAL   3          3HG1      VAL   3 -58.052 -41.592  -1.511
   25   HG21  VAL   3          3HG2      VAL   3 -59.871 -43.210  -4.223
   26   HG22  VAL   3          1HG2      VAL   3 -59.955 -42.470  -2.624
   27   HG23  VAL   3          2HG2      VAL   3 -59.669 -41.453  -4.053
   28    H    ARG   4           H        ARG   4 -55.514 -40.661  -5.026
   29    HA   ARG   4           HA       ARG   4 -53.132 -42.226  -4.115
   30    HB2  ARG   4           2HB      ARG   4 -51.825 -41.374  -5.962
   31    HB3  ARG   4           3HB      ARG   4 -53.197 -42.312  -6.546
   32    HG2  ARG   4           2HG      ARG   4 -54.394 -40.319  -7.224
   33    HG3  ARG   4           3HG      ARG   4 -53.229 -39.265  -6.407
   34    HD2  ARG   4           2HD      ARG   4 -51.446 -40.014  -7.934
   35    HD3  ARG   4           3HD      ARG   4 -52.578 -41.071  -8.772
   36    HE   ARG   4           HE       ARG   4 -52.435 -38.107  -8.867
   37   HH11  ARG   4          1HH1      ARG   4 -54.273 -40.907  -9.904
   38   HH12  ARG   4          2HH1      ARG   4 -55.046 -40.029 -11.199
   39   HH21  ARG   4          1HH2      ARG   4 -53.475 -37.053 -10.522
   40   HH22  ARG   4          2HH2      ARG   4 -54.626 -37.901 -11.510
   41    H    ARG   5           H        ARG   5 -54.789 -40.103  -2.897
   42    HA   ARG   5           HA       ARG   5 -53.778 -37.539  -2.966
   43    HB2  ARG   5           2HB      ARG   5 -55.854 -38.470  -1.773
   44    HB3  ARG   5           3HB      ARG   5 -54.804 -38.799  -0.389
   45    HG2  ARG   5           2HG      ARG   5 -54.234 -36.367  -0.286
   46    HG3  ARG   5           3HG      ARG   5 -55.263 -36.069  -1.701
   47    HD2  ARG   5           2HD      ARG   5 -57.239 -36.883  -0.422
   48    HD3  ARG   5           3HD      ARG   5 -56.202 -37.221   0.961
   49    HE   ARG   5           HE       ARG   5 -56.061 -34.960   1.478
   50   HH11  ARG   5          1HH2      ARG   5 -57.737 -35.211  -1.595
   51   HH12  ARG   5          2HH2      ARG   5 -58.246 -33.546  -1.549
   52   HH21  ARG   5          1HH1      ARG   5 -56.744 -32.856   1.465
   53   HH22  ARG   5          2HH1      ARG   5 -57.696 -32.254   0.140
   54    H    GLY   6           H        GLY   6 -52.234 -36.323  -2.066
   55    HA2  GLY   6           HA2      GLY   6 -50.306 -35.804  -0.786
   56    HA3  GLY   6           HA3      GLY   6 -50.146 -37.489  -0.293
   57    H    HIS   7           H        HIS   7 -50.719 -37.304  -3.658
   58    HA   HIS   7           HA       HIS   7 -48.076 -38.083  -4.465
   59    HB2  HIS   7           2HB      HIS   7 -48.987 -37.891  -6.733
   60    HB3  HIS   7           3HB      HIS   7 -50.093 -38.759  -5.682
   61    HD2  HIS   7           HD2      HIS   7 -49.777 -35.526  -7.723
   62    HE1  HIS   7           HE1      HIS   7 -53.726 -35.502  -6.110
   63    HE2  HIS   7           HE2      HIS   7 -52.138 -34.355  -7.736
   64    H    VAL   8           H        VAL   8 -46.584 -36.967  -5.881
   65    HA   VAL   8           HA       VAL   8 -46.253 -34.146  -5.395
   66    HB   VAL   8           HB       VAL   8 -44.229 -34.454  -6.660
   67   HG11  VAL   8          1HG1      VAL   8 -44.266 -35.008  -4.240
   68   HG12  VAL   8          2HG1      VAL   8 -44.550 -36.714  -4.651
   69   HG13  VAL   8          3HG1      VAL   8 -43.039 -35.920  -5.133
   70   HG21  VAL   8          3HG2      VAL   8 -45.003 -37.363  -7.069
   71   HG22  VAL   8          1HG2      VAL   8 -44.862 -36.128  -8.339
   72   HG23  VAL   8          2HG2      VAL   8 -43.432 -36.634  -7.443
   73    H    ALA   9           H        ALA   9 -46.288 -32.506  -6.868
   74    HA   ALA   9           HA       ALA   9 -47.981 -32.636  -9.211
   75    HB1  ALA   9           3HB      ALA   9 -47.711 -30.601  -7.833
   76    HB2  ALA   9           1HB      ALA   9 -45.976 -30.545  -8.226
   77    HB3  ALA   9           2HB      ALA   9 -47.183 -30.279  -9.493
   78    HA   PRO  10           HA       PRO  10 -45.019 -33.835 -12.371
   79    HB2  PRO  10           2HB      PRO  10 -45.476 -31.993 -14.416
   80    HB3  PRO  10           3HB      PRO  10 -46.440 -33.452 -14.084
   81    HG2  PRO  10           2HG      PRO  10 -46.987 -30.604 -13.187
   82    HG3  PRO  10           3HG      PRO  10 -48.138 -31.785 -13.886
   83    HD2  PRO  10           2HD      PRO  10 -48.022 -31.351 -11.234
   84    HD3  PRO  10           3HD      PRO  10 -48.222 -33.013 -11.854
   85    H    GLN  11           H        GLN  11 -43.008 -33.556 -11.736
   86    HA   GLN  11           HA       GLN  11 -41.982 -31.212 -10.642
   87    HB2  GLN  11           2HB      GLN  11 -39.956 -32.359 -10.332
   88    HB3  GLN  11           3HB      GLN  11 -41.252 -33.524 -10.130
   89    HG2  GLN  11           2HG      GLN  11 -39.423 -33.230 -12.559
   90    HG3  GLN  11           3HG      GLN  11 -39.327 -34.474 -11.326
   91   HE21  GLN  11          2HE2      GLN  11 -39.946 -34.423 -14.408
   92   HE22  GLN  11          1HE2      GLN  11 -41.318 -35.531 -14.483
   93    H    ASN  12           H        ASN  12 -41.901 -32.118 -14.037
   94    HA   ASN  12           HA       ASN  12 -39.579 -30.525 -14.746
   95    HB2  ASN  12           2HB      ASN  12 -41.849 -31.823 -16.322
   96    HB3  ASN  12           3HB      ASN  12 -40.655 -30.784 -17.091
   97   HD21  ASN  12          2HD2      ASN  12 -40.434 -32.950 -18.301
   98   HD22  ASN  12          1HD2      ASN  12 -39.191 -34.013 -17.661
   99    H    THR  13           H        THR  13 -43.097 -29.948 -15.061
  100    HA   THR  13           HA       THR  13 -42.761 -27.191 -15.954
  101    HB   THR  13           HB       THR  13 -44.603 -28.824 -16.537
  102    HG1  THR  13           HG1      THR  13 -46.073 -27.128 -16.739
  103   HG21  THR  13          1HG2      THR  13 -45.855 -27.856 -13.948
  104   HG22  THR  13          2HG2      THR  13 -46.577 -28.931 -15.173
  105   HG23  THR  13          3HG2      THR  13 -45.179 -29.469 -14.222
  106    H    PHE  14           H        PHE  14 -43.526 -28.790 -12.856
  107    HA   PHE  14           HA       PHE  14 -44.038 -26.482 -11.280
  108    HB2  PHE  14           2HB      PHE  14 -44.365 -28.850 -10.642
  109    HB3  PHE  14           3HB      PHE  14 -42.629 -29.087 -10.597
  110    HD1  PHE  14           HD1      PHE  14 -45.510 -27.469  -8.909
  111    HD2  PHE  14           HD2      PHE  14 -41.272 -28.260  -8.729
  112    HE1  PHE  14           HE1      PHE  14 -45.471 -26.735  -6.533
  113    HE2  PHE  14           HE2      PHE  14 -41.237 -27.523  -6.356
  114    HZ   PHE  14           HZ       PHE  14 -43.335 -26.761  -5.256
  115    H    LEU  15           H        LEU  15 -40.970 -28.071 -12.207
  116    HA   LEU  15           HA       LEU  15 -39.302 -26.075 -10.896
  117    HB2  LEU  15           2HB      LEU  15 -38.396 -28.272 -11.274
  118    HB3  LEU  15           3HB      LEU  15 -38.675 -28.149 -13.017
  119    HG   LEU  15           HG       LEU  15 -37.027 -26.381 -13.228
  120   HD11  LEU  15          1HD1      LEU  15 -36.562 -26.682 -10.223
  121   HD12  LEU  15          2HD1      LEU  15 -35.523 -25.757 -11.347
  122   HD13  LEU  15          3HD1      LEU  15 -37.171 -25.245 -11.055
  123   HD21  LEU  15          3HD2      LEU  15 -35.944 -28.738 -11.635
  124   HD22  LEU  15          1HD2      LEU  15 -36.295 -28.729 -13.378
  125   HD23  LEU  15          2HD2      LEU  15 -35.011 -27.692 -12.732
  126    H    ASP  16           H        ASP  16 -40.313 -26.476 -14.350
  127    HA   ASP  16           HA       ASP  16 -39.098 -24.293 -15.520
  128    HB2  ASP  16           2HB      ASP  16 -40.697 -26.033 -16.503
  129    HB3  ASP  16           3HB      ASP  16 -42.016 -24.984 -15.987
  130    H    THR  17           H        THR  17 -41.973 -24.198 -13.445
  131    HA   THR  17           HA       THR  17 -42.509 -21.360 -13.653
  132    HB   THR  17           HB       THR  17 -43.119 -23.245 -11.335
  133    HG1  THR  17           HG1      THR  17 -44.058 -23.924 -13.276
  134   HG21  THR  17          1HG2      THR  17 -44.328 -20.555 -12.105
  135   HG22  THR  17          2HG2      THR  17 -44.988 -21.663 -10.879
  136   HG23  THR  17          3HG2      THR  17 -43.403 -20.921 -10.629
  137    H    ILE  18           H        ILE  18 -40.365 -23.219 -11.518
  138    HA   ILE  18           HA       ILE  18 -39.600 -20.928  -9.880
  139    HB   ILE  18           HB       ILE  18 -38.175 -23.569 -10.284
  140   HG12  ILE  18          2HG1      ILE  18 -40.392 -24.050  -9.441
  141   HG13  ILE  18          3HG1      ILE  18 -39.139 -24.448  -8.295
  142   HG21  ILE  18          1HG2      ILE  18 -37.854 -21.445  -8.142
  143   HG22  ILE  18          2HG2      ILE  18 -37.203 -23.096  -7.999
  144   HG23  ILE  18          3HG2      ILE  18 -36.646 -22.047  -9.296
  145   HD11  ILE  18          3HD1      ILE  18 -40.923 -21.953  -8.229
  146   HD12  ILE  18          1HD1      ILE  18 -41.139 -23.403  -7.232
  147   HD13  ILE  18          2HD1      ILE  18 -39.711 -22.380  -6.995
  148    H    ILE  19           H        ILE  19 -38.357 -22.524 -12.839
  149    HA   ILE  19           HA       ILE  19 -35.986 -21.005 -13.060
  150    HB   ILE  19           HB       ILE  19 -37.790 -21.822 -15.368
  151   HG12  ILE  19          2HG1      ILE  19 -37.286 -23.890 -14.338
  152   HG13  ILE  19          3HG1      ILE  19 -36.177 -23.745 -15.676
  153   HG21  ILE  19          1HG2      ILE  19 -36.156 -20.144 -16.025
  154   HG22  ILE  19          2HG2      ILE  19 -34.849 -21.057 -15.248
  155   HG23  ILE  19          3HG2      ILE  19 -35.671 -21.709 -16.685
  156   HD11  ILE  19          3HD1      ILE  19 -34.405 -22.993 -14.014
  157   HD12  ILE  19          1HD1      ILE  19 -35.577 -23.361 -12.722
  158   HD13  ILE  19          2HD1      ILE  19 -35.019 -24.658 -13.784
  159    H    ARG  20           H        ARG  20 -39.287 -20.300 -14.390
  160    HA   ARG  20           HA       ARG  20 -38.771 -17.622 -15.211
  161    HB2  ARG  20           2HB      ARG  20 -41.179 -19.362 -14.590
  162    HB3  ARG  20           3HB      ARG  20 -41.411 -17.624 -14.627
  163    HG2  ARG  20           2HG      ARG  20 -41.858 -18.109 -16.770
  164    HG3  ARG  20           3HG      ARG  20 -40.166 -17.649 -16.911
  165    HD2  ARG  20           2HD      ARG  20 -40.944 -20.569 -16.572
  166    HD3  ARG  20           3HD      ARG  20 -41.172 -19.772 -18.130
  167    HE   ARG  20           HE       ARG  20 -38.540 -19.164 -17.234
  168   HH11  ARG  20          2HH2      ARG  20 -40.173 -22.018 -18.478
  169   HH12  ARG  20          1HH2      ARG  20 -38.838 -22.389 -19.525
  170   HH21  ARG  20          1HH1      ARG  20 -37.013 -19.631 -18.543
  171   HH22  ARG  20          2HH1      ARG  20 -37.010 -21.094 -19.532
  172    H    LYS  21           H        LYS  21 -39.411 -18.838 -11.968
  173    HA   LYS  21           HA       LYS  21 -39.878 -16.285 -10.708
  174    HB2  LYS  21           2HB      LYS  21 -40.255 -18.718  -9.903
  175    HB3  LYS  21           3HB      LYS  21 -38.571 -18.588  -9.327
  176    HG2  LYS  21           2HG      LYS  21 -39.141 -16.685  -7.933
  177    HG3  LYS  21           3HG      LYS  21 -40.799 -16.631  -8.600
  178    HD2  LYS  21           2HD      LYS  21 -41.274 -18.861  -7.770
  179    HD3  LYS  21           3HD      LYS  21 -39.584 -19.059  -7.269
  180    HE2  LYS  21           2HE      LYS  21 -39.865 -17.143  -5.669
  181    HE3  LYS  21           3HE      LYS  21 -41.570 -17.028  -6.123
  182    HZ1  LYS  21           HZ1      LYS  21 -41.915 -19.238  -5.195
  183    HZ2  LYS  21           HZ2      LYS  21 -40.303 -19.434  -4.899
  184    HZ3  LYS  21           HZ3      LYS  21 -41.127 -18.320  -4.072
  185    H    PHE  22           H        PHE  22 -36.826 -18.167 -11.168
  186    HA   PHE  22           HA       PHE  22 -35.344 -15.768 -10.196
  187    HB2  PHE  22           2HB      PHE  22 -33.577 -17.074  -9.498
  188    HB3  PHE  22           3HB      PHE  22 -35.030 -17.869  -8.949
  189    HD1  PHE  22           HD2      PHE  22 -32.161 -18.063 -11.333
  190    HD2  PHE  22           HD1      PHE  22 -35.550 -20.105  -9.656
  191    HE1  PHE  22           HE2      PHE  22 -31.366 -20.187 -12.329
  192    HE2  PHE  22           HE1      PHE  22 -34.758 -22.248 -10.667
  193    HZ   PHE  22           HZ       PHE  22 -32.667 -22.283 -12.008
  194    H    GLU  23           H        GLU  23 -36.180 -16.829 -13.142
  195    HA   GLU  23           HA       GLU  23 -34.095 -17.272 -14.725
  196    HB2  GLU  23           2HB      GLU  23 -36.436 -17.349 -15.404
  197    HB3  GLU  23           3HB      GLU  23 -36.558 -15.602 -15.370
  198    HG2  GLU  23           2HG      GLU  23 -35.129 -15.384 -17.295
  199    HG3  GLU  23           3HG      GLU  23 -34.655 -17.091 -17.209
  200    H    GLY  24           H        GLY  24 -34.832 -14.021 -13.562
  201    HA2  GLY  24           HA2      GLY  24 -33.546 -12.133 -13.430
  202    HA3  GLY  24           HA3      GLY  24 -32.192 -13.097 -14.014
  203    H    GLN  25           H        GLN  25 -34.390 -13.291 -16.449
  204    HA   GLN  25           HA       GLN  25 -33.100 -11.098 -18.001
  205    HB2  GLN  25           2HB      GLN  25 -34.376 -13.738 -18.773
  206    HB3  GLN  25           3HB      GLN  25 -33.813 -12.553 -19.953
  207    HG2  GLN  25           2HG      GLN  25 -31.553 -12.835 -19.416
  208    HG3  GLN  25           3HG      GLN  25 -31.878 -13.470 -17.809
  209   HE21  GLN  25          2HE2      GLN  25 -32.430 -15.691 -17.517
  210   HE22  GLN  25          1HE2      GLN  25 -32.186 -16.845 -18.833
  211    H    SER  26           H        SER  26 -36.054 -11.657 -16.506
  212    HA   SER  26           HA       SER  26 -37.689 -10.036 -18.361
  213    HB2  SER  26           2HB      SER  26 -39.522 -10.651 -16.794
  214    HB3  SER  26           3HB      SER  26 -38.693 -12.048 -17.496
  215    HG   SER  26           HG       SER  26 -39.001 -12.267 -15.222
  216    H    ARG  27           H        ARG  27 -35.379  -9.016 -16.606
  217    HA   ARG  27           HA       ARG  27 -36.452  -7.413 -14.481
  218    HB2  ARG  27           2HB      ARG  27 -33.756  -7.611 -15.791
  219    HB3  ARG  27           3HB      ARG  27 -34.138  -6.350 -14.616
  220    HG2  ARG  27           2HG      ARG  27 -35.114  -8.397 -13.165
  221    HG3  ARG  27           3HG      ARG  27 -34.011  -9.338 -14.186
  222    HD2  ARG  27           2HD      ARG  27 -32.267  -7.593 -13.623
  223    HD3  ARG  27           3HD      ARG  27 -33.384  -6.892 -12.478
  224    HE   ARG  27           HE       ARG  27 -33.036  -8.562 -10.954
  225   HH11  ARG  27          1HH1      ARG  27 -31.547  -9.792 -13.912
  226   HH12  ARG  27          2HH1      ARG  27 -30.512 -10.854 -13.001
  227   HH21  ARG  27          2HH2      ARG  27 -31.855  -9.992  -9.946
  228   HH22  ARG  27          1HH2      ARG  27 -30.753 -11.046 -10.799
  229    H    LYS  28           H        LYS  28 -36.181  -5.189 -14.176
  230    HA   LYS  28           HA       LYS  28 -36.902  -3.452 -16.465
  231    HB2  LYS  28           2HB      LYS  28 -38.942  -2.682 -15.169
  232    HB3  LYS  28           3HB      LYS  28 -39.019  -4.254 -15.959
  233    HG2  LYS  28           2HG      LYS  28 -38.196  -4.270 -13.091
  234    HG3  LYS  28           3HG      LYS  28 -39.833  -3.746 -13.417
  235    HD2  LYS  28           2HD      LYS  28 -38.655  -6.408 -14.246
  236    HD3  LYS  28           3HD      LYS  28 -39.771  -6.116 -12.909
  237    HE2  LYS  28           2HE      LYS  28 -41.581  -5.570 -14.380
  238    HE3  LYS  28           3HE      LYS  28 -40.520  -5.496 -15.789
  239    HZ1  LYS  28           HZ1      LYS  28 -41.096  -7.970 -14.253
  240    HZ2  LYS  28           HZ2      LYS  28 -41.680  -7.608 -15.736
  241    HZ3  LYS  28           HZ3      LYS  28 -40.076  -7.868 -15.534
  242    H    PHE  29           H        PHE  29 -36.807  -1.209 -16.147
  243    HA   PHE  29           HA       PHE  29 -35.825  -0.066 -13.697
  244    HB2  PHE  29           2HB      PHE  29 -33.482   0.325 -14.353
  245    HB3  PHE  29           3HB      PHE  29 -33.827  -1.363 -14.136
  246    HD1  PHE  29           HD2      PHE  29 -33.791  -2.956 -16.013
  247    HD2  PHE  29           HD1      PHE  29 -32.896   1.225 -16.565
  248    HE1  PHE  29           HE2      PHE  29 -32.748  -3.470 -18.205
  249    HE2  PHE  29           HE1      PHE  29 -31.825   0.699 -18.753
  250    HZ   PHE  29           HZ       PHE  29 -31.757  -1.645 -19.573
  251    H    ILE  30           H        ILE  30 -35.043   2.015 -13.807
  252    HA   ILE  30           HA       ILE  30 -35.713   3.679 -16.172
  253    HB   ILE  30           HB       ILE  30 -36.184   5.500 -14.432
  254   HG12  ILE  30          2HG1      ILE  30 -37.157   4.855 -12.311
  255   HG13  ILE  30          3HG1      ILE  30 -36.785   3.156 -12.573
  256   HG21  ILE  30          1HG2      ILE  30 -37.788   4.478 -15.929
  257   HG22  ILE  30          2HG2      ILE  30 -38.107   3.183 -14.755
  258   HG23  ILE  30          3HG2      ILE  30 -38.531   4.869 -14.365
  259   HD11  ILE  30          3HD1      ILE  30 -34.658   5.324 -12.344
  260   HD12  ILE  30          1HD1      ILE  30 -35.268   4.393 -10.968
  261   HD13  ILE  30          2HD1      ILE  30 -34.406   3.556 -12.263
  262    H    ILE  31           H        ILE  31 -34.576   5.776 -16.157
  263    HA   ILE  31           HA       ILE  31 -31.857   5.630 -14.945
  264    HB   ILE  31           HB       ILE  31 -32.456   6.756 -17.682
  265   HG12  ILE  31          2HG1      ILE  31 -33.033   4.327 -17.767
  266   HG13  ILE  31          3HG1      ILE  31 -31.684   4.793 -18.813
  267   HG21  ILE  31          1HG2      ILE  31 -29.984   6.529 -17.937
  268   HG22  ILE  31          2HG2      ILE  31 -30.459   7.597 -16.608
  269   HG23  ILE  31          3HG2      ILE  31 -29.893   5.968 -16.250
  270   HD11  ILE  31          3HD1      ILE  31 -30.050   3.875 -17.344
  271   HD12  ILE  31          1HD1      ILE  31 -31.239   3.661 -16.049
  272   HD13  ILE  31          2HD1      ILE  31 -31.319   2.655 -17.524
  273    H    ALA  32           H        ALA  32 -31.655   7.237 -13.641
  274    HA   ALA  32           HA       ALA  32 -32.755   9.921 -14.421
  275    HB1  ALA  32           3HB      ALA  32 -33.250  10.309 -11.992
  276    HB2  ALA  32           1HB      ALA  32 -34.250   9.046 -12.753
  277    HB3  ALA  32           2HB      ALA  32 -32.908   8.602 -11.693
  278    H    ASN  33           H        ASN  33 -31.738  11.826 -13.511
  279    HA   ASN  33           HA       ASN  33 -28.803  11.428 -13.150
  280    HB2  ASN  33           2HB      ASN  33 -30.710  13.727 -13.484
  281    HB3  ASN  33           3HB      ASN  33 -29.130  14.016 -12.744
  282   HD21  ASN  33          1HD2      ASN  33 -30.117  15.236 -15.069
  283   HD22  ASN  33          2HD2      ASN  33 -28.980  14.816 -16.322
  284    H    ALA  34           H        ALA  34 -27.910  11.148 -11.159
  285    HA   ALA  34           HA       ALA  34 -29.484  11.662  -8.712
  286    HB1  ALA  34           3HB      ALA  34 -26.641  10.656  -9.050
  287    HB2  ALA  34           1HB      ALA  34 -27.619  10.617  -7.572
  288    HB3  ALA  34           2HB      ALA  34 -28.084   9.619  -8.963
  289    H    ARG  35           H        ARG  35 -27.469  13.439 -10.727
  290    HA   ARG  35           HA       ARG  35 -26.373  15.236  -8.634
  291    HB2  ARG  35           2HB      ARG  35 -25.927  15.186 -11.639
  292    HB3  ARG  35           3HB      ARG  35 -25.042  16.174 -10.487
  293    HG2  ARG  35           2HG      ARG  35 -24.947  13.124 -10.623
  294    HG3  ARG  35           3HG      ARG  35 -23.766  14.245 -11.271
  295    HD2  ARG  35           2HD      ARG  35 -22.720  13.704  -9.336
  296    HD3  ARG  35           3HD      ARG  35 -23.581  15.140  -8.809
  297    HE   ARG  35           HE       ARG  35 -24.413  12.279  -8.284
  298   HH11  ARG  35          1HH1      ARG  35 -24.306  15.572  -7.045
  299   HH12  ARG  35          2HH1      ARG  35 -24.938  15.068  -5.503
  300   HH21  ARG  35          2HH2      ARG  35 -25.098  11.736  -6.370
  301   HH22  ARG  35          1HH2      ARG  35 -25.418  12.933  -5.128
  302    H    VAL  36           H        VAL  36 -29.279  15.163 -10.081
  303    HA   VAL  36           HA       VAL  36 -29.535  18.134 -10.342
  304    HB   VAL  36           HB       VAL  36 -31.508  17.743 -11.766
  305   HG11  VAL  36          1HG1      VAL  36 -30.313  17.143 -13.756
  306   HG12  VAL  36          2HG1      VAL  36 -29.261  18.115 -12.717
  307   HG13  VAL  36          3HG1      VAL  36 -29.027  16.356 -12.805
  308   HG21  VAL  36          3HG2      VAL  36 -30.889  14.837 -11.497
  309   HG22  VAL  36          1HG2      VAL  36 -32.406  15.697 -11.215
  310   HG23  VAL  36          2HG2      VAL  36 -31.793  15.541 -12.868
  311    H    GLU  37           H        GLU  37 -31.002  19.229  -9.164
  312    HA   GLU  37           HA       GLU  37 -31.764  18.151  -6.662
  313    HB2  GLU  37           2HB      GLU  37 -31.278  20.532  -7.222
  314    HB3  GLU  37           3HB      GLU  37 -32.830  20.639  -8.061
  315    HG2  GLU  37           2HG      GLU  37 -34.027  20.214  -5.952
  316    HG3  GLU  37           3HG      GLU  37 -32.498  19.929  -5.112
  317    H    ASN  38           H        ASN  38 -33.591  18.303  -9.661
  318    HA   ASN  38           HA       ASN  38 -36.132  17.477  -8.443
  319    HB2  ASN  38           2HB      ASN  38 -35.192  17.848 -11.321
  320    HB3  ASN  38           3HB      ASN  38 -36.813  17.319 -10.889
  321   HD21  ASN  38          2HD2      ASN  38 -36.638  19.545 -12.403
  322   HD22  ASN  38          1HD2      ASN  38 -37.048  20.946 -11.423
  323    H    CYS  39           H        CYS  39 -33.319  15.734  -9.086
  324    HA   CYS  39           HA       CYS  39 -32.763  13.636  -9.646
  325    HB2  CYS  39           2HB      CYS  39 -33.619  11.918  -8.215
  326    HB3  CYS  39           3HB      CYS  39 -33.461  13.415  -7.301
  327    HG   CYS  39           HG       CYS  39 -36.129  14.025  -7.893
  328    H    ALA  40           H        ALA  40 -34.196  14.715 -11.777
  329    HA   ALA  40           HA       ALA  40 -36.412  13.088 -12.434
  330    HB1  ALA  40           3HB      ALA  40 -34.938  15.062 -14.193
  331    HB2  ALA  40           1HB      ALA  40 -36.577  14.416 -14.454
  332    HB3  ALA  40           2HB      ALA  40 -36.256  15.437 -13.051
  333    H    VAL  41           H        VAL  41 -36.892  11.798 -14.084
  334    HA   VAL  41           HA       VAL  41 -35.042   9.714 -14.809
  335    HB   VAL  41           HB       VAL  41 -37.989  10.151 -15.432
  336   HG11  VAL  41          1HG1      VAL  41 -38.044   7.713 -15.899
  337   HG12  VAL  41          2HG1      VAL  41 -36.998   8.549 -17.045
  338   HG13  VAL  41          3HG1      VAL  41 -36.280   7.638 -15.700
  339   HG21  VAL  41          3HG2      VAL  41 -38.415   8.510 -13.681
  340   HG22  VAL  41          1HG2      VAL  41 -36.670   8.352 -13.353
  341   HG23  VAL  41          2HG2      VAL  41 -37.526   9.867 -13.004
  342    H    ILE  42           H        ILE  42 -33.585  10.613 -16.165
  343    HA   ILE  42           HA       ILE  42 -34.200  12.153 -18.537
  344    HB   ILE  42           HB       ILE  42 -31.808  11.837 -19.036
  345   HG12  ILE  42          2HG1      ILE  42 -31.778  10.003 -16.597
  346   HG13  ILE  42          3HG1      ILE  42 -31.508   9.517 -18.273
  347   HG21  ILE  42          1HG2      ILE  42 -32.186  12.525 -16.092
  348   HG22  ILE  42          2HG2      ILE  42 -30.963  13.144 -17.216
  349   HG23  ILE  42          3HG2      ILE  42 -32.654  13.592 -17.434
  350   HD11  ILE  42          3HD1      ILE  42 -29.739  11.235 -16.528
  351   HD12  ILE  42          1HD1      ILE  42 -29.416   9.619 -17.174
  352   HD13  ILE  42          2HD1      ILE  42 -29.482  11.005 -18.285
  353    H    TYR  43           H        TYR  43 -34.086   8.741 -17.842
  354    HA   TYR  43           HA       TYR  43 -35.140   8.115 -20.506
  355    HB2  TYR  43           2HB      TYR  43 -32.522   8.127 -20.675
  356    HB3  TYR  43           3HB      TYR  43 -32.596   6.645 -19.785
  357    HD1  TYR  43           HD1      TYR  43 -33.587   8.311 -22.943
  358    HD2  TYR  43           HD2      TYR  43 -33.207   4.559 -20.842
  359    HE1  TYR  43           HE1      TYR  43 -33.806   7.080 -25.098
  360    HE2  TYR  43           HE2      TYR  43 -33.449   3.331 -22.995
  361    HH   TYR  43           HH       TYR  43 -33.845   5.030 -26.129
  362    H    CYS  44           H        CYS  44 -35.911   5.848 -20.719
  363    HA   CYS  44           HA       CYS  44 -35.858   4.293 -18.243
  364    HB2  CYS  44           2HB      CYS  44 -38.325   3.956 -18.209
  365    HB3  CYS  44           3HB      CYS  44 -37.876   5.654 -17.938
  366    HG   CYS  44           HG       CYS  44 -40.043   5.464 -19.430
  367    H    ASN  45           H        ASN  45 -36.500   2.045 -18.472
  368    HA   ASN  45           HA       ASN  45 -36.025   1.088 -21.238
  369    HB2  ASN  45           2HB      ASN  45 -34.652   0.315 -19.276
  370    HB3  ASN  45           3HB      ASN  45 -36.062  -0.578 -18.706
  371   HD21  ASN  45          2HD2      ASN  45 -35.587  -2.744 -19.199
  372   HD22  ASN  45          1HD2      ASN  45 -35.036  -3.264 -20.778
  373    H    ASP  46           H        ASP  46 -37.216  -0.640 -22.159
  374    HA   ASP  46           HA       ASP  46 -40.072  -0.412 -22.083
  375    HB2  ASP  46           2HB      ASP  46 -38.712  -1.265 -23.989
  376    HB3  ASP  46           3HB      ASP  46 -38.321  -2.708 -23.052
  377    H    GLY  47           H        GLY  47 -37.820  -2.444 -20.275
  378    HA2  GLY  47           HA2      GLY  47 -39.491  -4.227 -18.917
  379    HA3  GLY  47           HA3      GLY  47 -38.065  -3.442 -18.233
  380    H    PHE  48           H        PHE  48 -38.901  -0.733 -18.015
  381    HA   PHE  48           HA       PHE  48 -40.622  -0.776 -15.684
  382    HB2  PHE  48           2HB      PHE  48 -39.607   1.216 -15.487
  383    HB3  PHE  48           3HB      PHE  48 -39.083   1.223 -17.161
  384    HD1  PHE  48           HD1      PHE  48 -41.849   2.201 -14.861
  385    HD2  PHE  48           HD2      PHE  48 -40.345   2.406 -18.902
  386    HE1  PHE  48           HE1      PHE  48 -43.786   3.594 -15.519
  387    HE2  PHE  48           HE2      PHE  48 -42.298   3.767 -19.555
  388    HZ   PHE  48           HZ       PHE  48 -44.038   4.350 -17.877
  389    H    CYS  49           H        CYS  49 -41.171  -0.348 -19.150
  390    HA   CYS  49           HA       CYS  49 -43.889   0.595 -18.958
  391    HB2  CYS  49           2HB      CYS  49 -42.274   0.747 -20.970
  392    HB3  CYS  49           3HB      CYS  49 -42.784  -0.915 -21.342
  393    HG   CYS  49           HG       CYS  49 -44.132   0.716 -22.856
  394    H    GLU  50           H        GLU  50 -42.425  -2.670 -19.131
  395    HA   GLU  50           HA       GLU  50 -45.008  -4.063 -19.126
  396    HB2  GLU  50           2HB      GLU  50 -42.231  -5.102 -18.435
  397    HB3  GLU  50           3HB      GLU  50 -43.677  -6.072 -18.729
  398    HG2  GLU  50           2HG      GLU  50 -43.799  -5.077 -21.050
  399    HG3  GLU  50           3HG      GLU  50 -42.228  -4.332 -20.758
  400    H    LEU  51           H        LEU  51 -42.805  -2.886 -16.642
  401    HA   LEU  51           HA       LEU  51 -43.861  -4.321 -14.405
  402    HB2  LEU  51           2HB      LEU  51 -41.694  -3.160 -14.519
  403    HB3  LEU  51           3HB      LEU  51 -42.492  -1.617 -14.643
  404    HG   LEU  51           HG       LEU  51 -43.553  -1.892 -12.433
  405   HD11  LEU  51          1HD1      LEU  51 -42.584  -3.478 -10.828
  406   HD12  LEU  51          2HD1      LEU  51 -43.415  -4.318 -12.144
  407   HD13  LEU  51          3HD1      LEU  51 -41.637  -4.234 -12.119
  408   HD21  LEU  51          3HD2      LEU  51 -40.525  -1.904 -12.460
  409   HD22  LEU  51          1HD2      LEU  51 -41.579  -0.502 -12.741
  410   HD23  LEU  51          2HD2      LEU  51 -41.566  -1.292 -11.159
  411    H    CYS  52           H        CYS  52 -44.464  -0.947 -15.444
  412    HA   CYS  52           HA       CYS  52 -46.785  -0.755 -13.619
  413    HB2  CYS  52           2HB      CYS  52 -45.312   1.363 -15.239
  414    HB3  CYS  52           3HB      CYS  52 -46.539   1.648 -13.984
  415    HG   CYS  52           HG       CYS  52 -45.252   0.527 -12.017
  416    H    GLY  53           H        GLY  53 -46.264  -1.165 -17.034
  417    HA2  GLY  53           HA2      GLY  53 -47.830  -1.544 -18.699
  418    HA3  GLY  53           HA3      GLY  53 -49.108  -1.398 -17.503
  419    H    TYR  54           H        TYR  54 -47.164   1.449 -17.640
  420    HA   TYR  54           HA       TYR  54 -49.328   2.915 -19.038
  421    HB2  TYR  54           2HB      TYR  54 -47.053   3.828 -17.267
  422    HB3  TYR  54           3HB      TYR  54 -48.099   4.931 -18.144
  423    HD1  TYR  54           HD2      TYR  54 -50.565   5.016 -17.717
  424    HD2  TYR  54           HD1      TYR  54 -47.841   2.811 -15.216
  425    HE1  TYR  54           HE2      TYR  54 -52.276   4.953 -15.900
  426    HE2  TYR  54           HE1      TYR  54 -49.544   2.741 -13.400
  427    HH   TYR  54           HH       TYR  54 -51.651   3.359 -12.756
  428    H    SER  55           H        SER  55 -46.468   4.667 -19.341
  429    HA   SER  55           HA       SER  55 -45.520   3.572 -21.877
  430    HB2  SER  55           2HB      SER  55 -47.562   4.743 -22.627
  431    HB3  SER  55           3HB      SER  55 -47.023   6.225 -21.812
  432    HG   SER  55           HG       SER  55 -46.544   6.082 -24.121
  433    H    ARG  56           H        ARG  56 -43.600   4.562 -22.565
  434    HA   ARG  56           HA       ARG  56 -41.820   5.703 -20.606
  435    HB2  ARG  56           2HB      ARG  56 -41.675   5.820 -23.659
  436    HB3  ARG  56           3HB      ARG  56 -40.348   6.109 -22.533
  437    HG2  ARG  56           2HG      ARG  56 -40.632   3.711 -21.703
  438    HG3  ARG  56           3HG      ARG  56 -41.834   3.476 -22.969
  439    HD2  ARG  56           2HD      ARG  56 -39.790   2.576 -23.770
  440    HD3  ARG  56           3HD      ARG  56 -40.109   4.038 -24.694
  441    HE   ARG  56           HE       ARG  56 -38.042   3.654 -22.551
  442   HH11  ARG  56          1HH2      ARG  56 -39.213   5.809 -25.076
  443   HH12  ARG  56          2HH2      ARG  56 -37.777   6.789 -24.987
  444   HH21  ARG  56          1HH1      ARG  56 -36.272   4.784 -22.623
  445   HH22  ARG  56          2HH1      ARG  56 -36.113   6.214 -23.626
  446    H    ALA  57           H        ALA  57 -43.848   7.251 -23.067
  447    HA   ALA  57           HA       ALA  57 -42.944   9.932 -22.673
  448    HB1  ALA  57           3HB      ALA  57 -45.018  10.510 -23.878
  449    HB2  ALA  57           1HB      ALA  57 -44.198   9.140 -24.649
  450    HB3  ALA  57           2HB      ALA  57 -45.635   8.862 -23.635
  451    H    GLU  58           H        GLU  58 -44.963   7.941 -20.616
  452    HA   GLU  58           HA       GLU  58 -46.080  10.238 -19.151
  453    HB2  GLU  58           2HB      GLU  58 -46.442   7.245 -18.779
  454    HB3  GLU  58           3HB      GLU  58 -47.158   8.497 -17.772
  455    HG2  GLU  58           2HG      GLU  58 -48.273   9.488 -19.761
  456    HG3  GLU  58           3HG      GLU  58 -47.601   8.215 -20.776
  457    H    VAL  59           H        VAL  59 -43.202   8.268 -19.013
  458    HA   VAL  59           HA       VAL  59 -42.664   9.254 -16.232
  459    HB   VAL  59           HB       VAL  59 -40.748   7.667 -16.230
  460   HG11  VAL  59          1HG1      VAL  59 -43.501   6.412 -16.536
  461   HG12  VAL  59          2HG1      VAL  59 -42.112   5.764 -15.628
  462   HG13  VAL  59          3HG1      VAL  59 -42.913   7.238 -15.079
  463   HG21  VAL  59          3HG2      VAL  59 -40.561   7.261 -18.649
  464   HG22  VAL  59          1HG2      VAL  59 -40.714   5.779 -17.677
  465   HG23  VAL  59          2HG2      VAL  59 -42.116   6.383 -18.582
  466    H    MET  60           H        MET  60 -41.634   9.770 -19.542
  467    HA   MET  60           HA       MET  60 -39.059  10.632 -19.330
  468    HB2  MET  60           2HB      MET  60 -41.367  11.802 -20.933
  469    HB3  MET  60           3HB      MET  60 -39.750  12.483 -21.033
  470    HG2  MET  60           2HG      MET  60 -40.503   9.665 -21.804
  471    HG3  MET  60           3HG      MET  60 -40.167  11.005 -22.872
  472    HE1  MET  60           3HE      MET  60 -38.912   7.847 -21.743
  473    HE2  MET  60           1HE      MET  60 -37.241   8.030 -21.187
  474    HE3  MET  60           2HE      MET  60 -38.582   8.576 -20.158
  475    H    GLN  61           H        GLN  61 -38.153  11.770 -17.832
  476    HA   GLN  61           HA       GLN  61 -37.370  13.551 -16.771
  477    HB2  GLN  61           2HB      GLN  61 -39.264  15.258 -18.391
  478    HB3  GLN  61           3HB      GLN  61 -37.787  15.785 -17.601
  479    HG2  GLN  61           2HG      GLN  61 -36.392  14.809 -19.206
  480    HG3  GLN  61           3HG      GLN  61 -37.544  13.558 -19.646
  481   HE21  GLN  61          1HE2      GLN  61 -37.693  13.807 -21.834
  482   HE22  GLN  61          2HE2      GLN  61 -38.344  15.259 -22.569
  483    H    ARG  62           H        ARG  62 -39.993  12.139 -15.791
  484    HA   ARG  62           HA       ARG  62 -40.896  14.126 -13.789
  485    HB2  ARG  62           2HB      ARG  62 -41.454  11.182 -14.372
  486    HB3  ARG  62           3HB      ARG  62 -41.776  11.822 -12.775
  487    HG2  ARG  62           2HG      ARG  62 -43.806  12.103 -13.648
  488    HG3  ARG  62           3HG      ARG  62 -43.130  13.691 -13.988
  489    HD2  ARG  62           2HD      ARG  62 -43.093  11.428 -16.010
  490    HD3  ARG  62           3HD      ARG  62 -44.522  12.432 -15.808
  491    HE   ARG  62           HE       ARG  62 -42.080  13.124 -17.191
  492   HH11  ARG  62          1HH1      ARG  62 -44.751  14.675 -15.516
  493   HH12  ARG  62          2HH1      ARG  62 -44.520  16.160 -16.400
  494   HH21  ARG  62          1HH2      ARG  62 -41.876  14.922 -18.248
  495   HH22  ARG  62          2HH2      ARG  62 -42.898  16.313 -17.930
  496    HA   PRO  63           HA       PRO  63 -37.807  13.151 -10.669
  497    HB2  PRO  63           2HB      PRO  63 -40.125  12.682  -8.797
  498    HB3  PRO  63           3HB      PRO  63 -38.641  13.648  -8.534
  499    HG2  PRO  63           2HG      PRO  63 -40.974  14.889  -9.111
  500    HG3  PRO  63           3HG      PRO  63 -39.464  15.419  -9.925
  501    HD2  PRO  63           2HD      PRO  63 -41.623  13.572 -10.993
  502    HD3  PRO  63           3HD      PRO  63 -40.830  14.965 -11.793
  503    H    CYS  64           H        CYS  64 -36.764  11.257 -10.071
  504    HA   CYS  64           HA       CYS  64 -37.831   8.679 -10.812
  505    HB2  CYS  64           2HB      CYS  64 -35.458   9.553 -10.850
  506    HB3  CYS  64           3HB      CYS  64 -35.403   9.270  -9.105
  507    HG   CYS  64           HG       CYS  64 -36.206   7.168 -11.560
  508    H    THR  65           H        THR  65 -38.262  10.513  -7.914
  509    HA   THR  65           HA       THR  65 -38.552   8.522  -5.965
  510    HB   THR  65           HB       THR  65 -40.206  11.064  -5.964
  511    HG1  THR  65           HG1      THR  65 -38.432  12.132  -5.176
  512   HG21  THR  65          1HG2      THR  65 -40.429   9.439  -4.075
  513   HG22  THR  65          2HG2      THR  65 -38.666   9.509  -3.841
  514   HG23  THR  65          3HG2      THR  65 -39.673  10.954  -3.559
  515    H    CYS  66           H        CYS  66 -39.636   6.835  -6.646
  516    HA   CYS  66           HA       CYS  66 -41.952   6.518  -8.046
  517    HB2  CYS  66           2HB      CYS  66 -42.125   4.286  -7.035
  518    HB3  CYS  66           3HB      CYS  66 -40.437   4.693  -7.381
  519    HG   CYS  66           HG       CYS  66 -42.102   4.911  -4.504
  520    H    ASP  67           H        ASP  67 -41.963   7.876  -4.909
  521    HA   ASP  67           HA       ASP  67 -44.555   7.455  -3.909
  522    HB2  ASP  67           2HB      ASP  67 -42.744   8.872  -2.881
  523    HB3  ASP  67           3HB      ASP  67 -43.038  10.088  -4.114
  524    H    PHE  68           H        PHE  68 -43.514   9.527  -6.688
  525    HA   PHE  68           HA       PHE  68 -46.031  10.809  -7.044
  526    HB2  PHE  68           2HB      PHE  68 -45.109  11.868  -8.777
  527    HB3  PHE  68           3HB      PHE  68 -43.622  11.279  -8.081
  528    HD1  PHE  68           HD1      PHE  68 -46.068  10.924 -10.844
  529    HD2  PHE  68           HD2      PHE  68 -42.253   9.619  -9.322
  530    HE1  PHE  68           HE1      PHE  68 -45.527   9.923 -13.048
  531    HE2  PHE  68           HE2      PHE  68 -41.713   8.626 -11.522
  532    HZ   PHE  68           HZ       PHE  68 -43.346   8.781 -13.394
  533    H    LEU  69           H        LEU  69 -45.167   7.572  -7.760
  534    HA   LEU  69           HA       LEU  69 -47.769   7.122  -9.101
  535    HB2  LEU  69           2HB      LEU  69 -46.767   5.393 -10.522
  536    HB3  LEU  69           3HB      LEU  69 -46.218   7.023 -10.840
  537    HG   LEU  69           HG       LEU  69 -44.067   6.510  -9.608
  538   HD11  LEU  69          1HD1      LEU  69 -44.722   4.516  -8.299
  539   HD12  LEU  69          2HD1      LEU  69 -45.087   3.641  -9.799
  540   HD13  LEU  69          3HD1      LEU  69 -43.418   4.122  -9.419
  541   HD21  LEU  69          3HD2      LEU  69 -43.116   5.268 -11.492
  542   HD22  LEU  69          1HD2      LEU  69 -44.740   4.755 -12.006
  543   HD23  LEU  69          2HD2      LEU  69 -44.277   6.468 -12.071
  544    H    HIS  70           H        HIS  70 -46.908   6.961  -6.206
  545    HA   HIS  70           HA       HIS  70 -47.013   4.202  -5.472
  546    HB2  HIS  70           2HB      HIS  70 -47.185   4.884  -3.311
  547    HB3  HIS  70           3HB      HIS  70 -46.414   6.272  -4.027
  548    HD2  HIS  70           HD2      HIS  70 -48.651   8.162  -4.917
  549    HE1  HIS  70           HE1      HIS  70 -50.705   7.412  -1.258
  550    HE2  HIS  70           HE2      HIS  70 -50.519   8.984  -3.254
  551    H    GLY  71           H        GLY  71 -48.675   2.883  -4.722
  552    HA2  GLY  71           HA2      GLY  71 -51.404   3.443  -5.840
  553    HA3  GLY  71           HA3      GLY  71 -50.645   1.859  -5.749
  554    HA   PRO  72           HA       PRO  72 -53.379   2.739  -1.998
  555    HB2  PRO  72           2HB      PRO  72 -55.271   0.779  -2.334
  556    HB3  PRO  72           3HB      PRO  72 -55.355   2.379  -3.131
  557    HG2  PRO  72           2HG      PRO  72 -54.262  -0.213  -4.281
  558    HG3  PRO  72           3HG      PRO  72 -55.462   0.899  -5.017
  559    HD2  PRO  72           2HD      PRO  72 -52.839   1.041  -5.678
  560    HD3  PRO  72           3HD      PRO  72 -53.803   2.534  -5.472
  561    H    ARG  73           H        ARG  73 -51.538   0.080  -3.159
  562    HA   ARG  73           HA       ARG  73 -51.503  -1.307  -0.514
  563    HB2  ARG  73           2HB      ARG  73 -51.639  -2.309  -3.031
  564    HB3  ARG  73           3HB      ARG  73 -49.894  -2.249  -2.877
  565    HG2  ARG  73           2HG      ARG  73 -51.873  -3.752  -1.100
  566    HG3  ARG  73           3HG      ARG  73 -50.837  -4.439  -2.351
  567    HD2  ARG  73           2HD      ARG  73 -48.841  -3.626  -0.990
  568    HD3  ARG  73           3HD      ARG  73 -49.998  -3.274   0.316
  569    HE   ARG  73           HE       ARG  73 -50.370  -5.962  -0.588
  570   HH11  ARG  73          1HH2      ARG  73 -48.118  -4.091   1.326
  571   HH12  ARG  73          2HH2      ARG  73 -47.566  -5.485   2.217
  572   HH21  ARG  73          1HH1      ARG  73 -49.624  -7.704   0.584
  573   HH22  ARG  73          2HH1      ARG  73 -48.402  -7.477   1.797
  574    H    THR  74           H        THR  74 -49.780   1.232  -2.065
  575    HA   THR  74           HA       THR  74 -47.148   0.415  -1.106
  576    HB   THR  74           HB       THR  74 -47.801   3.217  -2.014
  577    HG1  THR  74           HG1      THR  74 -46.814   1.524  -3.919
  578   HG21  THR  74          1HG2      THR  74 -45.423   2.897  -2.969
  579   HG22  THR  74          2HG2      THR  74 -45.547   2.956  -1.206
  580   HG23  THR  74          3HG2      THR  74 -45.357   1.389  -2.006
  581    H    GLN  75           H        GLN  75 -46.011   1.099   0.630
  582    HA   GLN  75           HA       GLN  75 -47.516   2.550   2.722
  583    HB2  GLN  75           2HB      GLN  75 -44.755   1.320   2.932
  584    HB3  GLN  75           3HB      GLN  75 -45.808   1.887   4.233
  585    HG2  GLN  75           2HG      GLN  75 -46.218  -0.556   2.477
  586    HG3  GLN  75           3HG      GLN  75 -45.851  -0.499   4.200
  587   HE21  GLN  75          2HE2      GLN  75 -48.463  -0.699   1.906
  588   HE22  GLN  75          1HE2      GLN  75 -49.729  -0.385   3.079
  589    H    ARG  76           H        ARG  76 -47.110   4.544   3.405
  590    HA   ARG  76           HA       ARG  76 -45.573   6.308   1.693
  591    HB2  ARG  76           2HB      ARG  76 -46.735   6.985   4.382
  592    HB3  ARG  76           3HB      ARG  76 -46.261   8.108   3.108
  593    HG2  ARG  76           2HG      ARG  76 -48.618   6.190   3.123
  594    HG3  ARG  76           3HG      ARG  76 -48.658   7.947   3.050
  595    HD2  ARG  76           2HD      ARG  76 -47.684   6.048   0.861
  596    HD3  ARG  76           3HD      ARG  76 -49.219   6.891   0.876
  597    HE   ARG  76           HE       ARG  76 -46.661   7.937   0.013
  598   HH11  ARG  76          1HH1      ARG  76 -49.713   9.058   1.341
  599   HH12  ARG  76          2HH1      ARG  76 -49.556  10.609   0.564
  600   HH21  ARG  76          1HH2      ARG  76 -46.550   9.852  -0.955
  601   HH22  ARG  76          2HH2      ARG  76 -47.790  11.061  -0.692
  602    H    ARG  77           H        ARG  77 -44.909   4.865   4.869
  603    HA   ARG  77           HA       ARG  77 -42.388   6.112   5.327
  604    HB2  ARG  77           2HB      ARG  77 -41.861   4.253   6.728
  605    HB3  ARG  77           3HB      ARG  77 -43.563   4.702   6.954
  606    HG2  ARG  77           2HG      ARG  77 -44.160   2.751   5.435
  607    HG3  ARG  77           3HG      ARG  77 -42.452   2.269   5.489
  608    HD2  ARG  77           2HD      ARG  77 -42.621   2.141   7.984
  609    HD3  ARG  77           3HD      ARG  77 -44.353   2.519   7.846
  610    HE   ARG  77           HE       ARG  77 -43.616   0.248   6.204
  611   HH11  ARG  77          1HH1      ARG  77 -44.316   1.045   9.544
  612   HH12  ARG  77          2HH1      ARG  77 -44.808  -0.582   9.923
  613   HH21  ARG  77          1HH2      ARG  77 -44.254  -1.811   6.761
  614   HH22  ARG  77          2HH2      ARG  77 -44.770  -2.147   8.386
  615    H    ALA  78           H        ALA  78 -43.168   3.421   3.184
  616    HA   ALA  78           HA       ALA  78 -40.442   2.729   2.482
  617    HB1  ALA  78           3HB      ALA  78 -42.296   1.146   2.156
  618    HB2  ALA  78           1HB      ALA  78 -43.068   2.228   0.971
  619    HB3  ALA  78           2HB      ALA  78 -41.533   1.533   0.615
  620    H    ALA  79           H        ALA  79 -43.018   4.675   0.904
  621    HA   ALA  79           HA       ALA  79 -41.390   5.552  -1.301
  622    HB1  ALA  79           3HB      ALA  79 -43.899   5.480  -1.212
  623    HB2  ALA  79           1HB      ALA  79 -43.862   6.849  -0.068
  624    HB3  ALA  79           2HB      ALA  79 -43.262   7.050  -1.723
  625    H    ALA  80           H        ALA  80 -41.951   6.944   1.910
  626    HA   ALA  80           HA       ALA  80 -40.643   9.434   1.490
  627    HB1  ALA  80           3HB      ALA  80 -41.214   7.856   4.030
  628    HB2  ALA  80           1HB      ALA  80 -40.733   9.568   3.964
  629    HB3  ALA  80           2HB      ALA  80 -42.282   9.057   3.264
  630    H    GLN  81           H        GLN  81 -39.414   6.424   3.161
  631    HA   GLN  81           HA       GLN  81 -36.719   7.197   3.481
  632    HB2  GLN  81           2HB      GLN  81 -38.027   4.528   2.896
  633    HB3  GLN  81           3HB      GLN  81 -36.282   4.686   3.131
  634    HG2  GLN  81           2HG      GLN  81 -36.542   5.556   5.365
  635    HG3  GLN  81           3HG      GLN  81 -38.294   5.679   5.187
  636   HE21  GLN  81          2HE2      GLN  81 -39.499   3.633   4.835
  637   HE22  GLN  81          1HE2      GLN  81 -38.884   2.160   5.605
  638    H    ILE  82           H        ILE  82 -38.300   5.872   0.498
  639    HA   ILE  82           HA       ILE  82 -35.883   5.962  -1.065
  640    HB   ILE  82           HB       ILE  82 -38.825   5.947  -1.728
  641   HG12  ILE  82          2HG1      ILE  82 -36.575   3.963  -2.319
  642   HG13  ILE  82          3HG1      ILE  82 -37.495   3.952  -0.811
  643   HG21  ILE  82          1HG2      ILE  82 -36.488   6.198  -3.660
  644   HG22  ILE  82          2HG2      ILE  82 -38.127   5.684  -4.142
  645   HG23  ILE  82          3HG2      ILE  82 -37.870   7.300  -3.475
  646   HD11  ILE  82          3HD1      ILE  82 -38.507   2.360  -2.197
  647   HD12  ILE  82          1HD1      ILE  82 -39.602   3.758  -2.119
  648   HD13  ILE  82          2HD1      ILE  82 -38.606   3.475  -3.576
  649    H    ALA  83           H        ALA  83 -38.530   8.396  -0.716
  650    HA   ALA  83           HA       ALA  83 -37.400  10.416  -2.283
  651    HB1  ALA  83           3HB      ALA  83 -38.889  10.845   0.330
  652    HB2  ALA  83           1HB      ALA  83 -38.799  11.931  -1.059
  653    HB3  ALA  83           2HB      ALA  83 -39.674  10.384  -1.197
  654    H    GLN  84           H        GLN  84 -36.522   9.524   1.044
  655    HA   GLN  84           HA       GLN  84 -34.701  11.775   1.469
  656    HB2  GLN  84           2HB      GLN  84 -34.513   9.092   2.871
  657    HB3  GLN  84           3HB      GLN  84 -33.885  10.648   3.373
  658    HG2  GLN  84           2HG      GLN  84 -36.679   9.614   3.507
  659    HG3  GLN  84           3HG      GLN  84 -35.713  10.261   4.773
  660   HE21  GLN  84          1HE2      GLN  84 -38.124  10.954   2.456
  661   HE22  GLN  84          2HE2      GLN  84 -38.205  12.702   2.729
  662    H    ALA  85           H        ALA  85 -34.360   8.416   0.168
  663    HA   ALA  85           HA       ALA  85 -31.471   8.491   0.042
  664    HB1  ALA  85           3HB      ALA  85 -32.787   6.392   0.079
  665    HB2  ALA  85           1HB      ALA  85 -33.475   6.792  -1.513
  666    HB3  ALA  85           2HB      ALA  85 -31.738   6.488  -1.348
  667    H    LEU  86           H        LEU  86 -34.073   9.491  -2.159
  668    HA   LEU  86           HA       LEU  86 -32.220  10.184  -4.291
  669    HB2  LEU  86           2HB      LEU  86 -35.115  11.010  -4.102
  670    HB3  LEU  86           3HB      LEU  86 -34.076  10.946  -5.515
  671    HG   LEU  86           HG       LEU  86 -35.547   8.753  -4.093
  672   HD11  LEU  86          1HD1      LEU  86 -34.821   9.189  -7.012
  673   HD12  LEU  86          2HD1      LEU  86 -36.068   8.093  -6.370
  674   HD13  LEU  86          3HD1      LEU  86 -36.258   9.854  -6.228
  675   HD21  LEU  86          3HD2      LEU  86 -34.222   7.004  -5.368
  676   HD22  LEU  86          1HD2      LEU  86 -32.984   8.236  -5.702
  677   HD23  LEU  86          2HD2      LEU  86 -33.314   7.699  -4.042
  678    H    LEU  87           H        LEU  87 -33.794  11.963  -1.664
  679    HA   LEU  87           HA       LEU  87 -32.895  14.598  -2.250
  680    HB2  LEU  87           2HB      LEU  87 -34.624  14.401  -0.761
  681    HB3  LEU  87           3HB      LEU  87 -33.988  12.962  -0.008
  682    HG   LEU  87           HG       LEU  87 -32.654  15.487   0.565
  683   HD11  LEU  87          1HD1      LEU  87 -34.202  15.818   2.491
  684   HD12  LEU  87          2HD1      LEU  87 -35.036  15.934   0.934
  685   HD13  LEU  87          3HD1      LEU  87 -35.170  14.446   1.897
  686   HD21  LEU  87          3HD2      LEU  87 -32.226  14.522   2.769
  687   HD22  LEU  87          1HD2      LEU  87 -33.092  13.049   2.298
  688   HD23  LEU  87          2HD2      LEU  87 -31.578  13.509   1.490
  689    H    GLY  88           H        GLY  88 -31.322  11.782  -0.805
  690    HA2  GLY  88           HA2      GLY  88 -28.986  11.479  -1.355
  691    HA3  GLY  88           HA3      GLY  88 -28.686  13.193  -1.082
  692    H    ALA  89           H        ALA  89 -30.706  11.540   1.287
  693    HA   ALA  89           HA       ALA  89 -28.910  12.162   3.419
  694    HB1  ALA  89           3HB      ALA  89 -30.532  10.870   4.789
  695    HB2  ALA  89           1HB      ALA  89 -31.327  12.052   3.738
  696    HB3  ALA  89           2HB      ALA  89 -31.344  10.325   3.307
  697    H    GLU  90           H        GLU  90 -29.782   9.053   1.861
  698    HA   GLU  90           HA       GLU  90 -27.170   7.840   2.524
  699    HB2  GLU  90           2HB      GLU  90 -29.816   6.545   3.333
  700    HB3  GLU  90           3HB      GLU  90 -28.207   5.836   3.479
  701    HG2  GLU  90           2HG      GLU  90 -27.601   7.669   5.091
  702    HG3  GLU  90           3HG      GLU  90 -29.276   8.241   5.010
  703    H    GLU  91           H        GLU  91 -26.545   6.303   1.019
  704    HA   GLU  91           HA       GLU  91 -28.306   5.639  -1.306
  705    HB2  GLU  91           2HB      GLU  91 -25.951   6.094  -1.696
  706    HB3  GLU  91           3HB      GLU  91 -25.448   4.857  -0.547
  707    HG2  GLU  91           2HG      GLU  91 -27.307   3.998  -2.740
  708    HG3  GLU  91           3HG      GLU  91 -25.696   4.491  -3.242
  709    H    ARG  92           H        ARG  92 -29.950   4.343  -0.659
  710    HA   ARG  92           HA       ARG  92 -29.364   1.829   0.814
  711    HB2  ARG  92           2HB      ARG  92 -29.941   3.622   2.459
  712    HB3  ARG  92           3HB      ARG  92 -31.453   3.908   1.609
  713    HG2  ARG  92           2HG      ARG  92 -31.854   2.609   3.596
  714    HG3  ARG  92           3HG      ARG  92 -32.215   1.616   2.179
  715    HD2  ARG  92           2HD      ARG  92 -30.373   0.201   2.522
  716    HD3  ARG  92           3HD      ARG  92 -29.472   1.435   3.401
  717    HE   ARG  92           HE       ARG  92 -30.382   0.759   5.369
  718   HH11  ARG  92          1HH2      ARG  92 -32.563  -0.632   2.927
  719   HH12  ARG  92          2HH2      ARG  92 -33.323  -1.622   4.133
  720   HH21  ARG  92          1HH1      ARG  92 -31.468  -0.509   6.780
  721   HH22  ARG  92          2HH1      ARG  92 -32.757  -1.535   6.228
  722    H    LYS  93           H        LYS  93 -30.522   0.173   0.242
  723    HA   LYS  93           HA       LYS  93 -32.571   0.289  -1.885
  724    HB2  LYS  93           2HB      LYS  93 -30.764  -1.378  -1.921
  725    HB3  LYS  93           3HB      LYS  93 -31.397  -2.067  -0.404
  726    HG2  LYS  93           2HG      LYS  93 -33.610  -2.351  -1.796
  727    HG3  LYS  93           3HG      LYS  93 -32.562  -2.063  -3.189
  728    HD2  LYS  93           2HD      LYS  93 -32.169  -4.230  -1.091
  729    HD3  LYS  93           3HD      LYS  93 -32.850  -4.476  -2.702
  730    HE2  LYS  93           2HE      LYS  93 -30.700  -3.594  -3.687
  731    HE3  LYS  93           3HE      LYS  93 -30.018  -3.529  -2.053
  732    HZ1  LYS  93           HZ1      LYS  93 -30.427  -5.968  -1.918
  733    HZ2  LYS  93           HZ2      LYS  93 -30.959  -5.953  -3.479
  734    HZ3  LYS  93           HZ3      LYS  93 -29.406  -5.591  -3.143
  735    H    VAL  94           H        VAL  94 -34.683   0.136  -1.549
  736    HA   VAL  94           HA       VAL  94 -35.800  -0.609   1.114
  737    HB   VAL  94           HB       VAL  94 -36.901   1.740  -0.440
  738   HG11  VAL  94          1HG1      VAL  94 -37.054   1.004   2.520
  739   HG12  VAL  94          2HG1      VAL  94 -37.857   2.385   1.740
  740   HG13  VAL  94          3HG1      VAL  94 -38.342   0.752   1.322
  741   HG21  VAL  94          3HG2      VAL  94 -34.832   1.972   1.786
  742   HG22  VAL  94          1HG2      VAL  94 -34.630   2.500   0.095
  743   HG23  VAL  94          2HG2      VAL  94 -35.794   3.317   1.132
  744    H    GLU  95           H        GLU  95 -37.881  -1.451   1.026
  745    HA   GLU  95           HA       GLU  95 -38.684  -2.621  -1.559
  746    HB2  GLU  95           2HB      GLU  95 -40.245  -3.907  -0.228
  747    HB3  GLU  95           3HB      GLU  95 -38.615  -4.005   0.465
  748    HG2  GLU  95           2HG      GLU  95 -39.229  -2.329   2.191
  749    HG3  GLU  95           3HG      GLU  95 -40.854  -2.211   1.529
  750    H    ILE  96           H        ILE  96 -40.895  -2.313  -2.365
  751    HA   ILE  96           HA       ILE  96 -42.589  -0.282  -1.295
  752    HB   ILE  96           HB       ILE  96 -42.459   0.888  -3.787
  753   HG12  ILE  96          2HG1      ILE  96 -40.183   1.668  -4.213
  754   HG13  ILE  96          3HG1      ILE  96 -39.546   0.555  -2.994
  755   HG21  ILE  96          1HG2      ILE  96 -40.966   1.976  -1.427
  756   HG22  ILE  96          2HG2      ILE  96 -41.748   2.859  -2.744
  757   HG23  ILE  96          3HG2      ILE  96 -42.744   1.981  -1.582
  758   HD11  ILE  96          3HD1      ILE  96 -40.975  -0.201  -5.561
  759   HD12  ILE  96          1HD1      ILE  96 -39.230  -0.375  -5.213
  760   HD13  ILE  96          2HD1      ILE  96 -40.412  -1.345  -4.335
  761    H    ALA  97           H        ALA  97 -44.542  -0.011  -2.551
  762    HA   ALA  97           HA       ALA  97 -45.147  -2.376  -4.243
  763    HB1  ALA  97           3HB      ALA  97 -47.393  -2.271  -3.638
  764    HB2  ALA  97           1HB      ALA  97 -46.583  -1.843  -2.125
  765    HB3  ALA  97           2HB      ALA  97 -47.300  -0.596  -3.143
  766    H    PHE  98           H        PHE  98 -46.120  -2.228  -6.198
  767    HA   PHE  98           HA       PHE  98 -46.425   0.483  -7.441
  768    HB2  PHE  98           2HB      PHE  98 -45.607  -2.107  -8.803
  769    HB3  PHE  98           3HB      PHE  98 -45.928  -0.582  -9.614
  770    HD1  PHE  98           HD2      PHE  98 -44.535   1.508  -8.701
  771    HD2  PHE  98           HD1      PHE  98 -43.347  -2.623  -8.308
  772    HE1  PHE  98           HE2      PHE  98 -42.169   2.210  -8.414
  773    HE2  PHE  98           HE1      PHE  98 -40.997  -1.918  -8.055
  774    HZ   PHE  98           HZ       PHE  98 -40.406   0.504  -8.066
  775    H    TYR  99           H        TYR  99 -48.105   0.657  -9.014
  776    HA   TYR  99           HA       TYR  99 -50.072  -1.537  -9.063
  777    HB2  TYR  99           2HB      TYR  99 -51.947  -0.257  -8.832
  778    HB3  TYR  99           3HB      TYR  99 -50.912   0.281  -7.525
  779    HD1  TYR  99           HD2      TYR  99 -49.521   2.521  -8.013
  780    HD2  TYR  99           HD1      TYR  99 -52.999   1.258 -10.239
  781    HE1  TYR  99           HE2      TYR  99 -49.921   4.867  -8.744
  782    HE2  TYR  99           HE1      TYR  99 -53.393   3.602 -10.958
  783    HH   TYR  99           HH       TYR  99 -52.658   5.772 -10.867
  784    H    ARG 100           H        ARG 100 -50.818  -2.042 -11.004
  785    HA   ARG 100           HA       ARG 100 -49.568  -0.799 -13.334
  786    HB2  ARG 100           2HB      ARG 100 -51.257  -3.268 -12.857
  787    HB3  ARG 100           3HB      ARG 100 -50.984  -2.682 -14.506
  788    HG2  ARG 100           2HG      ARG 100 -48.599  -2.779 -14.265
  789    HG3  ARG 100           3HG      ARG 100 -48.712  -3.219 -12.553
  790    HD2  ARG 100           2HD      ARG 100 -49.670  -5.363 -13.084
  791    HD3  ARG 100           3HD      ARG 100 -49.894  -4.910 -14.789
  792    HE   ARG 100           HE       ARG 100 -47.166  -4.582 -14.285
  793   HH11  ARG 100          2HH2      ARG 100 -49.267  -7.370 -13.956
  794   HH12  ARG 100          1HH2      ARG 100 -48.056  -8.470 -14.553
  795   HH21  ARG 100          2HH1      ARG 100 -45.845  -5.995 -15.409
  796   HH22  ARG 100          1HH1      ARG 100 -46.110  -7.712 -15.246
  797    H    LYS 101           H        LYS 101 -50.631  -0.156 -15.216
  798    HA   LYS 101           HA       LYS 101 -52.756   1.707 -15.053
  799    HB2  LYS 101           2HB      LYS 101 -51.064   1.667 -16.773
  800    HB3  LYS 101           3HB      LYS 101 -51.573   0.087 -17.345
  801    HG2  LYS 101           2HG      LYS 101 -53.565   2.361 -17.352
  802    HG3  LYS 101           3HG      LYS 101 -52.294   2.336 -18.577
  803    HD2  LYS 101           2HD      LYS 101 -52.931   0.235 -19.441
  804    HD3  LYS 101           3HD      LYS 101 -53.997  -0.142 -18.115
  805    HE2  LYS 101           2HE      LYS 101 -54.461   2.104 -20.127
  806    HE3  LYS 101           3HE      LYS 101 -55.204   0.500 -20.195
  807    HZ1  LYS 101           HZ1      LYS 101 -55.611   2.468 -18.008
  808    HZ2  LYS 101           HZ2      LYS 101 -56.706   2.061 -19.147
  809    HZ3  LYS 101           HZ3      LYS 101 -56.243   0.965 -18.028
  810    H    ASP 102           H        ASP 102 -52.922  -1.775 -15.476
  811    HA   ASP 102           HA       ASP 102 -55.763  -1.827 -16.098
  812    HB2  ASP 102           2HB      ASP 102 -54.031  -3.483 -16.873
  813    HB3  ASP 102           3HB      ASP 102 -53.932  -4.086 -15.218
  814    H    GLY 103           H        GLY 103 -54.128  -1.283 -13.180
  815    HA2  GLY 103           HA2      GLY 103 -55.216  -0.735 -11.184
  816    HA3  GLY 103           HA3      GLY 103 -56.538  -1.839 -11.549
  817    H    SER 104           H        SER 104 -53.683  -3.560 -12.086
  818    HA   SER 104           HA       SER 104 -54.059  -5.132  -9.655
  819    HB2  SER 104           2HB      SER 104 -51.945  -5.383 -11.822
  820    HB3  SER 104           3HB      SER 104 -52.295  -6.570 -10.551
  821    HG   SER 104           HG       SER 104 -53.367  -7.086 -12.515
  822    H    CYS 105           H        CYS 105 -52.976  -4.993  -7.753
  823    HA   CYS 105           HA       CYS 105 -50.627  -3.148  -7.561
  824    HB2  CYS 105           2HB      CYS 105 -52.727  -3.807  -5.461
  825    HB3  CYS 105           3HB      CYS 105 -51.389  -2.656  -5.303
  826    HG   CYS 105           HG       CYS 105 -53.869  -2.569  -7.522
  827    H    PHE 106           H        PHE 106 -48.759  -3.811  -6.558
  828    HA   PHE 106           HA       PHE 106 -48.736  -6.252  -4.885
  829    HB2  PHE 106           2HB      PHE 106 -46.855  -7.220  -6.270
  830    HB3  PHE 106           3HB      PHE 106 -48.459  -7.309  -6.963
  831    HD1  PHE 106           HD1      PHE 106 -45.131  -5.683  -7.274
  832    HD2  PHE 106           HD2      PHE 106 -49.072  -6.091  -8.979
  833    HE1  PHE 106           HE1      PHE 106 -44.351  -4.585  -9.362
  834    HE2  PHE 106           HE2      PHE 106 -48.286  -4.995 -11.057
  835    HZ   PHE 106           HZ       PHE 106 -45.924  -4.232 -11.254
  836    H    LEU 107           H        LEU 107 -47.209  -6.307  -3.360
  837    HA   LEU 107           HA       LEU 107 -44.891  -4.421  -3.398
  838    HB2  LEU 107           2HB      LEU 107 -46.641  -4.011  -1.605
  839    HB3  LEU 107           3HB      LEU 107 -46.356  -5.614  -1.017
  840    HG   LEU 107           HG       LEU 107 -44.982  -4.731   0.449
  841   HD11  LEU 107          1HD1      LEU 107 -43.100  -5.549  -0.815
  842   HD12  LEU 107          2HD1      LEU 107 -43.075  -4.083  -1.817
  843   HD13  LEU 107          3HD1      LEU 107 -42.684  -4.005  -0.095
  844   HD21  LEU 107          3HD2      LEU 107 -44.355  -2.516   0.712
  845   HD22  LEU 107          1HD2      LEU 107 -44.674  -2.158  -0.984
  846   HD23  LEU 107          2HD2      LEU 107 -46.017  -2.571   0.106
  847    H    CYS 108           H        CYS 108 -43.057  -5.468  -3.722
  848    HA   CYS 108           HA       CYS 108 -42.550  -8.127  -2.487
  849    HB2  CYS 108           2HB      CYS 108 -41.882  -7.296  -5.342
  850    HB3  CYS 108           3HB      CYS 108 -41.211  -8.722  -4.537
  851    HG   CYS 108           HG       CYS 108 -43.548  -9.817  -3.924
  852    H    LEU 109           H        LEU 109 -39.949  -8.460  -2.679
  853    HA   LEU 109           HA       LEU 109 -38.831  -6.159  -1.243
  854    HB2  LEU 109           2HB      LEU 109 -38.574  -8.484  -0.463
  855    HB3  LEU 109           3HB      LEU 109 -37.668  -8.887  -1.916
  856    HG   LEU 109           HG       LEU 109 -35.804  -7.464  -1.227
  857   HD11  LEU 109          1HD1      LEU 109 -36.918  -5.600  -0.137
  858   HD12  LEU 109          2HD1      LEU 109 -37.551  -6.671   1.139
  859   HD13  LEU 109          3HD1      LEU 109 -35.807  -6.351   1.006
  860   HD21  LEU 109          3HD2      LEU 109 -36.804  -9.138   1.106
  861   HD22  LEU 109          1HD2      LEU 109 -35.943  -9.755  -0.323
  862   HD23  LEU 109          2HD2      LEU 109 -35.123  -8.650   0.791
  863    H    VAL 110           H        VAL 110 -39.314  -4.987  -3.392
  864    HA   VAL 110           HA       VAL 110 -37.882  -5.360  -5.748
  865    HB   VAL 110           HB       VAL 110 -38.814  -2.734  -4.604
  866   HG11  VAL 110          1HG1      VAL 110 -38.343  -3.506  -7.513
  867   HG12  VAL 110          2HG1      VAL 110 -39.034  -1.975  -6.953
  868   HG13  VAL 110          3HG1      VAL 110 -37.363  -2.349  -6.583
  869   HG21  VAL 110          3HG2      VAL 110 -40.689  -4.345  -4.749
  870   HG22  VAL 110          1HG2      VAL 110 -40.868  -3.131  -5.997
  871   HG23  VAL 110          2HG2      VAL 110 -40.244  -4.736  -6.424
  872    H    ASP 111           H        ASP 111 -36.006  -4.328  -6.719
  873    HA   ASP 111           HA       ASP 111 -33.933  -4.065  -4.570
  874    HB2  ASP 111           2HB      ASP 111 -34.001  -5.945  -6.378
  875    HB3  ASP 111           3HB      ASP 111 -33.220  -4.737  -7.398
  876    H    VAL 112           H        VAL 112 -34.723  -1.832  -4.332
  877    HA   VAL 112           HA       VAL 112 -34.212   0.078  -6.451
  878    HB   VAL 112           HB       VAL 112 -35.033   0.544  -3.555
  879   HG11  VAL 112          1HG1      VAL 112 -36.117   2.551  -4.342
  880   HG12  VAL 112          2HG1      VAL 112 -34.439   2.635  -4.887
  881   HG13  VAL 112          3HG1      VAL 112 -35.732   2.179  -6.025
  882   HG21  VAL 112          3HG2      VAL 112 -36.579  -1.072  -4.545
  883   HG22  VAL 112          1HG2      VAL 112 -37.351   0.510  -4.469
  884   HG23  VAL 112          2HG2      VAL 112 -36.706  -0.104  -6.018
  885    H    VAL 113           H        VAL 113 -31.889  -0.602  -6.546
  886    HA   VAL 113           HA       VAL 113 -30.194   0.957  -4.641
  887    HB   VAL 113           HB       VAL 113 -29.976  -1.483  -4.527
  888   HG11  VAL 113          1HG1      VAL 113 -30.243  -2.055  -6.942
  889   HG12  VAL 113          2HG1      VAL 113 -28.638  -1.360  -7.260
  890   HG13  VAL 113          3HG1      VAL 113 -28.808  -2.770  -6.202
  891   HG21  VAL 113          3HG2      VAL 113 -27.442  -0.082  -5.445
  892   HG22  VAL 113          1HG2      VAL 113 -28.142  -0.027  -3.807
  893   HG23  VAL 113          2HG2      VAL 113 -27.546  -1.556  -4.464
  894    HA   PRO 114           HA       PRO 114 -29.297   3.333  -8.314
  895    HB2  PRO 114           2HB      PRO 114 -27.731   5.263  -7.346
  896    HB3  PRO 114           3HB      PRO 114 -29.323   5.006  -6.630
  897    HG2  PRO 114           2HG      PRO 114 -26.709   3.910  -5.585
  898    HG3  PRO 114           3HG      PRO 114 -27.949   4.887  -4.720
  899    HD2  PRO 114           2HD      PRO 114 -27.942   2.152  -4.631
  900    HD3  PRO 114           3HD      PRO 114 -29.466   3.087  -4.653
  901    H    VAL 115           H        VAL 115 -26.990   4.658  -9.156
  902    HA   VAL 115           HA       VAL 115 -24.796   2.649  -9.233
  903    HB   VAL 115           HB       VAL 115 -24.292   3.305 -11.558
  904   HG11  VAL 115          1HG1      VAL 115 -25.904   1.767 -12.560
  905   HG12  VAL 115          2HG1      VAL 115 -25.327   1.158 -11.000
  906   HG13  VAL 115          3HG1      VAL 115 -26.942   1.884 -11.124
  907   HG21  VAL 115          3HG2      VAL 115 -25.644   5.349 -11.692
  908   HG22  VAL 115          1HG2      VAL 115 -25.988   4.216 -13.002
  909   HG23  VAL 115          2HG2      VAL 115 -27.128   4.373 -11.640
  910    H    LYS 116           H        LYS 116 -22.874   3.259  -8.915
  911    HA   LYS 116           HA       LYS 116 -22.239   6.116  -8.378
  912    HB2  LYS 116           2HB      LYS 116 -21.232   3.626  -6.940
  913    HB3  LYS 116           3HB      LYS 116 -20.739   5.257  -6.577
  914    HG2  LYS 116           2HG      LYS 116 -22.549   5.649  -5.278
  915    HG3  LYS 116           3HG      LYS 116 -23.662   5.028  -6.481
  916    HD2  LYS 116           2HD      LYS 116 -23.899   3.708  -4.505
  917    HD3  LYS 116           3HD      LYS 116 -23.140   2.691  -5.735
  918    HE2  LYS 116           2HE      LYS 116 -20.914   3.103  -4.690
  919    HE3  LYS 116           3HE      LYS 116 -21.671   4.176  -3.503
  920    HZ1  LYS 116           HZ1      LYS 116 -22.250   1.276  -3.762
  921    HZ2  LYS 116           HZ2      LYS 116 -21.361   1.967  -2.577
  922    HZ3  LYS 116           HZ3      LYS 116 -22.961   2.289  -2.687
  923    H    ASN 117           H        ASN 117 -20.030   6.657  -8.433
  924    HA   ASN 117           HA       ASN 117 -18.546   5.392 -10.702
  925    HB2  ASN 117           2HB      ASN 117 -17.412   7.384 -11.020
  926    HB3  ASN 117           3HB      ASN 117 -19.033   7.907 -10.633
  927   HD21  ASN 117          2HD2      ASN 117 -19.364   8.707  -8.266
  928   HD22  ASN 117          1HD2      ASN 117 -17.940   9.447  -7.550
  929    H    GLU 118           H        GLU 118 -15.980   5.674 -10.310
  930    HA   GLU 118           HA       GLU 118 -15.280   3.627  -8.477
  931    HB2  GLU 118           2HB      GLU 118 -12.995   4.051  -9.143
  932    HB3  GLU 118           3HB      GLU 118 -14.068   4.083 -10.540
  933    HG2  GLU 118           2HG      GLU 118 -14.030   6.585 -10.499
  934    HG3  GLU 118           3HG      GLU 118 -12.932   6.535  -9.118
  935    H    ASP 119           H        ASP 119 -15.472   7.080  -7.859
  936    HA   ASP 119           HA       ASP 119 -13.965   7.052  -5.389
  937    HB2  ASP 119           2HB      ASP 119 -14.594   9.055  -6.872
  938    HB3  ASP 119           3HB      ASP 119 -16.195   8.967  -6.138
  939    H    GLY 120           H        GLY 120 -17.106   5.838  -6.195
  940    HA2  GLY 120           HA2      GLY 120 -18.458   4.542  -4.793
  941    HA3  GLY 120           HA3      GLY 120 -17.774   5.305  -3.356
  942    H    ALA 121           H        ALA 121 -18.554   7.745  -5.562
  943    HA   ALA 121           HA       ALA 121 -21.025   8.389  -4.086
  944    HB1  ALA 121           3HB      ALA 121 -20.723  10.644  -4.966
  945    HB2  ALA 121           1HB      ALA 121 -19.189  10.074  -4.272
  946    HB3  ALA 121           2HB      ALA 121 -19.426  10.095  -6.037
  947    H    VAL 122           H        VAL 122 -22.983   8.696  -4.880
  948    HA   VAL 122           HA       VAL 122 -23.712   7.201  -7.239
  949    HB   VAL 122           HB       VAL 122 -24.991   6.967  -5.275
  950   HG11  VAL 122          1HG1      VAL 122 -26.446   8.593  -4.295
  951   HG12  VAL 122          2HG1      VAL 122 -24.807   9.252  -4.277
  952   HG13  VAL 122          3HG1      VAL 122 -25.992   9.825  -5.476
  953   HG21  VAL 122          3HG2      VAL 122 -26.703   8.346  -7.362
  954   HG22  VAL 122          1HG2      VAL 122 -26.087   6.692  -7.465
  955   HG23  VAL 122          2HG2      VAL 122 -27.219   7.144  -6.172
  956    H    ILE 123           H        ILE 123 -23.111   8.031  -9.085
  957    HA   ILE 123           HA       ILE 123 -23.695  10.849  -9.714
  958    HB   ILE 123           HB       ILE 123 -22.322  10.797 -11.473
  959   HG12  ILE 123          2HG1      ILE 123 -23.050   8.992 -12.822
  960   HG13  ILE 123          3HG1      ILE 123 -21.318   8.926 -12.626
  961   HG21  ILE 123          1HG2      ILE 123 -20.206  10.012 -10.680
  962   HG22  ILE 123          2HG2      ILE 123 -21.164  10.534  -9.283
  963   HG23  ILE 123          3HG2      ILE 123 -20.980   8.805  -9.631
  964   HD11  ILE 123          3HD1      ILE 123 -22.172   6.690 -12.599
  965   HD12  ILE 123          1HD1      ILE 123 -21.622   7.057 -10.956
  966   HD13  ILE 123          2HD1      ILE 123 -23.356   7.069 -11.358
  967    H    MET 124           H        MET 124 -25.032   7.652 -10.448
  968    HA   MET 124           HA       MET 124 -27.281   9.129 -11.692
  969    HB2  MET 124           2HB      MET 124 -25.736   6.986 -13.107
  970    HB3  MET 124           3HB      MET 124 -27.494   6.956 -13.220
  971    HG2  MET 124           2HG      MET 124 -27.259   8.334 -14.932
  972    HG3  MET 124           3HG      MET 124 -27.038   9.597 -13.737
  973    HE1  MET 124           3HE      MET 124 -25.080  11.166 -13.804
  974    HE2  MET 124           1HE      MET 124 -24.077  11.184 -15.268
  975    HE3  MET 124           2HE      MET 124 -25.853  11.166 -15.407
  976    H    PHE 125           H        PHE 125 -29.186   8.290 -11.635
  977    HA   PHE 125           HA       PHE 125 -29.733   6.429  -9.353
  978    HB2  PHE 125           2HB      PHE 125 -31.010   8.961 -10.428
  979    HB3  PHE 125           3HB      PHE 125 -32.037   7.780  -9.665
  980    HD1  PHE 125           HD1      PHE 125 -29.493   7.209  -7.496
  981    HD2  PHE 125           HD2      PHE 125 -31.984  10.485  -8.795
  982    HE1  PHE 125           HE1      PHE 125 -29.076   8.373  -5.368
  983    HE2  PHE 125           HE2      PHE 125 -31.537  11.656  -6.648
  984    HZ   PHE 125           HZ       PHE 125 -30.044  10.616  -4.955
  985    H    ILE 126           H        ILE 126 -29.269   4.726 -10.797
  986    HA   ILE 126           HA       ILE 126 -31.571   4.035 -12.576
  987    HB   ILE 126           HB       ILE 126 -28.900   2.622 -12.323
  988   HG12  ILE 126          2HG1      ILE 126 -29.991   4.553 -14.415
  989   HG13  ILE 126          3HG1      ILE 126 -28.646   4.854 -13.331
  990   HG21  ILE 126          1HG2      ILE 126 -30.884   1.159 -12.988
  991   HG22  ILE 126          2HG2      ILE 126 -31.165   2.229 -14.340
  992   HG23  ILE 126          3HG2      ILE 126 -29.664   1.290 -14.241
  993   HD11  ILE 126          3HD1      ILE 126 -27.432   2.927 -14.360
  994   HD12  ILE 126          1HD1      ILE 126 -28.714   2.853 -15.589
  995   HD13  ILE 126          2HD1      ILE 126 -27.729   4.325 -15.438
  996    H    LEU 127           H        LEU 127 -32.772   4.106 -10.504
  997    HA   LEU 127           HA       LEU 127 -32.283   1.903  -8.648
  998    HB2  LEU 127           2HB      LEU 127 -34.728   3.682  -8.812
  999    HB3  LEU 127           3HB      LEU 127 -34.222   2.619  -7.524
 1000    HG   LEU 127           HG       LEU 127 -33.400   4.427  -6.568
 1001   HD11  LEU 127          1HD1      LEU 127 -31.350   5.103  -6.666
 1002   HD12  LEU 127          2HD1      LEU 127 -31.354   3.380  -7.030
 1003   HD13  LEU 127          3HD1      LEU 127 -31.105   4.570  -8.358
 1004   HD21  LEU 127          3HD2      LEU 127 -34.533   5.971  -8.041
 1005   HD22  LEU 127          1HD2      LEU 127 -32.925   6.587  -7.648
 1006   HD23  LEU 127          2HD2      LEU 127 -33.220   5.825  -9.231
 1007    H    ASN 128           H        ASN 128 -32.216   0.205 -10.022
 1008    HA   ASN 128           HA       ASN 128 -34.079  -0.681 -11.891
 1009    HB2  ASN 128           2HB      ASN 128 -32.440  -2.435  -9.998
 1010    HB3  ASN 128           3HB      ASN 128 -33.153  -2.951 -11.520
 1011   HD21  ASN 128          2HD2      ASN 128 -30.436  -1.310 -10.041
 1012   HD22  ASN 128          1HD2      ASN 128 -29.599  -1.004 -11.547
 1013    H    PHE 129           H        PHE 129 -36.321  -0.772 -11.543
 1014    HA   PHE 129           HA       PHE 129 -37.301  -1.631  -8.939
 1015    HB2  PHE 129           2HB      PHE 129 -38.830  -0.805 -11.405
 1016    HB3  PHE 129           3HB      PHE 129 -39.463  -1.087  -9.776
 1017    HD1  PHE 129           HD2      PHE 129 -37.430   0.458  -8.122
 1018    HD2  PHE 129           HD1      PHE 129 -39.485   1.419 -11.789
 1019    HE1  PHE 129           HE2      PHE 129 -37.297   2.875  -7.574
 1020    HE2  PHE 129           HE1      PHE 129 -39.342   3.831 -11.234
 1021    HZ   PHE 129           HZ       PHE 129 -38.235   4.564  -9.131
 1022    H    GLU 130           H        GLU 130 -36.046  -3.729  -9.601
 1023    HA   GLU 130           HA       GLU 130 -37.703  -5.623 -11.128
 1024    HB2  GLU 130           2HB      GLU 130 -35.995  -7.285 -10.432
 1025    HB3  GLU 130           3HB      GLU 130 -35.415  -5.921 -11.426
 1026    HG2  GLU 130           2HG      GLU 130 -34.426  -4.824  -9.565
 1027    HG3  GLU 130           3HG      GLU 130 -35.159  -5.911  -8.403
 1028    H    VAL 131           H        VAL 131 -39.137  -6.900 -10.389
 1029    HA   VAL 131           HA       VAL 131 -40.020  -6.835  -7.577
 1030    HB   VAL 131           HB       VAL 131 -41.071  -8.117 -10.113
 1031   HG11  VAL 131          1HG1      VAL 131 -42.438  -8.020  -7.410
 1032   HG12  VAL 131          2HG1      VAL 131 -43.148  -8.618  -8.920
 1033   HG13  VAL 131          3HG1      VAL 131 -41.800  -9.493  -8.185
 1034   HG21  VAL 131          3HG2      VAL 131 -42.856  -6.436  -9.940
 1035   HG22  VAL 131          1HG2      VAL 131 -42.127  -5.787  -8.453
 1036   HG23  VAL 131          2HG2      VAL 131 -41.279  -5.642 -10.003
 1037    H    VAL 132           H        VAL 132 -39.202  -8.253  -6.079
 1038    HA   VAL 132           HA       VAL 132 -38.592 -11.000  -6.989
 1039    HB   VAL 132           HB       VAL 132 -36.509  -9.919  -7.357
 1040   HG11  VAL 132          1HG1      VAL 132 -36.609  -8.047  -5.789
 1041   HG12  VAL 132          2HG1      VAL 132 -36.444  -9.175  -4.419
 1042   HG13  VAL 132          3HG1      VAL 132 -35.121  -8.977  -5.586
 1043   HG21  VAL 132          3HG2      VAL 132 -36.267 -11.670  -4.884
 1044   HG22  VAL 132          1HG2      VAL 132 -36.510 -12.263  -6.546
 1045   HG23  VAL 132          2HG2      VAL 132 -35.039 -11.375  -6.127
 1046    H    MET 133           H        MET 133 -38.822 -12.571  -5.583
 1047    HA   MET 133           HA       MET 133 -39.379 -12.033  -2.725
 1048    HB2  MET 133           2HB      MET 133 -41.308 -13.476  -2.734
 1049    HB3  MET 133           3HB      MET 133 -41.562 -12.183  -3.905
 1050    HG2  MET 133           2HG      MET 133 -40.918 -13.722  -5.745
 1051    HG3  MET 133           3HG      MET 133 -40.676 -15.023  -4.582
 1052    HE1  MET 133           3HE      MET 133 -44.284 -15.908  -3.414
 1053    HE2  MET 133           1HE      MET 133 -42.545 -16.235  -3.252
 1054    HE3  MET 133           2HE      MET 133 -43.240 -14.740  -2.583
 1055    H    GLU 134           H        GLU 134 -39.453 -14.230  -1.534
 1056    HA   GLU 134           HA       GLU 134 -36.947 -15.573  -1.863
 1057    HB2  GLU 134           2HB      GLU 134 -39.414 -16.383  -0.277
 1058    HB3  GLU 134           3HB      GLU 134 -37.829 -17.159  -0.165
 1059    HG2  GLU 134           2HG      GLU 134 -36.825 -14.979   0.528
 1060    HG3  GLU 134           3HG      GLU 134 -38.430 -14.245   0.506
 1061    H    LYS 135           H        LYS 135 -36.335 -17.403  -2.844
 1062    HA   LYS 135           HA       LYS 135 -37.839 -18.424  -5.066
 1063    HB2  LYS 135           2HB      LYS 135 -35.414 -18.115  -5.085
 1064    HB3  LYS 135           3HB      LYS 135 -35.221 -19.328  -3.812
 1065    HG2  LYS 135           2HG      LYS 135 -36.063 -21.086  -5.311
 1066    HG3  LYS 135           3HG      LYS 135 -36.380 -19.886  -6.582
 1067    HD2  LYS 135           2HD      LYS 135 -34.007 -19.386  -6.785
 1068    HD3  LYS 135           3HD      LYS 135 -33.621 -20.400  -5.379
 1069    HE2  LYS 135           2HE      LYS 135 -34.380 -22.409  -6.558
 1070    HE3  LYS 135           3HE      LYS 135 -34.881 -21.443  -7.949
 1071    HZ1  LYS 135           HZ1      LYS 135 -32.558 -20.826  -8.297
 1072    HZ2  LYS 135           HZ2      LYS 135 -32.079 -21.677  -6.982
 1073    HZ3  LYS 135           HZ3      LYS 135 -32.685 -22.452  -8.283
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1   7.448 -19.827 -14.347
    2    H2   MET   1           2H       MET   1   7.303 -20.009 -12.723
    3    H3   MET   1           3H       MET   1   6.015 -19.531 -13.619
    4    HA   MET   1           HA       MET   1   7.337 -22.153 -13.830
    5    HB2  MET   1           2HB      MET   1   4.728 -21.373 -12.459
    6    HB3  MET   1           3HB      MET   1   5.093 -23.019 -12.963
    7    HG2  MET   1           2HG      MET   1   5.631 -22.873 -10.674
    8    HG3  MET   1           3HG      MET   1   7.138 -23.019 -11.568
    9    HE1  MET   1           3HE      MET   1   8.472 -22.404  -9.371
   10    HE2  MET   1           1HE      MET   1   8.143 -20.966  -8.380
   11    HE3  MET   1           2HE      MET   1   6.935 -22.264  -8.486
   12    HA   PRO   2           HA       PRO   2   5.475 -22.559 -17.801
   13    HB2  PRO   2           2HB      PRO   2   4.710 -25.360 -16.983
   14    HB3  PRO   2           3HB      PRO   2   5.556 -24.805 -18.463
   15    HG2  PRO   2           2HG      PRO   2   6.964 -25.931 -16.449
   16    HG3  PRO   2           3HG      PRO   2   7.593 -24.450 -17.248
   17    HD2  PRO   2           2HD      PRO   2   6.054 -24.669 -14.642
   18    HD3  PRO   2           3HD      PRO   2   7.560 -23.766 -14.993
   19    H    VAL   3           H        VAL   3   3.489 -22.755 -18.965
   20    HA   VAL   3           HA       VAL   3   1.088 -22.074 -17.455
   21    HB   VAL   3           HB       VAL   3   1.433 -22.571 -20.438
   22   HG11  VAL   3          1HG1      VAL   3  -0.806 -21.193 -18.881
   23   HG12  VAL   3          2HG1      VAL   3  -0.635 -21.201 -20.649
   24   HG13  VAL   3          3HG1      VAL   3  -0.938 -22.713 -19.799
   25   HG21  VAL   3          3HG2      VAL   3   1.451 -19.972 -18.834
   26   HG22  VAL   3          1HG2      VAL   3   2.837 -20.680 -19.693
   27   HG23  VAL   3          2HG2      VAL   3   1.451 -20.090 -20.607
   28    H    ARG   4           H        ARG   4  -0.673 -23.312 -17.016
   29    HA   ARG   4           HA       ARG   4  -0.372 -26.194 -16.940
   30    HB2  ARG   4           2HB      ARG   4  -2.775 -24.432 -16.317
   31    HB3  ARG   4           3HB      ARG   4  -2.647 -26.156 -15.949
   32    HG2  ARG   4           2HG      ARG   4  -0.676 -25.684 -14.486
   33    HG3  ARG   4           3HG      ARG   4  -0.912 -23.950 -14.759
   34    HD2  ARG   4           2HD      ARG   4  -2.934 -25.865 -13.515
   35    HD3  ARG   4           3HD      ARG   4  -1.933 -24.730 -12.622
   36    HE   ARG   4           HE       ARG   4  -4.338 -24.144 -14.219
   37   HH11  ARG   4          2HH1      ARG   4  -1.591 -22.651 -12.629
   38   HH12  ARG   4          1HH1      ARG   4  -2.355 -21.085 -12.591
   39   HH21  ARG   4          1HH2      ARG   4  -5.248 -22.129 -14.126
   40   HH22  ARG   4          2HH2      ARG   4  -4.370 -20.806 -13.419
   41    H    ARG   5           H        ARG   5  -1.705 -27.779 -17.804
   42    HA   ARG   5           HA       ARG   5  -3.503 -27.159 -20.082
   43    HB2  ARG   5           2HB      ARG   5  -1.219 -29.183 -20.226
   44    HB3  ARG   5           3HB      ARG   5  -2.535 -29.050 -21.398
   45    HG2  ARG   5           2HG      ARG   5  -1.827 -26.710 -21.914
   46    HG3  ARG   5           3HG      ARG   5  -0.450 -26.905 -20.807
   47    HD2  ARG   5           2HD      ARG   5   0.378 -28.800 -22.157
   48    HD3  ARG   5           3HD      ARG   5  -0.990 -28.603 -23.274
   49    HE   ARG   5           HE       ARG   5   0.354 -26.106 -23.073
   50   HH11  ARG   5          1HH1      ARG   5   1.016 -29.275 -24.412
   51   HH12  ARG   5          2HH1      ARG   5   2.099 -28.640 -25.621
   52   HH21  ARG   5          1HH2      ARG   5   1.742 -25.361 -24.640
   53   HH22  ARG   5          2HH2      ARG   5   2.495 -26.479 -25.740
   54    H    GLY   6           H        GLY   6  -5.135 -28.662 -20.403
   55    HA2  GLY   6           HA2      GLY   6  -6.639 -30.332 -19.913
   56    HA3  GLY   6           HA3      GLY   6  -5.357 -31.190 -19.058
   57    H    HIS   7           H        HIS   7  -5.875 -28.058 -17.777
   58    HA   HIS   7           HA       HIS   7  -6.985 -29.120 -15.282
   59    HB2  HIS   7           2HB      HIS   7  -6.417 -26.875 -14.439
   60    HB3  HIS   7           3HB      HIS   7  -5.054 -27.632 -15.257
   61    HD2  HIS   7           HD2      HIS   7  -7.289 -24.561 -15.406
   62    HE1  HIS   7           HE1      HIS   7  -4.769 -24.314 -18.841
   63    HE2  HIS   7           HE2      HIS   7  -6.461 -23.059 -17.412
   64    H    VAL   8           H        VAL   8  -8.674 -27.961 -14.103
   65    HA   VAL   8           HA       VAL   8 -11.033 -27.338 -15.753
   66    HB   VAL   8           HB       VAL   8 -10.786 -27.227 -12.720
   67   HG11  VAL   8          1HG1      VAL   8 -13.203 -27.514 -14.572
   68   HG12  VAL   8          2HG1      VAL   8 -13.244 -27.560 -12.796
   69   HG13  VAL   8          3HG1      VAL   8 -12.790 -26.073 -13.619
   70   HG21  VAL   8          3HG2      VAL   8 -11.666 -29.545 -14.503
   71   HG22  VAL   8          1HG2      VAL   8 -10.245 -29.518 -13.434
   72   HG23  VAL   8          2HG2      VAL   8 -11.863 -29.477 -12.737
   73    H    ALA   9           H        ALA   9 -11.845 -25.317 -16.110
   74    HA   ALA   9           HA       ALA   9 -10.299 -22.936 -15.774
   75    HB1  ALA   9           3HB      ALA   9 -12.376 -21.827 -16.546
   76    HB2  ALA   9           1HB      ALA   9 -12.014 -23.263 -17.519
   77    HB3  ALA   9           2HB      ALA   9 -13.284 -23.327 -16.273
   78    HA   PRO  10           HA       PRO  10 -11.199 -21.436 -11.664
   79    HB2  PRO  10           2HB      PRO  10 -12.141 -18.890 -12.961
   80    HB3  PRO  10           3HB      PRO  10 -11.037 -19.104 -11.574
   81    HG2  PRO  10           2HG      PRO  10 -10.049 -18.564 -14.048
   82    HG3  PRO  10           3HG      PRO  10  -9.248 -19.773 -12.994
   83    HD2  PRO  10           2HD      PRO  10 -11.087 -20.266 -15.344
   84    HD3  PRO  10           3HD      PRO  10  -9.607 -21.126 -14.842
   85    H    GLN  11           H        GLN  11 -12.832 -22.386 -10.707
   86    HA   GLN  11           HA       GLN  11 -15.303 -22.872 -11.937
   87    HB2  GLN  11           2HB      GLN  11 -15.879 -24.162 -10.068
   88    HB3  GLN  11           3HB      GLN  11 -14.155 -24.359 -10.330
   89    HG2  GLN  11           2HG      GLN  11 -15.503 -22.683  -8.165
   90    HG3  GLN  11           3HG      GLN  11 -14.695 -24.231  -7.956
   91   HE21  GLN  11          2HE2      GLN  11 -14.203 -21.263  -6.969
   92   HE22  GLN  11          1HE2      GLN  11 -12.456 -21.151  -7.182
   93    H    ASN  12           H        ASN  12 -14.494 -20.226  -9.796
   94    HA   ASN  12           HA       ASN  12 -17.182 -19.586  -8.945
   95    HB2  ASN  12           2HB      ASN  12 -14.528 -18.074  -9.001
   96    HB3  ASN  12           3HB      ASN  12 -16.032 -17.300  -8.515
   97   HD21  ASN  12          2HD2      ASN  12 -14.554 -17.038  -6.527
   98   HD22  ASN  12          1HD2      ASN  12 -14.737 -18.300  -5.317
   99    H    THR  13           H        THR  13 -15.092 -18.239 -11.545
  100    HA   THR  13           HA       THR  13 -17.214 -16.553 -12.607
  101    HB   THR  13           HB       THR  13 -14.668 -16.239 -12.709
  102    HG1  THR  13           HG1      THR  13 -16.214 -15.818 -15.057
  103   HG21  THR  13          1HG2      THR  13 -13.510 -16.964 -14.680
  104   HG22  THR  13          2HG2      THR  13 -14.169 -18.386 -13.851
  105   HG23  THR  13          3HG2      THR  13 -14.961 -17.786 -15.309
  106    H    PHE  14           H        PHE  14 -15.886 -19.760 -13.450
  107    HA   PHE  14           HA       PHE  14 -17.361 -20.241 -15.824
  108    HB2  PHE  14           2HB      PHE  14 -15.489 -21.592 -14.883
  109    HB3  PHE  14           3HB      PHE  14 -16.553 -22.163 -13.611
  110    HD1  PHE  14           HD1      PHE  14 -15.852 -22.292 -17.259
  111    HD2  PHE  14           HD2      PHE  14 -18.214 -23.902 -14.026
  112    HE1  PHE  14           HE1      PHE  14 -16.602 -24.151 -18.728
  113    HE2  PHE  14           HE2      PHE  14 -18.963 -25.756 -15.500
  114    HZ   PHE  14           HZ       PHE  14 -18.157 -25.883 -17.851
  115    H    LEU  15           H        LEU  15 -18.226 -20.654 -12.401
  116    HA   LEU  15           HA       LEU  15 -20.964 -21.510 -12.953
  117    HB2  LEU  15           2HB      LEU  15 -20.009 -22.128 -10.843
  118    HB3  LEU  15           3HB      LEU  15 -19.636 -20.448 -10.445
  119    HG   LEU  15           HG       LEU  15 -21.999 -19.887 -10.276
  120   HD11  LEU  15          1HD1      LEU  15 -23.779 -21.564 -10.366
  121   HD12  LEU  15          2HD1      LEU  15 -22.968 -21.495 -11.918
  122   HD13  LEU  15          3HD1      LEU  15 -22.601 -22.831 -10.821
  123   HD21  LEU  15          3HD2      LEU  15 -20.828 -20.732  -8.287
  124   HD22  LEU  15          1HD2      LEU  15 -22.543 -21.181  -8.266
  125   HD23  LEU  15          2HD2      LEU  15 -21.313 -22.394  -8.694
  126    H    ASP  16           H        ASP  16 -19.579 -18.296 -12.030
  127    HA   ASP  16           HA       ASP  16 -21.824 -16.747 -12.056
  128    HB2  ASP  16           2HB      ASP  16 -19.418 -16.040 -11.686
  129    HB3  ASP  16           3HB      ASP  16 -19.292 -15.836 -13.433
  130    H    THR  17           H        THR  17 -20.192 -17.905 -14.971
  131    HA   THR  17           HA       THR  17 -21.864 -16.512 -16.897
  132    HB   THR  17           HB       THR  17 -20.430 -19.187 -17.173
  133    HG1  THR  17           HG1      THR  17 -18.847 -17.919 -18.136
  134   HG21  THR  17          1HG2      THR  17 -21.540 -17.298 -19.301
  135   HG22  THR  17          2HG2      THR  17 -20.455 -18.672 -19.621
  136   HG23  THR  17          3HG2      THR  17 -22.074 -18.964 -18.983
  137    H    ILE  18           H        ILE  18 -22.303 -19.588 -15.171
  138    HA   ILE  18           HA       ILE  18 -24.774 -20.320 -16.558
  139    HB   ILE  18           HB       ILE  18 -23.731 -21.258 -13.878
  140   HG12  ILE  18          2HG1      ILE  18 -22.004 -21.735 -15.510
  141   HG13  ILE  18          3HG1      ILE  18 -22.741 -23.182 -14.874
  142   HG21  ILE  18          1HG2      ILE  18 -25.082 -23.319 -14.370
  143   HG22  ILE  18          2HG2      ILE  18 -26.032 -21.861 -14.112
  144   HG23  ILE  18          3HG2      ILE  18 -25.784 -22.460 -15.762
  145   HD11  ILE  18          3HD1      ILE  18 -22.292 -23.321 -17.320
  146   HD12  ILE  18          1HD1      ILE  18 -24.029 -23.450 -17.002
  147   HD13  ILE  18          2HD1      ILE  18 -23.342 -21.920 -17.605
  148    H    ILE  19           H        ILE  19 -23.883 -18.559 -13.553
  149    HA   ILE  19           HA       ILE  19 -26.511 -18.125 -12.643
  150    HB   ILE  19           HB       ILE  19 -24.251 -16.097 -12.489
  151   HG12  ILE  19          2HG1      ILE  19 -23.407 -18.072 -11.417
  152   HG13  ILE  19          3HG1      ILE  19 -23.864 -16.925 -10.180
  153   HG21  ILE  19          1HG2      ILE  19 -26.850 -16.398 -10.951
  154   HG22  ILE  19          2HG2      ILE  19 -25.532 -15.297 -10.487
  155   HG23  ILE  19          3HG2      ILE  19 -26.377 -15.066 -12.020
  156   HD11  ILE  19          3HD1      ILE  19 -24.500 -19.144  -9.513
  157   HD12  ILE  19          1HD1      ILE  19 -26.004 -18.243  -9.864
  158   HD13  ILE  19          2HD1      ILE  19 -25.359 -19.426 -11.034
  159    H    ARG  20           H        ARG  20 -24.562 -16.076 -14.950
  160    HA   ARG  20           HA       ARG  20 -26.660 -14.311 -15.693
  161    HB2  ARG  20           2HB      ARG  20 -24.048 -15.248 -16.920
  162    HB3  ARG  20           3HB      ARG  20 -25.219 -14.516 -17.994
  163    HG2  ARG  20           2HG      ARG  20 -24.240 -12.624 -17.477
  164    HG3  ARG  20           3HG      ARG  20 -25.307 -12.651 -16.083
  165    HD2  ARG  20           2HD      ARG  20 -22.438 -13.689 -16.079
  166    HD3  ARG  20           3HD      ARG  20 -22.859 -12.023 -15.701
  167    HE   ARG  20           HE       ARG  20 -23.002 -14.267 -13.938
  168   HH11  ARG  20          2HH1      ARG  20 -24.915 -11.415 -14.600
  169   HH12  ARG  20          1HH1      ARG  20 -25.602 -11.433 -13.019
  170   HH21  ARG  20          1HH2      ARG  20 -23.331 -13.725 -11.834
  171   HH22  ARG  20          2HH2      ARG  20 -24.578 -12.564 -11.417
  172    H    LYS  21           H        LYS  21 -26.032 -17.607 -16.787
  173    HA   LYS  21           HA       LYS  21 -27.879 -17.639 -18.993
  174    HB2  LYS  21           2HB      LYS  21 -26.001 -19.282 -18.238
  175    HB3  LYS  21           3HB      LYS  21 -27.324 -20.058 -17.327
  176    HG2  LYS  21           2HG      LYS  21 -28.580 -20.445 -19.357
  177    HG3  LYS  21           3HG      LYS  21 -27.438 -19.459 -20.317
  178    HD2  LYS  21           2HD      LYS  21 -25.612 -20.995 -19.840
  179    HD3  LYS  21           3HD      LYS  21 -26.618 -21.869 -18.691
  180    HE2  LYS  21           2HE      LYS  21 -26.477 -23.199 -20.706
  181    HE3  LYS  21           3HE      LYS  21 -28.128 -22.594 -20.548
  182    HZ1  LYS  21           HZ1      LYS  21 -26.041 -21.415 -22.313
  183    HZ2  LYS  21           HZ2      LYS  21 -27.278 -22.348 -22.817
  184    HZ3  LYS  21           HZ3      LYS  21 -27.581 -20.874 -22.193
  185    H    PHE  22           H        PHE  22 -28.361 -18.492 -15.522
  186    HA   PHE  22           HA       PHE  22 -31.281 -18.657 -16.084
  187    HB2  PHE  22           2HB      PHE  22 -31.591 -19.984 -14.197
  188    HB3  PHE  22           3HB      PHE  22 -30.264 -20.633 -15.123
  189    HD1  PHE  22           HD2      PHE  22 -31.074 -18.633 -12.031
  190    HD2  PHE  22           HD1      PHE  22 -28.220 -21.143 -14.057
  191    HE1  PHE  22           HE2      PHE  22 -29.752 -18.802  -9.949
  192    HE2  PHE  22           HE1      PHE  22 -26.907 -21.336 -11.952
  193    HZ   PHE  22           HZ       PHE  22 -27.674 -20.168  -9.896
  194    H    GLU  23           H        GLU  23 -29.321 -16.257 -15.055
  195    HA   GLU  23           HA       GLU  23 -30.110 -15.278 -12.709
  196    HB2  GLU  23           2HB      GLU  23 -28.286 -14.361 -14.049
  197    HB3  GLU  23           3HB      GLU  23 -29.418 -13.679 -15.199
  198    HG2  GLU  23           2HG      GLU  23 -30.174 -12.035 -13.609
  199    HG3  GLU  23           3HG      GLU  23 -29.400 -12.893 -12.265
  200    H    GLY  24           H        GLY  24 -32.134 -14.976 -15.600
  201    HA2  GLY  24           HA2      GLY  24 -34.347 -14.227 -15.808
  202    HA3  GLY  24           HA3      GLY  24 -34.379 -13.842 -14.085
  203    H    GLN  25           H        GLN  25 -32.603 -12.718 -16.987
  204    HA   GLN  25           HA       GLN  25 -32.142 -10.064 -15.991
  205    HB2  GLN  25           2HB      GLN  25 -31.616 -11.340 -18.704
  206    HB3  GLN  25           3HB      GLN  25 -31.060  -9.732 -18.209
  207    HG2  GLN  25           2HG      GLN  25 -29.856 -10.771 -16.277
  208    HG3  GLN  25           3HG      GLN  25 -30.266 -12.367 -16.910
  209   HE21  GLN  25          2HE2      GLN  25 -27.606 -11.441 -16.476
  210   HE22  GLN  25          1HE2      GLN  25 -26.826 -11.359 -18.070
  211    H    SER  26           H        SER  26 -34.997 -11.191 -16.951
  212    HA   SER  26           HA       SER  26 -36.020  -8.959 -18.525
  213    HB2  SER  26           2HB      SER  26 -38.217 -10.007 -17.996
  214    HB3  SER  26           3HB      SER  26 -37.060 -11.122 -18.738
  215    HG   SER  26           HG       SER  26 -38.118 -12.057 -16.919
  216    H    ARG  27           H        ARG  27 -34.658  -8.789 -15.687
  217    HA   ARG  27           HA       ARG  27 -36.348  -7.394 -13.879
  218    HB2  ARG  27           2HB      ARG  27 -33.457  -6.686 -14.540
  219    HB3  ARG  27           3HB      ARG  27 -34.299  -6.313 -13.053
  220    HG2  ARG  27           2HG      ARG  27 -33.387  -9.032 -14.015
  221    HG3  ARG  27           3HG      ARG  27 -32.725  -8.101 -12.690
  222    HD2  ARG  27           2HD      ARG  27 -34.738  -8.494 -11.352
  223    HD3  ARG  27           3HD      ARG  27 -35.535  -9.266 -12.724
  224    HE   ARG  27           HE       ARG  27 -33.976 -11.081 -12.655
  225   HH11  ARG  27          2HH1      ARG  27 -33.594  -9.057  -9.755
  226   HH12  ARG  27          1HH1      ARG  27 -32.951 -10.399  -8.859
  227   HH21  ARG  27          2HH2      ARG  27 -32.900 -12.610 -11.462
  228   HH22  ARG  27          1HH2      ARG  27 -32.585 -12.323  -9.776
  229    H    LYS  28           H        LYS  28 -36.801  -5.227 -13.525
  230    HA   LYS  28           HA       LYS  28 -37.075  -3.531 -15.941
  231    HB2  LYS  28           2HB      LYS  28 -38.657  -2.773 -13.598
  232    HB3  LYS  28           3HB      LYS  28 -39.185  -3.020 -15.234
  233    HG2  LYS  28           2HG      LYS  28 -38.687  -5.284 -13.251
  234    HG3  LYS  28           3HG      LYS  28 -40.193  -4.460 -13.395
  235    HD2  LYS  28           2HD      LYS  28 -40.466  -5.131 -15.721
  236    HD3  LYS  28           3HD      LYS  28 -38.877  -5.885 -15.713
  237    HE2  LYS  28           2HE      LYS  28 -39.811  -7.286 -13.721
  238    HE3  LYS  28           3HE      LYS  28 -41.403  -6.736 -14.248
  239    HZ1  LYS  28           HZ1      LYS  28 -39.436  -8.167 -15.968
  240    HZ2  LYS  28           HZ2      LYS  28 -40.752  -8.870 -15.285
  241    HZ3  LYS  28           HZ3      LYS  28 -40.943  -7.721 -16.434
  242    H    PHE  29           H        PHE  29 -36.735  -1.231 -15.898
  243    HA   PHE  29           HA       PHE  29 -35.662   0.079 -13.569
  244    HB2  PHE  29           2HB      PHE  29 -33.319   0.291 -14.231
  245    HB3  PHE  29           3HB      PHE  29 -33.729  -1.374 -13.966
  246    HD1  PHE  29           HD1      PHE  29 -33.970  -2.978 -15.889
  247    HD2  PHE  29           HD2      PHE  29 -32.459   1.034 -16.361
  248    HE1  PHE  29           HE1      PHE  29 -32.886  -3.641 -18.014
  249    HE2  PHE  29           HE2      PHE  29 -31.341   0.351 -18.478
  250    HZ   PHE  29           HZ       PHE  29 -31.548  -1.983 -19.299
  251    H    ILE  30           H        ILE  30 -34.760   2.134 -13.835
  252    HA   ILE  30           HA       ILE  30 -35.435   3.567 -16.351
  253    HB   ILE  30           HB       ILE  30 -35.931   5.561 -14.891
  254   HG12  ILE  30          2HG1      ILE  30 -36.756   5.265 -12.642
  255   HG13  ILE  30          3HG1      ILE  30 -36.324   3.556 -12.636
  256   HG21  ILE  30          1HG2      ILE  30 -37.807   3.194 -14.671
  257   HG22  ILE  30          2HG2      ILE  30 -38.238   4.924 -14.631
  258   HG23  ILE  30          3HG2      ILE  30 -37.556   4.208 -16.104
  259   HD11  ILE  30          3HD1      ILE  30 -34.747   5.093 -11.395
  260   HD12  ILE  30          1HD1      ILE  30 -33.967   4.070 -12.618
  261   HD13  ILE  30          2HD1      ILE  30 -34.280   5.796 -12.950
  262    H    ILE  31           H        ILE  31 -34.298   5.750 -16.385
  263    HA   ILE  31           HA       ILE  31 -31.519   5.577 -15.328
  264    HB   ILE  31           HB       ILE  31 -32.264   6.670 -18.053
  265   HG12  ILE  31          2HG1      ILE  31 -32.845   4.235 -18.065
  266   HG13  ILE  31          3HG1      ILE  31 -31.558   4.685 -19.188
  267   HG21  ILE  31          1HG2      ILE  31 -30.205   7.529 -17.130
  268   HG22  ILE  31          2HG2      ILE  31 -29.631   5.905 -16.736
  269   HG23  ILE  31          3HG2      ILE  31 -29.803   6.407 -18.437
  270   HD11  ILE  31          3HD1      ILE  31 -29.845   3.772 -17.825
  271   HD12  ILE  31          1HD1      ILE  31 -30.924   3.626 -16.428
  272   HD13  ILE  31          2HD1      ILE  31 -31.147   2.568 -17.848
  273    H    ALA  32           H        ALA  32 -31.203   7.235 -14.079
  274    HA   ALA  32           HA       ALA  32 -32.452   9.865 -14.771
  275    HB1  ALA  32           3HB      ALA  32 -32.574   8.458 -12.093
  276    HB2  ALA  32           1HB      ALA  32 -32.981  10.153 -12.315
  277    HB3  ALA  32           2HB      ALA  32 -33.917   8.890 -13.155
  278    H    ASN  33           H        ASN  33 -31.642  11.753 -13.908
  279    HA   ASN  33           HA       ASN  33 -28.706  11.681 -13.583
  280    HB2  ASN  33           2HB      ASN  33 -28.929  14.200 -13.482
  281    HB3  ASN  33           3HB      ASN  33 -29.298  13.407 -14.991
  282   HD21  ASN  33          2HD2      ASN  33 -30.221  15.599 -15.386
  283   HD22  ASN  33          1HD2      ASN  33 -31.912  15.792 -14.949
  284    H    ALA  34           H        ALA  34 -27.909  11.046 -11.703
  285    HA   ALA  34           HA       ALA  34 -29.211  11.344  -9.152
  286    HB1  ALA  34           3HB      ALA  34 -27.080  10.474  -8.270
  287    HB2  ALA  34           1HB      ALA  34 -27.555   9.561  -9.714
  288    HB3  ALA  34           2HB      ALA  34 -26.274  10.788  -9.805
  289    H    ARG  35           H        ARG  35 -27.371  13.553 -11.000
  290    HA   ARG  35           HA       ARG  35 -26.232  15.009  -8.677
  291    HB2  ARG  35           2HB      ARG  35 -25.740  15.542 -11.622
  292    HB3  ARG  35           3HB      ARG  35 -24.795  16.105 -10.253
  293    HG2  ARG  35           2HG      ARG  35 -24.941  13.315 -11.419
  294    HG3  ARG  35           3HG      ARG  35 -23.547  14.372 -11.283
  295    HD2  ARG  35           2HD      ARG  35 -24.943  12.869  -9.034
  296    HD3  ARG  35           3HD      ARG  35 -23.350  12.548  -9.721
  297    HE   ARG  35           HE       ARG  35 -23.283  15.193  -8.753
  298   HH11  ARG  35          1HH1      ARG  35 -23.515  11.945  -7.425
  299   HH12  ARG  35          2HH1      ARG  35 -22.893  12.454  -5.872
  300   HH21  ARG  35          1HH2      ARG  35 -22.463  15.745  -6.758
  301   HH22  ARG  35          2HH2      ARG  35 -22.276  14.534  -5.526
  302    H    VAL  36           H        VAL  36 -29.145  15.207 -10.037
  303    HA   VAL  36           HA       VAL  36 -29.327  18.181  -9.856
  304    HB   VAL  36           HB       VAL  36 -29.767  16.875 -12.107
  305   HG11  VAL  36          1HG1      VAL  36 -32.101  16.385 -12.538
  306   HG12  VAL  36          2HG1      VAL  36 -31.507  15.340 -11.227
  307   HG13  VAL  36          3HG1      VAL  36 -32.546  16.743 -10.881
  308   HG21  VAL  36          3HG2      VAL  36 -31.623  19.076 -11.173
  309   HG22  VAL  36          1HG2      VAL  36 -29.969  19.278 -11.814
  310   HG23  VAL  36          2HG2      VAL  36 -31.235  18.611 -12.853
  311    H    GLU  37           H        GLU  37 -30.892  19.072  -8.527
  312    HA   GLU  37           HA       GLU  37 -31.699  17.637  -6.250
  313    HB2  GLU  37           2HB      GLU  37 -31.431  20.106  -6.510
  314    HB3  GLU  37           3HB      GLU  37 -32.950  20.162  -7.410
  315    HG2  GLU  37           2HG      GLU  37 -34.178  19.373  -5.421
  316    HG3  GLU  37           3HG      GLU  37 -32.660  19.162  -4.542
  317    H    ASN  38           H        ASN  38 -33.435  17.970  -9.298
  318    HA   ASN  38           HA       ASN  38 -35.969  16.954  -8.312
  319    HB2  ASN  38           2HB      ASN  38 -35.330  18.523 -10.369
  320    HB3  ASN  38           3HB      ASN  38 -35.188  16.996 -11.234
  321   HD21  ASN  38          2HD2      ASN  38 -37.331  15.495 -10.462
  322   HD22  ASN  38          1HD2      ASN  38 -38.813  16.393 -10.801
  323    H    CYS  39           H        CYS  39 -33.038  15.298  -9.109
  324    HA   CYS  39           HA       CYS  39 -32.510  13.181  -9.813
  325    HB2  CYS  39           2HB      CYS  39 -34.724  12.594  -7.815
  326    HB3  CYS  39           3HB      CYS  39 -33.475  11.454  -8.345
  327    HG   CYS  39           HG       CYS  39 -33.003  14.433  -6.942
  328    H    ALA  40           H        ALA  40 -33.734  14.017 -11.974
  329    HA   ALA  40           HA       ALA  40 -36.238  12.577 -12.398
  330    HB1  ALA  40           3HB      ALA  40 -36.164  14.981 -12.792
  331    HB2  ALA  40           1HB      ALA  40 -34.953  14.740 -14.077
  332    HB3  ALA  40           2HB      ALA  40 -36.600  14.086 -14.249
  333    H    VAL  41           H        VAL  41 -36.830  11.400 -14.114
  334    HA   VAL  41           HA       VAL  41 -34.960   9.443 -15.069
  335    HB   VAL  41           HB       VAL  41 -37.947   9.848 -15.460
  336   HG11  VAL  41          1HG1      VAL  41 -36.224   7.431 -16.116
  337   HG12  VAL  41          2HG1      VAL  41 -38.000   7.440 -16.110
  338   HG13  VAL  41          3HG1      VAL  41 -37.124   8.406 -17.293
  339   HG21  VAL  41          3HG2      VAL  41 -36.404   7.907 -13.679
  340   HG22  VAL  41          1HG2      VAL  41 -37.246   9.358 -13.111
  341   HG23  VAL  41          2HG2      VAL  41 -38.173   8.040 -13.822
  342    H    ILE  42           H        ILE  42 -33.568  10.476 -16.430
  343    HA   ILE  42           HA       ILE  42 -34.351  12.005 -18.770
  344    HB   ILE  42           HB       ILE  42 -31.970  11.800 -19.388
  345   HG12  ILE  42          2HG1      ILE  42 -31.688  10.080 -16.882
  346   HG13  ILE  42          3HG1      ILE  42 -31.562   9.489 -18.540
  347   HG21  ILE  42          1HG2      ILE  42 -31.113  13.167 -17.582
  348   HG22  ILE  42          2HG2      ILE  42 -32.823  13.544 -17.789
  349   HG23  ILE  42          3HG2      ILE  42 -32.302  12.514 -16.439
  350   HD11  ILE  42          3HD1      ILE  42 -29.384   9.722 -17.644
  351   HD12  ILE  42          1HD1      ILE  42 -29.599  10.998 -18.863
  352   HD13  ILE  42          2HD1      ILE  42 -29.683  11.386 -17.116
  353    H    TYR  43           H        TYR  43 -34.026   8.610 -18.090
  354    HA   TYR  43           HA       TYR  43 -35.206   7.952 -20.680
  355    HB2  TYR  43           2HB      TYR  43 -32.582   8.012 -21.013
  356    HB3  TYR  43           3HB      TYR  43 -32.616   6.493 -20.172
  357    HD1  TYR  43           HD1      TYR  43 -33.953   8.292 -23.144
  358    HD2  TYR  43           HD2      TYR  43 -33.285   4.458 -21.276
  359    HE1  TYR  43           HE1      TYR  43 -34.588   7.148 -25.263
  360    HE2  TYR  43           HE2      TYR  43 -33.927   3.318 -23.394
  361    HH   TYR  43           HH       TYR  43 -34.880   5.139 -26.331
  362    H    CYS  44           H        CYS  44 -35.867   5.621 -20.870
  363    HA   CYS  44           HA       CYS  44 -35.710   4.158 -18.338
  364    HB2  CYS  44           2HB      CYS  44 -38.148   3.689 -18.279
  365    HB3  CYS  44           3HB      CYS  44 -37.787   5.418 -18.070
  366    HG   CYS  44           HG       CYS  44 -39.951   5.075 -19.524
  367    H    ASN  45           H        ASN  45 -36.225   1.903 -18.440
  368    HA   ASN  45           HA       ASN  45 -35.658   0.779 -21.115
  369    HB2  ASN  45           2HB      ASN  45 -34.432   0.077 -19.017
  370    HB3  ASN  45           3HB      ASN  45 -35.895  -0.772 -18.516
  371   HD21  ASN  45          1HD2      ASN  45 -33.413  -0.526 -21.121
  372   HD22  ASN  45          2HD2      ASN  45 -33.661  -2.168 -21.688
  373    H    ASP  46           H        ASP  46 -36.864  -0.915 -22.030
  374    HA   ASP  46           HA       ASP  46 -39.745  -0.582 -21.927
  375    HB2  ASP  46           2HB      ASP  46 -38.059  -2.785 -23.163
  376    HB3  ASP  46           3HB      ASP  46 -39.791  -2.556 -23.421
  377    H    GLY  47           H        GLY  47 -37.496  -2.656 -20.162
  378    HA2  GLY  47           HA2      GLY  47 -39.208  -4.529 -18.966
  379    HA3  GLY  47           HA3      GLY  47 -37.833  -3.746 -18.171
  380    H    PHE  48           H        PHE  48 -38.692  -1.066 -17.927
  381    HA   PHE  48           HA       PHE  48 -40.546  -1.226 -15.723
  382    HB2  PHE  48           2HB      PHE  48 -39.551   0.777 -15.377
  383    HB3  PHE  48           3HB      PHE  48 -38.926   0.848 -17.014
  384    HD1  PHE  48           HD1      PHE  48 -41.828   1.759 -14.852
  385    HD2  PHE  48           HD2      PHE  48 -40.067   2.108 -18.776
  386    HE1  PHE  48           HE1      PHE  48 -43.699   3.217 -15.573
  387    HE2  PHE  48           HE2      PHE  48 -41.950   3.538 -19.495
  388    HZ   PHE  48           HZ       PHE  48 -43.789   4.070 -17.910
  389    H    CYS  49           H        CYS  49 -40.916  -0.626 -19.195
  390    HA   CYS  49           HA       CYS  49 -43.630   0.347 -19.129
  391    HB2  CYS  49           2HB      CYS  49 -41.930   0.549 -21.038
  392    HB3  CYS  49           3HB      CYS  49 -42.354  -1.127 -21.457
  393    HG   CYS  49           HG       CYS  49 -43.639   0.496 -23.048
  394    H    GLU  50           H        GLU  50 -42.202  -2.923 -19.295
  395    HA   GLU  50           HA       GLU  50 -44.790  -4.291 -19.481
  396    HB2  GLU  50           2HB      GLU  50 -42.053  -5.357 -18.678
  397    HB3  GLU  50           3HB      GLU  50 -43.488  -6.321 -19.042
  398    HG2  GLU  50           2HG      GLU  50 -43.528  -5.316 -21.351
  399    HG3  GLU  50           3HG      GLU  50 -41.997  -4.525 -20.997
  400    H    LEU  51           H        LEU  51 -42.677  -3.237 -16.843
  401    HA   LEU  51           HA       LEU  51 -43.892  -4.676 -14.714
  402    HB2  LEU  51           2HB      LEU  51 -41.741  -3.493 -14.651
  403    HB3  LEU  51           3HB      LEU  51 -42.531  -1.957 -14.796
  404    HG   LEU  51           HG       LEU  51 -43.710  -2.201 -12.677
  405   HD11  LEU  51          1HD1      LEU  51 -41.988  -4.654 -12.192
  406   HD12  LEU  51          2HD1      LEU  51 -43.019  -3.821 -11.017
  407   HD13  LEU  51          3HD1      LEU  51 -43.752  -4.629 -12.404
  408   HD21  LEU  51          3HD2      LEU  51 -41.783  -1.742 -11.257
  409   HD22  LEU  51          1HD2      LEU  51 -40.702  -2.369 -12.519
  410   HD23  LEU  51          2HD2      LEU  51 -41.681  -0.915 -12.819
  411    H    CYS  52           H        CYS  52 -44.449  -1.264 -15.710
  412    HA   CYS  52           HA       CYS  52 -46.841  -1.162 -13.964
  413    HB2  CYS  52           2HB      CYS  52 -45.360   1.022 -15.480
  414    HB3  CYS  52           3HB      CYS  52 -46.667   1.243 -14.292
  415    HG   CYS  52           HG       CYS  52 -44.391   1.898 -13.183
  416    H    GLY  53           H        GLY  53 -46.171  -1.453 -17.377
  417    HA2  GLY  53           HA2      GLY  53 -47.639  -1.820 -19.110
  418    HA3  GLY  53           HA3      GLY  53 -48.991  -1.731 -17.982
  419    H    TYR  54           H        TYR  54 -46.943   1.108 -18.044
  420    HA   TYR  54           HA       TYR  54 -49.057   2.638 -19.455
  421    HB2  TYR  54           2HB      TYR  54 -46.698   3.563 -17.794
  422    HB3  TYR  54           3HB      TYR  54 -47.864   4.620 -18.582
  423    HD1  TYR  54           HD1      TYR  54 -50.401   4.244 -18.038
  424    HD2  TYR  54           HD2      TYR  54 -47.116   2.982 -15.551
  425    HE1  TYR  54           HE1      TYR  54 -51.926   4.145 -16.067
  426    HE2  TYR  54           HE2      TYR  54 -48.651   2.836 -13.589
  427    HH   TYR  54           HH       TYR  54 -50.793   3.121 -12.830
  428    H    SER  55           H        SER  55 -46.299   4.390 -19.826
  429    HA   SER  55           HA       SER  55 -45.165   3.264 -22.252
  430    HB2  SER  55           2HB      SER  55 -47.109   5.600 -22.375
  431    HB3  SER  55           3HB      SER  55 -45.798   5.428 -23.552
  432    HG   SER  55           HG       SER  55 -47.542   3.273 -23.000
  433    H    ARG  56           H        ARG  56 -43.285   4.419 -22.876
  434    HA   ARG  56           HA       ARG  56 -41.784   5.569 -20.730
  435    HB2  ARG  56           2HB      ARG  56 -40.108   6.120 -22.506
  436    HB3  ARG  56           3HB      ARG  56 -40.618   4.437 -22.393
  437    HG2  ARG  56           2HG      ARG  56 -41.969   4.646 -24.422
  438    HG3  ARG  56           3HG      ARG  56 -41.622   6.380 -24.506
  439    HD2  ARG  56           2HD      ARG  56 -40.225   5.120 -26.075
  440    HD3  ARG  56           3HD      ARG  56 -39.243   5.938 -24.871
  441    HE   ARG  56           HE       ARG  56 -39.804   2.989 -25.031
  442   HH11  ARG  56          2HH2      ARG  56 -37.783   5.520 -23.627
  443   HH12  ARG  56          1HH2      ARG  56 -36.850   4.322 -22.740
  444   HH21  ARG  56          1HH1      ARG  56 -38.458   1.594 -23.903
  445   HH22  ARG  56          2HH1      ARG  56 -37.191   2.303 -22.897
  446    H    ALA  57           H        ALA  57 -43.603   7.234 -23.231
  447    HA   ALA  57           HA       ALA  57 -42.760   9.897 -22.699
  448    HB1  ALA  57           3HB      ALA  57 -44.020   9.160 -24.689
  449    HB2  ALA  57           1HB      ALA  57 -45.434   8.797 -23.673
  450    HB3  ALA  57           2HB      ALA  57 -44.872  10.474 -23.854
  451    H    GLU  58           H        GLU  58 -44.771   7.784 -20.772
  452    HA   GLU  58           HA       GLU  58 -46.042   9.907 -19.204
  453    HB2  GLU  58           2HB      GLU  58 -45.968   6.921 -18.663
  454    HB3  GLU  58           3HB      GLU  58 -47.072   8.098 -17.994
  455    HG2  GLU  58           2HG      GLU  58 -46.961   7.386 -20.966
  456    HG3  GLU  58           3HG      GLU  58 -48.019   6.621 -19.818
  457    H    VAL  59           H        VAL  59 -43.034   8.128 -19.117
  458    HA   VAL  59           HA       VAL  59 -42.560   8.973 -16.287
  459    HB   VAL  59           HB       VAL  59 -40.651   7.383 -16.298
  460   HG11  VAL  59          1HG1      VAL  59 -42.061   5.489 -15.769
  461   HG12  VAL  59          2HG1      VAL  59 -42.849   6.964 -15.205
  462   HG13  VAL  59          3HG1      VAL  59 -43.420   6.182 -16.693
  463   HG21  VAL  59          3HG2      VAL  59 -40.432   7.043 -18.734
  464   HG22  VAL  59          1HG2      VAL  59 -40.591   5.547 -17.792
  465   HG23  VAL  59          2HG2      VAL  59 -41.989   6.163 -18.699
  466    H    MET  60           H        MET  60 -41.488   9.678 -19.538
  467    HA   MET  60           HA       MET  60 -38.923  10.577 -19.170
  468    HB2  MET  60           2HB      MET  60 -41.143  11.900 -20.776
  469    HB3  MET  60           3HB      MET  60 -39.467  12.423 -20.820
  470    HG2  MET  60           2HG      MET  60 -40.502   9.744 -21.732
  471    HG3  MET  60           3HG      MET  60 -39.992  11.079 -22.724
  472    HE1  MET  60           3HE      MET  60 -38.456   8.604 -19.851
  473    HE2  MET  60           1HE      MET  60 -39.146   7.826 -21.286
  474    HE3  MET  60           2HE      MET  60 -37.398   7.780 -21.010
  475    H    GLN  61           H        GLN  61 -38.071  11.666 -17.694
  476    HA   GLN  61           HA       GLN  61 -37.352  13.353 -16.476
  477    HB2  GLN  61           2HB      GLN  61 -39.311  15.111 -17.955
  478    HB3  GLN  61           3HB      GLN  61 -37.841  15.627 -17.142
  479    HG2  GLN  61           2HG      GLN  61 -36.458  14.917 -18.855
  480    HG3  GLN  61           3HG      GLN  61 -37.423  13.509 -19.240
  481   HE21  GLN  61          2HE2      GLN  61 -37.625  13.688 -21.424
  482   HE22  GLN  61          1HE2      GLN  61 -38.571  14.958 -22.164
  483    H    ARG  62           H        ARG  62 -39.886  11.770 -15.581
  484    HA   ARG  62           HA       ARG  62 -40.841  13.532 -13.428
  485    HB2  ARG  62           2HB      ARG  62 -41.268  10.630 -14.253
  486    HB3  ARG  62           3HB      ARG  62 -41.554  11.078 -12.587
  487    HG2  ARG  62           2HG      ARG  62 -43.627  11.343 -13.385
  488    HG3  ARG  62           3HG      ARG  62 -43.036  12.994 -13.518
  489    HD2  ARG  62           2HD      ARG  62 -43.039  11.007 -15.813
  490    HD3  ARG  62           3HD      ARG  62 -44.434  12.014 -15.454
  491    HE   ARG  62           HE       ARG  62 -42.036  12.791 -16.847
  492   HH11  ARG  62          1HH1      ARG  62 -44.549  14.230 -14.855
  493   HH12  ARG  62          2HH1      ARG  62 -44.293  15.800 -15.565
  494   HH21  ARG  62          1HH2      ARG  62 -41.806  14.697 -17.692
  495   HH22  ARG  62          2HH2      ARG  62 -42.745  16.078 -17.149
  496    HA   PRO  63           HA       PRO  63 -37.630  12.586 -10.452
  497    HB2  PRO  63           2HB      PRO  63 -38.984  12.587  -8.079
  498    HB3  PRO  63           3HB      PRO  63 -38.680  14.081  -9.014
  499    HG2  PRO  63           2HG      PRO  63 -41.189  12.374  -9.017
  500    HG3  PRO  63           3HG      PRO  63 -41.057  14.151  -8.818
  501    HD2  PRO  63           2HD      PRO  63 -41.623  13.027 -11.220
  502    HD3  PRO  63           3HD      PRO  63 -40.569  14.466 -11.109
  503    H    CYS  64           H        CYS  64 -36.681  10.707  -9.705
  504    HA   CYS  64           HA       CYS  64 -37.906   8.138  -9.977
  505    HB2  CYS  64           2HB      CYS  64 -35.447   9.084  -8.455
  506    HB3  CYS  64           3HB      CYS  64 -35.917   7.379  -8.615
  507    HG   CYS  64           HG       CYS  64 -35.251   9.607 -10.952
  508    H    THR  65           H        THR  65 -38.489  10.385  -7.452
  509    HA   THR  65           HA       THR  65 -38.692   8.749  -5.188
  510    HB   THR  65           HB       THR  65 -40.444  11.185  -5.615
  511    HG1  THR  65           HG1      THR  65 -38.684  12.436  -5.031
  512   HG21  THR  65          1HG2      THR  65 -38.830  10.108  -3.269
  513   HG22  THR  65          2HG2      THR  65 -39.879  11.546  -3.234
  514   HG23  THR  65          3HG2      THR  65 -40.592   9.940  -3.458
  515    H    CYS  66           H        CYS  66 -39.704   6.908  -5.626
  516    HA   CYS  66           HA       CYS  66 -41.842   6.200  -7.029
  517    HB2  CYS  66           2HB      CYS  66 -41.195   5.052  -4.279
  518    HB3  CYS  66           3HB      CYS  66 -42.063   4.215  -5.577
  519    HG   CYS  66           HG       CYS  66 -40.096   4.370  -7.350
  520    H    ASP  67           H        ASP  67 -42.271   7.990  -4.128
  521    HA   ASP  67           HA       ASP  67 -44.946   7.579  -3.359
  522    HB2  ASP  67           2HB      ASP  67 -43.333   9.127  -2.286
  523    HB3  ASP  67           3HB      ASP  67 -43.388  10.175  -3.698
  524    H    PHE  68           H        PHE  68 -43.691   9.387  -6.228
  525    HA   PHE  68           HA       PHE  68 -46.164  10.543  -6.985
  526    HB2  PHE  68           2HB      PHE  68 -45.069  11.415  -8.724
  527    HB3  PHE  68           3HB      PHE  68 -43.657  10.923  -7.827
  528    HD1  PHE  68           HD2      PHE  68 -45.787  10.294 -10.781
  529    HD2  PHE  68           HD1      PHE  68 -42.219   9.068  -8.698
  530    HE1  PHE  68           HE2      PHE  68 -45.036   9.047 -12.791
  531    HE2  PHE  68           HE1      PHE  68 -41.470   7.832 -10.704
  532    HZ   PHE  68           HZ       PHE  68 -42.871   7.820 -12.759
  533    H    LEU  69           H        LEU  69 -45.202   7.252  -7.258
  534    HA   LEU  69           HA       LEU  69 -47.644   6.636  -8.823
  535    HB2  LEU  69           2HB      LEU  69 -46.485   4.795  -9.951
  536    HB3  LEU  69           3HB      LEU  69 -45.914   6.396 -10.367
  537    HG   LEU  69           HG       LEU  69 -43.900   6.051  -8.894
  538   HD11  LEU  69          1HD1      LEU  69 -44.896   3.171  -8.819
  539   HD12  LEU  69          2HD1      LEU  69 -43.274   3.719  -8.332
  540   HD13  LEU  69          3HD1      LEU  69 -44.688   4.233  -7.413
  541   HD21  LEU  69          3HD2      LEU  69 -43.871   5.680 -11.345
  542   HD22  LEU  69          1HD2      LEU  69 -42.763   4.592 -10.500
  543   HD23  LEU  69          2HD2      LEU  69 -44.326   3.985 -11.094
  544    H    HIS  70           H        HIS  70 -47.101   6.754  -5.848
  545    HA   HIS  70           HA       HIS  70 -47.265   4.039  -4.916
  546    HB2  HIS  70           2HB      HIS  70 -47.563   4.864  -2.827
  547    HB3  HIS  70           3HB      HIS  70 -46.747   6.211  -3.577
  548    HD2  HIS  70           HD2      HIS  70 -48.941   8.030  -4.712
  549    HE1  HIS  70           HE1      HIS  70 -51.190   7.483  -1.131
  550    HE2  HIS  70           HE2      HIS  70 -50.899   8.936  -3.203
  551    H    GLY  71           H        GLY  71 -49.010   2.805  -4.175
  552    HA2  GLY  71           HA2      GLY  71 -51.727   3.445  -5.253
  553    HA3  GLY  71           HA3      GLY  71 -50.918   1.933  -5.661
  554    HA   PRO  72           HA       PRO  72 -53.745   1.631  -1.974
  555    HB2  PRO  72           2HB      PRO  72 -54.499  -0.947  -3.348
  556    HB3  PRO  72           3HB      PRO  72 -55.552   0.238  -2.516
  557    HG2  PRO  72           2HG      PRO  72 -55.431   0.209  -5.214
  558    HG3  PRO  72           3HG      PRO  72 -55.378   1.780  -4.345
  559    HD2  PRO  72           2HD      PRO  72 -53.061   0.175  -5.464
  560    HD3  PRO  72           3HD      PRO  72 -53.412   1.919  -5.629
  561    H    ARG  73           H        ARG  73 -51.204  -0.433  -2.989
  562    HA   ARG  73           HA       ARG  73 -51.139  -1.942  -0.389
  563    HB2  ARG  73           2HB      ARG  73 -49.791  -2.356  -3.089
  564    HB3  ARG  73           3HB      ARG  73 -49.346  -3.280  -1.662
  565    HG2  ARG  73           2HG      ARG  73 -52.181  -3.209  -2.768
  566    HG3  ARG  73           3HG      ARG  73 -50.968  -4.375  -3.280
  567    HD2  ARG  73           2HD      ARG  73 -51.959  -4.042  -0.422
  568    HD3  ARG  73           3HD      ARG  73 -52.546  -5.252  -1.553
  569    HE   ARG  73           HE       ARG  73 -50.073  -5.318  -0.032
  570   HH11  ARG  73          1HH1      ARG  73 -51.492  -6.601  -2.983
  571   HH12  ARG  73          2HH1      ARG  73 -50.485  -8.018  -2.945
  572   HH21  ARG  73          1HH2      ARG  73 -48.805  -7.130  -0.083
  573   HH22  ARG  73          2HH2      ARG  73 -48.986  -8.289  -1.364
  574    H    THR  74           H        THR  74 -49.748   0.872  -1.771
  575    HA   THR  74           HA       THR  74 -47.046   0.331  -0.882
  576    HB   THR  74           HB       THR  74 -48.038   3.080  -1.570
  577    HG1  THR  74           HG1      THR  74 -46.986   1.477  -3.579
  578   HG21  THR  74          1HG2      THR  74 -45.709   2.956  -0.852
  579   HG22  THR  74          2HG2      THR  74 -45.405   1.583  -1.935
  580   HG23  THR  74          3HG2      THR  74 -45.730   3.195  -2.606
  581    H    GLN  75           H        GLN  75 -45.983   0.877   0.869
  582    HA   GLN  75           HA       GLN  75 -47.511   1.994   3.132
  583    HB2  GLN  75           2HB      GLN  75 -44.643   1.015   3.142
  584    HB3  GLN  75           3HB      GLN  75 -45.688   1.347   4.520
  585    HG2  GLN  75           2HG      GLN  75 -45.940  -0.952   2.555
  586    HG3  GLN  75           3HG      GLN  75 -45.424  -0.998   4.242
  587   HE21  GLN  75          2HE2      GLN  75 -48.243  -1.125   2.120
  588   HE22  GLN  75          1HE2      GLN  75 -49.400  -1.168   3.440
  589    H    ARG  76           H        ARG  76 -47.196   3.897   4.050
  590    HA   ARG  76           HA       ARG  76 -45.894   5.978   2.497
  591    HB2  ARG  76           2HB      ARG  76 -46.998   6.273   5.278
  592    HB3  ARG  76           3HB      ARG  76 -46.829   7.519   4.039
  593    HG2  ARG  76           2HG      ARG  76 -48.835   5.238   4.146
  594    HG3  ARG  76           3HG      ARG  76 -49.175   6.956   4.172
  595    HD2  ARG  76           2HD      ARG  76 -49.153   7.135   1.888
  596    HD3  ARG  76           3HD      ARG  76 -47.740   6.115   1.713
  597    HE   ARG  76           HE       ARG  76 -48.999   4.190   1.526
  598   HH11  ARG  76          1HH1      ARG  76 -51.247   6.821   2.117
  599   HH12  ARG  76          2HH1      ARG  76 -52.599   5.870   1.561
  600   HH21  ARG  76          1HH2      ARG  76 -50.661   3.090   0.872
  601   HH22  ARG  76          2HH2      ARG  76 -52.274   3.773   0.851
  602    H    ARG  77           H        ARG  77 -45.029   4.313   5.492
  603    HA   ARG  77           HA       ARG  77 -42.583   5.684   6.013
  604    HB2  ARG  77           2HB      ARG  77 -41.893   3.723   7.209
  605    HB3  ARG  77           3HB      ARG  77 -43.597   4.068   7.536
  606    HG2  ARG  77           2HG      ARG  77 -44.189   2.250   5.869
  607    HG3  ARG  77           3HG      ARG  77 -42.467   1.833   5.794
  608    HD2  ARG  77           2HD      ARG  77 -42.476   1.410   8.232
  609    HD3  ARG  77           3HD      ARG  77 -44.194   1.816   8.304
  610    HE   ARG  77           HE       ARG  77 -42.973  -0.656   7.301
  611   HH11  ARG  77          1HH1      ARG  77 -45.964   1.183   7.430
  612   HH12  ARG  77          2HH1      ARG  77 -46.896  -0.162   6.810
  613   HH21  ARG  77          1HH2      ARG  77 -44.297  -2.387   6.823
  614   HH22  ARG  77          2HH2      ARG  77 -46.019  -2.148   6.714
  615    H    ALA  78           H        ALA  78 -43.249   3.127   3.660
  616    HA   ALA  78           HA       ALA  78 -40.506   2.704   2.839
  617    HB1  ALA  78           3HB      ALA  78 -41.510   1.419   1.034
  618    HB2  ALA  78           1HB      ALA  78 -42.340   1.036   2.525
  619    HB3  ALA  78           2HB      ALA  78 -43.092   2.089   1.300
  620    H    ALA  79           H        ALA  79 -43.241   4.605   1.481
  621    HA   ALA  79           HA       ALA  79 -41.713   5.755  -0.685
  622    HB1  ALA  79           3HB      ALA  79 -44.244   6.750   0.707
  623    HB2  ALA  79           1HB      ALA  79 -43.664   7.248  -0.892
  624    HB3  ALA  79           2HB      ALA  79 -44.194   5.575  -0.632
  625    H    ALA  80           H        ALA  80 -42.271   6.825   2.660
  626    HA   ALA  80           HA       ALA  80 -41.108   9.411   2.408
  627    HB1  ALA  80           3HB      ALA  80 -41.498   7.595   4.818
  628    HB2  ALA  80           1HB      ALA  80 -41.110   9.330   4.888
  629    HB3  ALA  80           2HB      ALA  80 -42.656   8.795   4.195
  630    H    GLN  81           H        GLN  81 -39.669   6.351   3.767
  631    HA   GLN  81           HA       GLN  81 -37.013   7.204   4.104
  632    HB2  GLN  81           2HB      GLN  81 -38.221   4.542   3.269
  633    HB3  GLN  81           3HB      GLN  81 -36.487   4.760   3.530
  634    HG2  GLN  81           2HG      GLN  81 -36.824   5.402   5.845
  635    HG3  GLN  81           3HG      GLN  81 -38.576   5.382   5.660
  636   HE21  GLN  81          2HE2      GLN  81 -35.666   3.238   5.514
  637   HE22  GLN  81          1HE2      GLN  81 -36.561   1.794   5.965
  638    H    ILE  82           H        ILE  82 -38.617   6.085   1.038
  639    HA   ILE  82           HA       ILE  82 -36.228   6.444  -0.542
  640    HB   ILE  82           HB       ILE  82 -39.169   6.248  -1.157
  641   HG12  ILE  82          2HG1      ILE  82 -36.781   4.593  -2.093
  642   HG13  ILE  82          3HG1      ILE  82 -37.510   4.351  -0.500
  643   HG21  ILE  82          1HG2      ILE  82 -38.398   7.852  -2.801
  644   HG22  ILE  82          2HG2      ILE  82 -36.936   6.898  -3.124
  645   HG23  ILE  82          3HG2      ILE  82 -38.538   6.281  -3.605
  646   HD11  ILE  82          3HD1      ILE  82 -39.683   3.908  -1.483
  647   HD12  ILE  82          1HD1      ILE  82 -38.995   4.094  -3.120
  648   HD13  ILE  82          2HD1      ILE  82 -38.410   2.793  -2.060
  649    H    ALA  83           H        ALA  83 -39.002   8.674   0.031
  650    HA   ALA  83           HA       ALA  83 -38.024  10.870  -1.397
  651    HB1  ALA  83           3HB      ALA  83 -39.412  12.234   0.038
  652    HB2  ALA  83           1HB      ALA  83 -40.255  10.703  -0.309
  653    HB3  ALA  83           2HB      ALA  83 -39.476  10.968   1.267
  654    H    GLN  84           H        GLN  84 -37.000   9.782   1.835
  655    HA   GLN  84           HA       GLN  84 -35.259  12.071   2.348
  656    HB2  GLN  84           2HB      GLN  84 -34.910   9.326   3.585
  657    HB3  GLN  84           3HB      GLN  84 -34.362  10.883   4.171
  658    HG2  GLN  84           2HG      GLN  84 -37.089   9.682   4.270
  659    HG3  GLN  84           3HG      GLN  84 -36.147  10.291   5.564
  660   HE21  GLN  84          1HE2      GLN  84 -38.654  10.996   3.378
  661   HE22  GLN  84          2HE2      GLN  84 -38.815  12.720   3.754
  662    H    ALA  85           H        ALA  85 -34.825   8.800   0.876
  663    HA   ALA  85           HA       ALA  85 -31.953   8.910   0.833
  664    HB1  ALA  85           3HB      ALA  85 -33.239   6.801   0.785
  665    HB2  ALA  85           1HB      ALA  85 -33.913   7.234  -0.803
  666    HB3  ALA  85           2HB      ALA  85 -32.175   6.930  -0.627
  667    H    LEU  86           H        LEU  86 -34.479   9.937  -1.423
  668    HA   LEU  86           HA       LEU  86 -32.523  10.741  -3.464
  669    HB2  LEU  86           2HB      LEU  86 -35.476  11.362  -3.474
  670    HB3  LEU  86           3HB      LEU  86 -34.343  11.315  -4.813
  671    HG   LEU  86           HG       LEU  86 -35.808   9.088  -3.427
  672   HD11  LEU  86          1HD1      LEU  86 -34.937   9.506  -6.312
  673   HD12  LEU  86          2HD1      LEU  86 -36.161   8.357  -5.714
  674   HD13  LEU  86          3HD1      LEU  86 -36.448  10.106  -5.621
  675   HD21  LEU  86          3HD2      LEU  86 -33.576   8.101  -3.205
  676   HD22  LEU  86          1HD2      LEU  86 -34.376   7.357  -4.571
  677   HD23  LEU  86          2HD2      LEU  86 -33.143   8.602  -4.849
  678    H    LEU  87           H        LEU  87 -34.365  12.347  -0.862
  679    HA   LEU  87           HA       LEU  87 -33.685  15.053  -1.361
  680    HB2  LEU  87           2HB      LEU  87 -35.345  14.642   0.177
  681    HB3  LEU  87           3HB      LEU  87 -34.529  13.261   0.869
  682    HG   LEU  87           HG       LEU  87 -33.443  15.885   1.472
  683   HD11  LEU  87          1HD1      LEU  87 -34.963  16.025   3.444
  684   HD12  LEU  87          2HD1      LEU  87 -35.849  16.086   1.913
  685   HD13  LEU  87          3HD1      LEU  87 -35.807  14.574   2.847
  686   HD21  LEU  87          3HD2      LEU  87 -32.135  14.047   2.342
  687   HD22  LEU  87          1HD2      LEU  87 -32.902  14.900   3.666
  688   HD23  LEU  87          2HD2      LEU  87 -33.575  13.354   3.124
  689    H    GLY  88           H        GLY  88 -31.876  12.349   0.029
  690    HA2  GLY  88           HA2      GLY  88 -29.519  12.239  -0.538
  691    HA3  GLY  88           HA3      GLY  88 -29.359  13.971  -0.256
  692    H    ALA  89           H        ALA  89 -31.226  12.047   2.052
  693    HA   ALA  89           HA       ALA  89 -29.520  12.588   4.273
  694    HB1  ALA  89           3HB      ALA  89 -30.885  10.848   5.403
  695    HB2  ALA  89           1HB      ALA  89 -31.891  12.001   4.509
  696    HB3  ALA  89           2HB      ALA  89 -31.590  10.381   3.841
  697    H    GLU  90           H        GLU  90 -29.943   9.668   2.282
  698    HA   GLU  90           HA       GLU  90 -27.173   9.187   1.878
  699    HB2  GLU  90           2HB      GLU  90 -27.092   6.886   2.820
  700    HB3  GLU  90           3HB      GLU  90 -27.076   8.151   4.038
  701    HG2  GLU  90           2HG      GLU  90 -29.492   7.750   4.505
  702    HG3  GLU  90           3HG      GLU  90 -29.509   6.468   3.291
  703    H    GLU  91           H        GLU  91 -26.931   7.908  -0.009
  704    HA   GLU  91           HA       GLU  91 -29.367   7.027  -1.435
  705    HB2  GLU  91           2HB      GLU  91 -26.400   6.857  -2.074
  706    HB3  GLU  91           3HB      GLU  91 -27.638   5.985  -2.960
  707    HG2  GLU  91           2HG      GLU  91 -27.457   7.940  -4.201
  708    HG3  GLU  91           3HG      GLU  91 -28.903   8.171  -3.260
  709    H    ARG  92           H        ARG  92 -30.314   5.268  -1.134
  710    HA   ARG  92           HA       ARG  92 -29.147   2.788  -0.026
  711    HB2  ARG  92           2HB      ARG  92 -29.491   4.363   1.936
  712    HB3  ARG  92           3HB      ARG  92 -31.187   4.479   1.511
  713    HG2  ARG  92           2HG      ARG  92 -30.972   2.976   3.363
  714    HG3  ARG  92           3HG      ARG  92 -31.461   2.035   1.963
  715    HD2  ARG  92           2HD      ARG  92 -29.793   0.806   3.204
  716    HD3  ARG  92           3HD      ARG  92 -29.074   1.300   1.664
  717    HE   ARG  92           HE       ARG  92 -28.529   3.277   3.706
  718   HH11  ARG  92          1HH2      ARG  92 -27.388   0.071   2.806
  719   HH12  ARG  92          2HH2      ARG  92 -25.845   0.351   3.571
  720   HH21  ARG  92          1HH1      ARG  92 -26.721   3.543   4.604
  721   HH22  ARG  92          2HH1      ARG  92 -25.442   2.320   4.601
  722    H    LYS  93           H        LYS  93 -30.359   1.035  -0.485
  723    HA   LYS  93           HA       LYS  93 -32.739   1.372  -2.169
  724    HB2  LYS  93           2HB      LYS  93 -31.059  -0.168  -2.852
  725    HB3  LYS  93           3HB      LYS  93 -31.137  -1.068  -1.348
  726    HG2  LYS  93           2HG      LYS  93 -33.663  -0.771  -2.986
  727    HG3  LYS  93           3HG      LYS  93 -32.398  -1.805  -3.625
  728    HD2  LYS  93           2HD      LYS  93 -33.671  -2.178  -0.877
  729    HD3  LYS  93           3HD      LYS  93 -34.116  -3.052  -2.349
  730    HE2  LYS  93           2HE      LYS  93 -31.759  -3.849  -2.564
  731    HE3  LYS  93           3HE      LYS  93 -31.365  -3.058  -1.034
  732    HZ1  LYS  93           HZ1      LYS  93 -33.360  -5.241  -1.364
  733    HZ2  LYS  93           HZ2      LYS  93 -31.878  -5.411  -0.708
  734    HZ3  LYS  93           HZ3      LYS  93 -33.003  -4.510   0.057
  735    H    VAL  94           H        VAL  94 -34.732   0.936  -1.737
  736    HA   VAL  94           HA       VAL  94 -35.623  -0.247   0.837
  737    HB   VAL  94           HB       VAL  94 -36.967   2.200  -0.311
  738   HG11  VAL  94          1HG1      VAL  94 -38.249   0.877   1.346
  739   HG12  VAL  94          2HG1      VAL  94 -36.925   1.049   2.517
  740   HG13  VAL  94          3HG1      VAL  94 -37.859   2.464   1.982
  741   HG21  VAL  94          3HG2      VAL  94 -34.815   2.311   1.843
  742   HG22  VAL  94          1HG2      VAL  94 -34.750   3.084   0.239
  743   HG23  VAL  94          2HG2      VAL  94 -35.920   3.641   1.428
  744    H    GLU  95           H        GLU  95 -37.684  -1.169   0.693
  745    HA   GLU  95           HA       GLU  95 -38.514  -2.052  -1.994
  746    HB2  GLU  95           2HB      GLU  95 -39.996  -3.541  -0.758
  747    HB3  GLU  95           3HB      GLU  95 -38.321  -3.657  -0.175
  748    HG2  GLU  95           2HG      GLU  95 -38.876  -2.249   1.784
  749    HG3  GLU  95           3HG      GLU  95 -40.530  -2.061   1.214
  750    H    ILE  96           H        ILE  96 -40.830  -1.840  -2.622
  751    HA   ILE  96           HA       ILE  96 -42.616  -0.239  -1.190
  752    HB   ILE  96           HB       ILE  96 -42.857   1.358  -3.447
  753   HG12  ILE  96          2HG1      ILE  96 -40.834   2.577  -3.847
  754   HG13  ILE  96          3HG1      ILE  96 -39.933   1.525  -2.755
  755   HG21  ILE  96          1HG2      ILE  96 -43.162   2.013  -1.071
  756   HG22  ILE  96          2HG2      ILE  96 -41.407   2.299  -0.992
  757   HG23  ILE  96          3HG2      ILE  96 -42.410   3.230  -2.108
  758   HD11  ILE  96          3HD1      ILE  96 -41.194   0.114  -5.013
  759   HD12  ILE  96          1HD1      ILE  96 -39.900   1.262  -5.430
  760   HD13  ILE  96          2HD1      ILE  96 -39.574  -0.032  -4.276
  761    H    ALA  97           H        ALA  97 -44.690  -0.176  -2.114
  762    HA   ALA  97           HA       ALA  97 -45.134  -2.353  -4.056
  763    HB1  ALA  97           3HB      ALA  97 -47.375  -2.399  -3.390
  764    HB2  ALA  97           1HB      ALA  97 -46.507  -2.048  -1.885
  765    HB3  ALA  97           2HB      ALA  97 -47.334  -0.755  -2.789
  766    H    PHE  98           H        PHE  98 -46.199  -2.196  -5.993
  767    HA   PHE  98           HA       PHE  98 -46.496   0.539  -7.194
  768    HB2  PHE  98           2HB      PHE  98 -45.685  -2.028  -8.597
  769    HB3  PHE  98           3HB      PHE  98 -45.845  -0.443  -9.337
  770    HD1  PHE  98           HD1      PHE  98 -44.421   1.339  -7.412
  771    HD2  PHE  98           HD2      PHE  98 -43.415  -2.605  -8.856
  772    HE1  PHE  98           HE1      PHE  98 -42.018   1.822  -7.070
  773    HE2  PHE  98           HE2      PHE  98 -41.023  -2.107  -8.521
  774    HZ   PHE  98           HZ       PHE  98 -40.314   0.098  -7.608
  775    H    TYR  99           H        TYR  99 -48.053   0.690  -8.935
  776    HA   TYR  99           HA       TYR  99 -50.027  -1.478  -9.081
  777    HB2  TYR  99           2HB      TYR  99 -51.924  -0.187  -8.883
  778    HB3  TYR  99           3HB      TYR  99 -50.918   0.320  -7.543
  779    HD1  TYR  99           HD2      TYR  99 -49.634   2.562  -7.757
  780    HD2  TYR  99           HD1      TYR  99 -52.739   1.341 -10.497
  781    HE1  TYR  99           HE2      TYR  99 -49.937   4.922  -8.472
  782    HE2  TYR  99           HE1      TYR  99 -53.037   3.709 -11.208
  783    HH   TYR  99           HH       TYR  99 -51.092   6.380  -9.813
  784    H    ARG 100           H        ARG 100 -50.819  -1.911 -11.032
  785    HA   ARG 100           HA       ARG 100 -49.441  -0.764 -13.350
  786    HB2  ARG 100           2HB      ARG 100 -51.470  -3.025 -13.220
  787    HB3  ARG 100           3HB      ARG 100 -50.394  -2.624 -14.567
  788    HG2  ARG 100           2HG      ARG 100 -48.452  -3.062 -12.870
  789    HG3  ARG 100           3HG      ARG 100 -49.701  -3.825 -11.875
  790    HD2  ARG 100           2HD      ARG 100 -48.790  -5.599 -13.129
  791    HD3  ARG 100           3HD      ARG 100 -50.303  -5.231 -13.953
  792    HE   ARG 100           HE       ARG 100 -47.546  -4.360 -14.787
  793   HH11  ARG 100          1HH1      ARG 100 -50.901  -4.794 -15.874
  794   HH12  ARG 100          2HH1      ARG 100 -50.400  -4.941 -17.532
  795   HH21  ARG 100          2HH2      ARG 100 -47.046  -4.691 -16.960
  796   HH22  ARG 100          1HH2      ARG 100 -48.336  -4.775 -18.124
  797    H    LYS 101           H        LYS 101 -50.589  -0.479 -15.352
  798    HA   LYS 101           HA       LYS 101 -52.540   1.596 -15.374
  799    HB2  LYS 101           2HB      LYS 101 -50.844   1.242 -17.075
  800    HB3  LYS 101           3HB      LYS 101 -51.493  -0.331 -17.499
  801    HG2  LYS 101           2HG      LYS 101 -53.287   2.094 -17.709
  802    HG3  LYS 101           3HG      LYS 101 -52.033   1.858 -18.927
  803    HD2  LYS 101           2HD      LYS 101 -52.855  -0.239 -19.617
  804    HD3  LYS 101           3HD      LYS 101 -53.927  -0.426 -18.255
  805    HE2  LYS 101           2HE      LYS 101 -54.245   1.679 -20.438
  806    HE3  LYS 101           3HE      LYS 101 -55.113   0.141 -20.362
  807    HZ1  LYS 101           HZ1      LYS 101 -55.327   2.314 -18.349
  808    HZ2  LYS 101           HZ2      LYS 101 -56.472   1.896 -19.434
  809    HZ3  LYS 101           HZ3      LYS 101 -56.072   0.869 -18.228
  810    H    ASP 102           H        ASP 102 -52.920  -1.898 -15.505
  811    HA   ASP 102           HA       ASP 102 -55.769  -1.834 -16.098
  812    HB2  ASP 102           2HB      ASP 102 -55.653  -4.247 -15.748
  813    HB3  ASP 102           3HB      ASP 102 -54.364  -3.689 -16.807
  814    H    GLY 103           H        GLY 103 -54.068  -1.130 -13.246
  815    HA2  GLY 103           HA2      GLY 103 -55.059  -0.365 -11.280
  816    HA3  GLY 103           HA3      GLY 103 -56.505  -1.318 -11.588
  817    H    SER 104           H        SER 104 -53.923  -3.468 -12.004
  818    HA   SER 104           HA       SER 104 -54.370  -4.690  -9.372
  819    HB2  SER 104           2HB      SER 104 -54.059  -6.045 -11.412
  820    HB3  SER 104           3HB      SER 104 -52.386  -5.453 -11.541
  821    HG   SER 104           HG       SER 104 -52.602  -7.502 -10.440
  822    H    CYS 105           H        CYS 105 -52.938  -4.815  -7.620
  823    HA   CYS 105           HA       CYS 105 -50.449  -3.214  -7.747
  824    HB2  CYS 105           2HB      CYS 105 -51.104  -2.046  -5.647
  825    HB3  CYS 105           3HB      CYS 105 -52.137  -1.653  -7.030
  826    HG   CYS 105           HG       CYS 105 -52.810  -4.062  -4.863
  827    H    PHE 106           H        PHE 106 -48.778  -3.788  -6.513
  828    HA   PHE 106           HA       PHE 106 -49.002  -5.985  -4.536
  829    HB2  PHE 106           2HB      PHE 106 -47.241  -7.286  -5.890
  830    HB3  PHE 106           3HB      PHE 106 -48.909  -7.341  -6.421
  831    HD1  PHE 106           HD1      PHE 106 -45.605  -5.698  -7.160
  832    HD2  PHE 106           HD2      PHE 106 -49.564  -6.646  -8.591
  833    HE1  PHE 106           HE1      PHE 106 -44.995  -4.864  -9.417
  834    HE2  PHE 106           HE2      PHE 106 -48.940  -5.850 -10.846
  835    HZ   PHE 106           HZ       PHE 106 -46.654  -4.937 -11.268
  836    H    LEU 107           H        LEU 107 -47.254  -6.265  -3.167
  837    HA   LEU 107           HA       LEU 107 -44.940  -4.404  -3.394
  838    HB2  LEU 107           2HB      LEU 107 -46.310  -4.320  -1.291
  839    HB3  LEU 107           3HB      LEU 107 -45.950  -6.008  -1.011
  840    HG   LEU 107           HG       LEU 107 -44.654  -4.525   0.393
  841   HD11  LEU 107          1HD1      LEU 107 -43.512  -6.691  -0.426
  842   HD12  LEU 107          2HD1      LEU 107 -42.574  -5.644  -1.514
  843   HD13  LEU 107          3HD1      LEU 107 -42.467  -5.398   0.214
  844   HD21  LEU 107          3HD2      LEU 107 -43.333  -3.441  -2.067
  845   HD22  LEU 107          1HD2      LEU 107 -44.462  -2.585  -0.964
  846   HD23  LEU 107          2HD2      LEU 107 -42.875  -3.096  -0.389
  847    H    CYS 108           H        CYS 108 -43.115  -5.261  -4.081
  848    HA   CYS 108           HA       CYS 108 -42.467  -8.132  -3.603
  849    HB2  CYS 108           2HB      CYS 108 -41.972  -6.552  -6.159
  850    HB3  CYS 108           3HB      CYS 108 -41.434  -8.223  -5.842
  851    HG   CYS 108           HG       CYS 108 -43.894  -9.162  -5.381
  852    H    LEU 109           H        LEU 109 -39.978  -8.449  -3.780
  853    HA   LEU 109           HA       LEU 109 -38.763  -6.412  -2.044
  854    HB2  LEU 109           2HB      LEU 109 -37.808  -9.121  -3.049
  855    HB3  LEU 109           3HB      LEU 109 -36.856  -8.051  -2.037
  856    HG   LEU 109           HG       LEU 109 -38.508  -8.194  -0.223
  857   HD11  LEU 109          1HD1      LEU 109 -39.910 -10.220  -2.019
  858   HD12  LEU 109          2HD1      LEU 109 -40.158 -10.103  -0.262
  859   HD13  LEU 109          3HD1      LEU 109 -40.609  -8.750  -1.288
  860   HD21  LEU 109          3HD2      LEU 109 -36.558  -9.709  -0.348
  861   HD22  LEU 109          1HD2      LEU 109 -37.940 -10.501   0.420
  862   HD23  LEU 109          2HD2      LEU 109 -37.526 -10.885  -1.266
  863    H    VAL 110           H        VAL 110 -39.157  -4.933  -3.992
  864    HA   VAL 110           HA       VAL 110 -37.608  -5.134  -6.346
  865    HB   VAL 110           HB       VAL 110 -38.393  -2.790  -6.775
  866   HG11  VAL 110          1HG1      VAL 110 -40.348  -4.998  -6.017
  867   HG12  VAL 110          2HG1      VAL 110 -40.855  -3.510  -6.805
  868   HG13  VAL 110          3HG1      VAL 110 -39.716  -4.579  -7.623
  869   HG21  VAL 110          3HG2      VAL 110 -40.113  -1.897  -5.324
  870   HG22  VAL 110          1HG2      VAL 110 -39.905  -3.185  -4.148
  871   HG23  VAL 110          2HG2      VAL 110 -38.580  -2.028  -4.421
  872    H    ASP 111           H        ASP 111 -35.893  -3.744  -7.175
  873    HA   ASP 111           HA       ASP 111 -33.943  -3.347  -4.911
  874    HB2  ASP 111           2HB      ASP 111 -33.627  -5.331  -6.394
  875    HB3  ASP 111           3HB      ASP 111 -33.301  -4.220  -7.726
  876    H    VAL 112           H        VAL 112 -34.943  -1.171  -4.875
  877    HA   VAL 112           HA       VAL 112 -34.383   0.696  -6.981
  878    HB   VAL 112           HB       VAL 112 -35.298   1.231  -4.124
  879   HG11  VAL 112          1HG1      VAL 112 -36.513   3.107  -5.044
  880   HG12  VAL 112          2HG1      VAL 112 -34.823   3.265  -5.525
  881   HG13  VAL 112          3HG1      VAL 112 -36.038   2.679  -6.695
  882   HG21  VAL 112          3HG2      VAL 112 -37.616   1.021  -5.126
  883   HG22  VAL 112          1HG2      VAL 112 -36.861   0.224  -6.532
  884   HG23  VAL 112          2HG2      VAL 112 -36.756  -0.500  -4.918
  885    H    VAL 113           H        VAL 113 -32.055   0.096  -6.980
  886    HA   VAL 113           HA       VAL 113 -30.428   1.641  -4.992
  887    HB   VAL 113           HB       VAL 113 -30.366  -0.838  -4.835
  888   HG11  VAL 113          1HG1      VAL 113 -29.042  -2.180  -6.295
  889   HG12  VAL 113          2HG1      VAL 113 -30.311  -1.413  -7.257
  890   HG13  VAL 113          3HG1      VAL 113 -28.642  -0.800  -7.331
  891   HG21  VAL 113          3HG2      VAL 113 -27.703   0.517  -5.397
  892   HG22  VAL 113          1HG2      VAL 113 -28.618   0.597  -3.870
  893   HG23  VAL 113          2HG2      VAL 113 -27.966  -0.948  -4.429
  894    HA   PRO 114           HA       PRO 114 -28.995   3.831  -8.596
  895    HB2  PRO 114           2HB      PRO 114 -27.315   5.617  -7.528
  896    HB3  PRO 114           3HB      PRO 114 -29.051   5.687  -7.235
  897    HG2  PRO 114           2HG      PRO 114 -26.905   4.510  -5.449
  898    HG3  PRO 114           3HG      PRO 114 -28.257   5.617  -5.017
  899    HD2  PRO 114           2HD      PRO 114 -28.415   2.904  -4.655
  900    HD3  PRO 114           3HD      PRO 114 -29.828   3.911  -5.096
  901    H    VAL 115           H        VAL 115 -26.743   4.733  -9.494
  902    HA   VAL 115           HA       VAL 115 -24.655   2.618  -9.262
  903    HB   VAL 115           HB       VAL 115 -24.216   2.911 -11.679
  904   HG11  VAL 115          1HG1      VAL 115 -25.987   1.383 -12.398
  905   HG12  VAL 115          2HG1      VAL 115 -25.378   0.941 -10.793
  906   HG13  VAL 115          3HG1      VAL 115 -26.941   1.772 -10.951
  907   HG21  VAL 115          3HG2      VAL 115 -25.877   3.783 -13.164
  908   HG22  VAL 115          1HG2      VAL 115 -26.982   4.141 -11.809
  909   HG23  VAL 115          2HG2      VAL 115 -25.452   5.022 -11.976
  910    H    LYS 116           H        LYS 116 -22.639   3.151  -9.260
  911    HA   LYS 116           HA       LYS 116 -21.842   6.009  -9.103
  912    HB2  LYS 116           2HB      LYS 116 -20.432   5.274  -7.084
  913    HB3  LYS 116           3HB      LYS 116 -22.142   5.558  -6.822
  914    HG2  LYS 116           2HG      LYS 116 -21.178   2.757  -7.349
  915    HG3  LYS 116           3HG      LYS 116 -20.927   3.532  -5.776
  916    HD2  LYS 116           2HD      LYS 116 -23.231   3.757  -5.318
  917    HD3  LYS 116           3HD      LYS 116 -23.709   3.460  -6.987
  918    HE2  LYS 116           2HE      LYS 116 -22.791   1.119  -6.792
  919    HE3  LYS 116           3HE      LYS 116 -22.511   1.422  -5.072
  920    HZ1  LYS 116           HZ1      LYS 116 -24.903   1.802  -4.818
  921    HZ2  LYS 116           HZ2      LYS 116 -25.173   1.557  -6.421
  922    HZ3  LYS 116           HZ3      LYS 116 -24.652   0.328  -5.473
  923    H    ASN 117           H        ASN 117 -19.547   6.309  -8.917
  924    HA   ASN 117           HA       ASN 117 -18.199   4.856 -11.123
  925    HB2  ASN 117           2HB      ASN 117 -16.728   6.819 -11.162
  926    HB3  ASN 117           3HB      ASN 117 -18.410   7.291 -11.199
  927   HD21  ASN 117          2HD2      ASN 117 -17.877   9.418 -10.415
  928   HD22  ASN 117          1HD2      ASN 117 -17.327   9.659  -8.768
  929    H    GLU 118           H        GLU 118 -15.624   4.966 -10.754
  930    HA   GLU 118           HA       GLU 118 -15.002   2.872  -8.931
  931    HB2  GLU 118           2HB      GLU 118 -12.717   3.155  -9.656
  932    HB3  GLU 118           3HB      GLU 118 -13.817   3.253 -11.028
  933    HG2  GLU 118           2HG      GLU 118 -13.624   5.752 -10.980
  934    HG3  GLU 118           3HG      GLU 118 -12.492   5.626  -9.633
  935    H    ASP 119           H        ASP 119 -15.128   6.279  -8.279
  936    HA   ASP 119           HA       ASP 119 -13.515   6.126  -5.823
  937    HB2  ASP 119           2HB      ASP 119 -13.743   8.185  -7.360
  938    HB3  ASP 119           3HB      ASP 119 -15.347   8.388  -6.666
  939    H    GLY 120           H        GLY 120 -16.792   5.457  -6.773
  940    HA2  GLY 120           HA2      GLY 120 -18.418   4.464  -5.421
  941    HA3  GLY 120           HA3      GLY 120 -17.668   5.112  -3.962
  942    H    ALA 121           H        ALA 121 -17.987   7.529  -6.458
  943    HA   ALA 121           HA       ALA 121 -20.238   8.764  -4.973
  944    HB1  ALA 121           3HB      ALA 121 -19.749  10.745  -6.292
  945    HB2  ALA 121           1HB      ALA 121 -18.264  10.137  -5.528
  946    HB3  ALA 121           2HB      ALA 121 -18.563   9.851  -7.255
  947    H    VAL 122           H        VAL 122 -22.277   8.704  -5.608
  948    HA   VAL 122           HA       VAL 122 -23.179   7.162  -7.838
  949    HB   VAL 122           HB       VAL 122 -24.386   7.152  -5.803
  950   HG11  VAL 122          1HG1      VAL 122 -25.665   8.968  -4.912
  951   HG12  VAL 122          2HG1      VAL 122 -23.978   9.469  -4.972
  952   HG13  VAL 122          3HG1      VAL 122 -25.141  10.074  -6.179
  953   HG21  VAL 122          3HG2      VAL 122 -25.571   6.811  -7.913
  954   HG22  VAL 122          1HG2      VAL 122 -26.618   7.516  -6.654
  955   HG23  VAL 122          2HG2      VAL 122 -25.998   8.522  -7.976
  956    H    ILE 123           H        ILE 123 -22.570   7.845  -9.783
  957    HA   ILE 123           HA       ILE 123 -23.024  10.629 -10.553
  958    HB   ILE 123           HB       ILE 123 -21.898  10.322 -12.484
  959   HG12  ILE 123          2HG1      ILE 123 -22.846   8.415 -13.540
  960   HG13  ILE 123          3HG1      ILE 123 -21.105   8.285 -13.517
  961   HG21  ILE 123          1HG2      ILE 123 -20.504  10.243 -10.447
  962   HG22  ILE 123          2HG2      ILE 123 -20.469   8.474 -10.552
  963   HG23  ILE 123          3HG2      ILE 123 -19.748   9.453 -11.847
  964   HD11  ILE 123          3HD1      ILE 123 -21.274   6.627 -11.631
  965   HD12  ILE 123          1HD1      ILE 123 -23.054   6.715 -11.804
  966   HD13  ILE 123          2HD1      ILE 123 -22.067   6.114 -13.129
  967    H    MET 124           H        MET 124 -24.671   7.514 -10.922
  968    HA   MET 124           HA       MET 124 -26.900   9.008 -12.235
  969    HB2  MET 124           2HB      MET 124 -25.509   6.562 -13.362
  970    HB3  MET 124           3HB      MET 124 -27.220   6.868 -13.681
  971    HG2  MET 124           2HG      MET 124 -24.845   8.548 -14.419
  972    HG3  MET 124           3HG      MET 124 -25.897   7.668 -15.504
  973    HE1  MET 124           3HE      MET 124 -24.716  10.800 -14.475
  974    HE2  MET 124           1HE      MET 124 -25.023  10.553 -16.203
  975    HE3  MET 124           2HE      MET 124 -25.830  11.887 -15.340
  976    H    PHE 125           H        PHE 125 -28.849   8.228 -12.011
  977    HA   PHE 125           HA       PHE 125 -29.427   6.377  -9.717
  978    HB2  PHE 125           2HB      PHE 125 -30.764   8.871 -10.739
  979    HB3  PHE 125           3HB      PHE 125 -31.760   7.591 -10.070
  980    HD1  PHE 125           HD1      PHE 125 -28.515   7.950  -8.369
  981    HD2  PHE 125           HD2      PHE 125 -32.600   9.316  -8.581
  982    HE1  PHE 125           HE1      PHE 125 -28.311   8.944  -6.110
  983    HE2  PHE 125           HE2      PHE 125 -32.383  10.291  -6.308
  984    HZ   PHE 125           HZ       PHE 125 -30.238  10.100  -5.067
  985    H    ILE 126           H        ILE 126 -29.077   4.564 -11.045
  986    HA   ILE 126           HA       ILE 126 -31.337   4.018 -12.929
  987    HB   ILE 126           HB       ILE 126 -28.821   2.404 -12.510
  988   HG12  ILE 126          2HG1      ILE 126 -29.722   4.371 -14.675
  989   HG13  ILE 126          3HG1      ILE 126 -28.368   4.583 -13.578
  990   HG21  ILE 126          1HG2      ILE 126 -30.879   2.119 -14.732
  991   HG22  ILE 126          2HG2      ILE 126 -29.586   0.994 -14.279
  992   HG23  ILE 126          3HG2      ILE 126 -31.022   1.180 -13.267
  993   HD11  ILE 126          3HD1      ILE 126 -27.321   2.534 -14.552
  994   HD12  ILE 126          1HD1      ILE 126 -28.596   2.551 -15.795
  995   HD13  ILE 126          2HD1      ILE 126 -27.484   3.934 -15.662
  996    H    LEU 127           H        LEU 127 -32.701   4.228 -11.056
  997    HA   LEU 127           HA       LEU 127 -32.478   2.193  -8.959
  998    HB2  LEU 127           2HB      LEU 127 -34.678   4.268  -9.294
  999    HB3  LEU 127           3HB      LEU 127 -34.298   3.285  -7.890
 1000    HG   LEU 127           HG       LEU 127 -32.657   5.569  -9.023
 1001   HD11  LEU 127          1HD1      LEU 127 -33.543   5.098  -6.151
 1002   HD12  LEU 127          2HD1      LEU 127 -32.669   6.485  -6.782
 1003   HD13  LEU 127          3HD1      LEU 127 -34.359   6.210  -7.288
 1004   HD21  LEU 127          3HD2      LEU 127 -31.883   3.503  -6.958
 1005   HD22  LEU 127          1HD2      LEU 127 -31.080   3.856  -8.510
 1006   HD23  LEU 127          2HD2      LEU 127 -31.037   5.039  -7.195
 1007    H    ASN 128           H        ASN 128 -32.481   0.410 -10.257
 1008    HA   ASN 128           HA       ASN 128 -34.423  -0.531 -11.931
 1009    HB2  ASN 128           2HB      ASN 128 -33.048  -2.381  -9.952
 1010    HB3  ASN 128           3HB      ASN 128 -33.529  -2.727 -11.602
 1011   HD21  ASN 128          2HD2      ASN 128 -31.066  -1.449  -9.517
 1012   HD22  ASN 128          1HD2      ASN 128 -29.925  -1.034 -10.783
 1013    H    PHE 129           H        PHE 129 -36.656  -0.610 -11.608
 1014    HA   PHE 129           HA       PHE 129 -37.656  -1.181  -8.909
 1015    HB2  PHE 129           2HB      PHE 129 -39.178  -0.654 -11.482
 1016    HB3  PHE 129           3HB      PHE 129 -39.790  -0.671  -9.835
 1017    HD1  PHE 129           HD1      PHE 129 -38.057   1.065  -8.287
 1018    HD2  PHE 129           HD2      PHE 129 -39.391   1.487 -12.366
 1019    HE1  PHE 129           HE1      PHE 129 -37.761   3.524  -8.133
 1020    HE2  PHE 129           HE2      PHE 129 -39.117   3.946 -12.197
 1021    HZ   PHE 129           HZ       PHE 129 -38.292   4.968 -10.081
 1022    H    GLU 130           H        GLU 130 -36.287  -3.323  -9.609
 1023    HA   GLU 130           HA       GLU 130 -37.883  -5.148 -11.222
 1024    HB2  GLU 130           2HB      GLU 130 -36.029  -6.751 -10.799
 1025    HB3  GLU 130           3HB      GLU 130 -35.647  -5.229 -11.660
 1026    HG2  GLU 130           2HG      GLU 130 -34.617  -4.263  -9.779
 1027    HG3  GLU 130           3HG      GLU 130 -35.247  -5.484  -8.692
 1028    H    VAL 131           H        VAL 131 -39.531  -5.908 -10.479
 1029    HA   VAL 131           HA       VAL 131 -40.290  -6.886  -7.911
 1030    HB   VAL 131           HB       VAL 131 -41.117  -7.500 -10.729
 1031   HG11  VAL 131          1HG1      VAL 131 -41.620  -9.625  -9.783
 1032   HG12  VAL 131          2HG1      VAL 131 -42.191  -8.909  -8.269
 1033   HG13  VAL 131          3HG1      VAL 131 -43.138  -8.729  -9.762
 1034   HG21  VAL 131          3HG2      VAL 131 -42.646  -6.274  -8.398
 1035   HG22  VAL 131          1HG2      VAL 131 -41.773  -5.349  -9.634
 1036   HG23  VAL 131          2HG2      VAL 131 -43.161  -6.350 -10.093
 1037    H    VAL 132           H        VAL 132 -39.263  -8.337  -6.715
 1038    HA   VAL 132           HA       VAL 132 -38.738 -10.935  -7.945
 1039    HB   VAL 132           HB       VAL 132 -36.574  -9.944  -8.194
 1040   HG11  VAL 132          1HG1      VAL 132 -35.159  -9.292  -6.300
 1041   HG12  VAL 132          2HG1      VAL 132 -36.571  -8.244  -6.450
 1042   HG13  VAL 132          3HG1      VAL 132 -36.528  -9.498  -5.187
 1043   HG21  VAL 132          3HG2      VAL 132 -36.485 -11.958  -5.919
 1044   HG22  VAL 132          1HG2      VAL 132 -36.736 -12.353  -7.638
 1045   HG23  VAL 132          2HG2      VAL 132 -35.217 -11.615  -7.108
 1046    H    MET 133           H        MET 133 -39.035 -12.654  -6.447
 1047    HA   MET 133           HA       MET 133 -39.631 -12.012  -3.626
 1048    HB2  MET 133           2HB      MET 133 -41.643 -13.398  -5.454
 1049    HB3  MET 133           3HB      MET 133 -41.756 -13.282  -3.695
 1050    HG2  MET 133           2HG      MET 133 -41.751 -10.761  -3.929
 1051    HG3  MET 133           3HG      MET 133 -41.839 -10.985  -5.676
 1052    HE1  MET 133           3HE      MET 133 -43.695 -12.654  -2.521
 1053    HE2  MET 133           1HE      MET 133 -43.699 -10.887  -2.307
 1054    HE3  MET 133           2HE      MET 133 -45.219 -11.750  -2.621
 1055    H    GLU 134           H        GLU 134 -39.618 -13.827  -2.242
 1056    HA   GLU 134           HA       GLU 134 -37.736 -15.913  -2.999
 1057    HB2  GLU 134           2HB      GLU 134 -39.357 -15.535  -0.451
 1058    HB3  GLU 134           3HB      GLU 134 -38.046 -16.697  -0.686
 1059    HG2  GLU 134           2HG      GLU 134 -36.496 -14.773  -1.188
 1060    HG3  GLU 134           3HG      GLU 134 -37.794 -13.659  -0.756
 1061    H    LYS 135           H        LYS 135 -38.057 -18.177  -2.878
 1062    HA   LYS 135           HA       LYS 135 -40.552 -19.121  -4.057
 1063    HB2  LYS 135           2HB      LYS 135 -39.415 -21.223  -4.336
 1064    HB3  LYS 135           3HB      LYS 135 -38.402 -19.898  -4.901
 1065    HG2  LYS 135           2HG      LYS 135 -37.078 -20.026  -2.779
 1066    HG3  LYS 135           3HG      LYS 135 -38.096 -21.379  -2.245
 1067    HD2  LYS 135           2HD      LYS 135 -37.376 -22.700  -4.217
 1068    HD3  LYS 135           3HD      LYS 135 -36.353 -21.347  -4.748
 1069    HE2  LYS 135           2HE      LYS 135 -35.072 -21.487  -2.622
 1070    HE3  LYS 135           3HE      LYS 135 -36.093 -22.829  -2.090
 1071    HZ1  LYS 135           HZ1      LYS 135 -35.269 -24.120  -3.988
 1072    HZ2  LYS 135           HZ2      LYS 135 -34.325 -22.879  -4.481
 1073    HZ3  LYS 135           HZ3      LYS 135 -34.018 -23.629  -3.064
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1 -16.093  19.978  -9.435
    2    H2   MET   1           2H       MET   1 -16.398  20.771  -8.034
    3    H3   MET   1           3H       MET   1 -16.869  19.210  -8.218
    4    HA   MET   1           HA       MET   1 -14.073  20.132  -8.174
    5    HB2  MET   1           2HB      MET   1 -15.727  18.773  -6.003
    6    HB3  MET   1           3HB      MET   1 -13.967  18.756  -6.023
    7    HG2  MET   1           2HG      MET   1 -14.618  20.497  -4.574
    8    HG3  MET   1           3HG      MET   1 -13.921  21.233  -6.011
    9    HE1  MET   1           3HE      MET   1 -16.512  23.902  -4.765
   10    HE2  MET   1           1HE      MET   1 -15.517  22.821  -3.764
   11    HE3  MET   1           2HE      MET   1 -14.821  23.586  -5.212
   12    HA   PRO   2           HA       PRO   2 -13.232  16.220 -10.119
   13    HB2  PRO   2           2HB      PRO   2 -10.581  15.890  -9.593
   14    HB3  PRO   2           3HB      PRO   2 -11.190  17.196 -10.653
   15    HG2  PRO   2           2HG      PRO   2 -10.502  17.373  -7.696
   16    HG3  PRO   2           3HG      PRO   2  -9.933  18.435  -9.025
   17    HD2  PRO   2           2HD      PRO   2 -12.052  19.110  -7.465
   18    HD3  PRO   2           3HD      PRO   2 -12.035  19.487  -9.215
   19    H    VAL   3           H        VAL   3 -12.381  14.014  -9.653
   20    HA   VAL   3           HA       VAL   3 -13.316  12.916  -7.136
   21    HB   VAL   3           HB       VAL   3 -12.468  10.776  -7.951
   22   HG11  VAL   3          1HG1      VAL   3 -13.940  12.275 -10.158
   23   HG12  VAL   3          2HG1      VAL   3 -13.950  10.528  -9.847
   24   HG13  VAL   3          3HG1      VAL   3 -14.692  11.635  -8.682
   25   HG21  VAL   3          3HG2      VAL   3 -11.484  10.520 -10.175
   26   HG22  VAL   3          1HG2      VAL   3 -11.422  12.280 -10.390
   27   HG23  VAL   3          2HG2      VAL   3 -10.428  11.492  -9.145
   28    H    ARG   4           H        ARG   4 -12.061  11.636  -5.639
   29    HA   ARG   4           HA       ARG   4  -9.833  13.112  -4.546
   30    HB2  ARG   4           2HB      ARG   4 -11.000  10.371  -3.910
   31    HB3  ARG   4           3HB      ARG   4  -9.739  11.154  -2.953
   32    HG2  ARG   4           2HG      ARG   4 -11.222  12.995  -2.364
   33    HG3  ARG   4           3HG      ARG   4 -12.525  12.320  -3.369
   34    HD2  ARG   4           2HD      ARG   4 -12.593  10.292  -2.017
   35    HD3  ARG   4           3HD      ARG   4 -11.181  10.827  -1.081
   36    HE   ARG   4           HE       ARG   4 -13.370  12.723  -0.929
   37   HH11  ARG   4          1HH2      ARG   4 -12.264   9.683   0.431
   38   HH12  ARG   4          2HH2      ARG   4 -13.091   9.956   1.945
   39   HH21  ARG   4          1HH1      ARG   4 -14.429  12.987   1.018
   40   HH22  ARG   4          2HH1      ARG   4 -14.309  11.764   2.248
   41    H    ARG   5           H        ARG   5  -7.776  12.352  -4.019
   42    HA   ARG   5           HA       ARG   5  -6.561  10.161  -5.654
   43    HB2  ARG   5           2HB      ARG   5  -5.292  12.855  -4.989
   44    HB3  ARG   5           3HB      ARG   5  -4.438  11.468  -5.680
   45    HG2  ARG   5           2HG      ARG   5  -5.944  11.524  -7.663
   46    HG3  ARG   5           3HG      ARG   5  -6.758  12.953  -6.995
   47    HD2  ARG   5           2HD      ARG   5  -4.619  14.194  -7.024
   48    HD3  ARG   5           3HD      ARG   5  -3.802  12.768  -7.702
   49    HE   ARG   5           HE       ARG   5  -6.009  13.397  -9.377
   50   HH11  ARG   5          1HH1      ARG   5  -2.916  14.829  -8.570
   51   HH12  ARG   5          2HH1      ARG   5  -2.786  15.640 -10.107
   52   HH21  ARG   5          1HH2      ARG   5  -5.779  14.457 -11.319
   53   HH22  ARG   5          2HH2      ARG   5  -4.370  15.430 -11.617
   54    H    GLY   6           H        GLY   6  -4.999   8.911  -4.580
   55    HA2  GLY   6           HA2      GLY   6  -4.163   7.753  -2.759
   56    HA3  GLY   6           HA3      GLY   6  -4.286   9.229  -1.795
   57    H    HIS   7           H        HIS   7  -7.087   7.833  -3.392
   58    HA   HIS   7           HA       HIS   7  -8.356   7.148  -0.764
   59    HB2  HIS   7           2HB      HIS   7  -9.268   9.189  -1.627
   60    HB3  HIS   7           3HB      HIS   7  -9.420   8.518  -3.249
   61    HD2  HIS   7           HD2      HIS   7 -11.679   7.409  -3.900
   62    HE1  HIS   7           HE1      HIS   7 -13.591   7.473  -0.099
   63    HE2  HIS   7           HE2      HIS   7 -13.939   7.124  -2.602
   64    H    VAL   8           H        VAL   8  -9.717   5.414  -0.657
   65    HA   VAL   8           HA       VAL   8 -10.106   3.692  -3.058
   66    HB   VAL   8           HB       VAL   8  -9.569   2.586  -0.271
   67   HG11  VAL   8          1HG1      VAL   8 -11.103   1.173  -1.575
   68   HG12  VAL   8          2HG1      VAL   8  -9.999   1.216  -2.969
   69   HG13  VAL   8          3HG1      VAL   8  -9.525   0.401  -1.462
   70   HG21  VAL   8          3HG2      VAL   8  -7.506   1.622  -1.274
   71   HG22  VAL   8          1HG2      VAL   8  -7.808   2.545  -2.764
   72   HG23  VAL   8          2HG2      VAL   8  -7.454   3.384  -1.237
   73    H    ALA   9           H        ALA   9 -12.198   3.732  -3.494
   74    HA   ALA   9           HA       ALA   9 -14.244   4.661  -1.716
   75    HB1  ALA   9           3HB      ALA   9 -14.335   3.055  -4.310
   76    HB2  ALA   9           1HB      ALA   9 -15.736   3.852  -3.574
   77    HB3  ALA   9           2HB      ALA   9 -14.375   4.824  -4.162
   78    HA   PRO  10           HA       PRO  10 -15.366   0.929   0.548
   79    HB2  PRO  10           2HB      PRO  10 -18.144   0.784   0.228
   80    HB3  PRO  10           3HB      PRO  10 -17.264   1.758   1.429
   81    HG2  PRO  10           2HG      PRO  10 -18.335   2.634  -1.272
   82    HG3  PRO  10           3HG      PRO  10 -18.438   3.497   0.294
   83    HD2  PRO  10           2HD      PRO  10 -16.599   4.168  -1.553
   84    HD3  PRO  10           3HD      PRO  10 -16.149   4.129   0.175
   85    H    GLN  11           H        GLN  11 -14.539  -0.799  -0.386
   86    HA   GLN  11           HA       GLN  11 -14.806  -1.431  -3.081
   87    HB2  GLN  11           2HB      GLN  11 -13.366  -3.240  -2.699
   88    HB3  GLN  11           3HB      GLN  11 -12.872  -1.928  -1.645
   89    HG2  GLN  11           2HG      GLN  11 -14.372  -4.460  -0.846
   90    HG3  GLN  11           3HG      GLN  11 -12.682  -4.079  -0.531
   91   HE21  GLN  11          2HE2      GLN  11 -15.272  -4.549   1.229
   92   HE22  GLN  11          1HE2      GLN  11 -15.073  -3.262   2.420
   93    H    ASN  12           H        ASN  12 -16.851  -2.559  -0.478
   94    HA   ASN  12           HA       ASN  12 -17.829  -4.957  -1.784
   95    HB2  ASN  12           2HB      ASN  12 -18.787  -3.239   0.558
   96    HB3  ASN  12           3HB      ASN  12 -19.735  -4.587  -0.059
   97   HD21  ASN  12          2HD2      ASN  12 -19.343  -5.172   2.329
   98   HD22  ASN  12          1HD2      ASN  12 -17.942  -6.198   2.602
   99    H    THR  13           H        THR  13 -19.179  -1.658  -1.461
  100    HA   THR  13           HA       THR  13 -21.420  -2.206  -3.233
  101    HB   THR  13           HB       THR  13 -21.331  -0.649  -1.245
  102    HG1  THR  13           HG1      THR  13 -22.968   0.453  -2.111
  103   HG21  THR  13          1HG2      THR  13 -20.723   1.654  -1.610
  104   HG22  THR  13          2HG2      THR  13 -19.332   0.611  -1.979
  105   HG23  THR  13          3HG2      THR  13 -20.265   1.314  -3.302
  106    H    PHE  14           H        PHE  14 -18.262  -0.624  -3.561
  107    HA   PHE  14           HA       PHE  14 -18.405   0.362  -6.223
  108    HB2  PHE  14           2HB      PHE  14 -16.589   0.702  -4.590
  109    HB3  PHE  14           3HB      PHE  14 -16.195  -1.001  -4.649
  110    HD1  PHE  14           HD2      PHE  14 -15.252  -2.008  -6.792
  111    HD2  PHE  14           HD1      PHE  14 -15.568   2.245  -6.126
  112    HE1  PHE  14           HE2      PHE  14 -13.509  -1.611  -8.508
  113    HE2  PHE  14           HE1      PHE  14 -13.741   2.620  -7.770
  114    HZ   PHE  14           HZ       PHE  14 -12.744   0.706  -8.993
  115    H    LEU  15           H        LEU  15 -17.673  -2.911  -4.935
  116    HA   LEU  15           HA       LEU  15 -17.499  -4.080  -7.586
  117    HB2  LEU  15           2HB      LEU  15 -16.271  -5.084  -5.769
  118    HB3  LEU  15           3HB      LEU  15 -17.757  -5.359  -4.848
  119    HG   LEU  15           HG       LEU  15 -18.566  -6.937  -6.515
  120   HD11  LEU  15          1HD1      LEU  15 -17.149  -7.744  -8.368
  121   HD12  LEU  15          2HD1      LEU  15 -17.522  -6.042  -8.583
  122   HD13  LEU  15          3HD1      LEU  15 -15.923  -6.503  -7.985
  123   HD21  LEU  15          3HD2      LEU  15 -17.157  -7.763  -4.674
  124   HD22  LEU  15          1HD2      LEU  15 -16.943  -8.741  -6.136
  125   HD23  LEU  15          2HD2      LEU  15 -15.705  -7.548  -5.677
  126    H    ASP  16           H        ASP  16 -20.133  -4.134  -5.124
  127    HA   ASP  16           HA       ASP  16 -22.143  -5.541  -6.395
  128    HB2  ASP  16           2HB      ASP  16 -22.314  -4.429  -4.187
  129    HB3  ASP  16           3HB      ASP  16 -22.396  -2.867  -4.986
  130    H    THR  17           H        THR  17 -21.154  -2.228  -7.123
  131    HA   THR  17           HA       THR  17 -23.180  -1.676  -9.119
  132    HB   THR  17           HB       THR  17 -20.354  -0.538  -8.998
  133    HG1  THR  17           HG1      THR  17 -21.278  -0.098  -7.106
  134   HG21  THR  17          1HG2      THR  17 -21.376   1.427 -10.090
  135   HG22  THR  17          2HG2      THR  17 -21.475  -0.017 -11.114
  136   HG23  THR  17          3HG2      THR  17 -22.917   0.544 -10.230
  137    H    ILE  18           H        ILE  18 -19.933  -3.122  -9.371
  138    HA   ILE  18           HA       ILE  18 -20.051  -3.472 -12.249
  139    HB   ILE  18           HB       ILE  18 -18.341  -4.933 -10.219
  140   HG12  ILE  18          2HG1      ILE  18 -17.934  -2.554  -9.956
  141   HG13  ILE  18          3HG1      ILE  18 -16.545  -3.417 -10.560
  142   HG21  ILE  18          1HG2      ILE  18 -18.017  -4.606 -13.220
  143   HG22  ILE  18          2HG2      ILE  18 -16.739  -5.214 -12.142
  144   HG23  ILE  18          3HG2      ILE  18 -18.248  -6.105 -12.304
  145   HD11  ILE  18          3HD1      ILE  18 -16.992  -2.503 -12.847
  146   HD12  ILE  18          1HD1      ILE  18 -18.472  -1.718 -12.244
  147   HD13  ILE  18          2HD1      ILE  18 -16.882  -1.195 -11.657
  148    H    ILE  19           H        ILE  19 -20.864  -5.502  -9.413
  149    HA   ILE  19           HA       ILE  19 -21.480  -7.875 -10.775
  150    HB   ILE  19           HB       ILE  19 -22.996  -6.678  -8.407
  151   HG12  ILE  19          2HG1      ILE  19 -20.797  -6.997  -7.599
  152   HG13  ILE  19          3HG1      ILE  19 -21.709  -8.373  -7.043
  153   HG21  ILE  19          1HG2      ILE  19 -23.012  -9.488  -9.555
  154   HG22  ILE  19          2HG2      ILE  19 -23.689  -9.043  -7.970
  155   HG23  ILE  19          3HG2      ILE  19 -24.376  -8.357  -9.437
  156   HD11  ILE  19          3HD1      ILE  19 -20.765  -9.666  -9.042
  157   HD12  ILE  19          1HD1      ILE  19 -19.702  -8.259  -9.312
  158   HD13  ILE  19          2HD1      ILE  19 -19.584  -9.150  -7.788
  159    H    ARG  20           H        ARG  20 -23.686  -5.141 -10.058
  160    HA   ARG  20           HA       ARG  20 -25.840  -6.115 -11.737
  161    HB2  ARG  20           2HB      ARG  20 -25.177  -3.394 -10.601
  162    HB3  ARG  20           3HB      ARG  20 -26.633  -3.713 -11.563
  163    HG2  ARG  20           2HG      ARG  20 -27.391  -5.436 -10.024
  164    HG3  ARG  20           3HG      ARG  20 -25.919  -5.306  -9.051
  165    HD2  ARG  20           2HD      ARG  20 -27.952  -3.090  -9.492
  166    HD3  ARG  20           3HD      ARG  20 -27.855  -4.127  -8.064
  167    HE   ARG  20           HE       ARG  20 -25.481  -3.275  -7.774
  168   HH11  ARG  20          2HH1      ARG  20 -27.653  -1.145  -9.559
  169   HH12  ARG  20          1HH1      ARG  20 -26.944   0.260  -8.790
  170   HH21  ARG  20          2HH2      ARG  20 -24.942  -1.516  -6.718
  171   HH22  ARG  20          1HH2      ARG  20 -25.427   0.091  -7.340
  172    H    LYS  21           H        LYS  21 -22.970  -4.305 -12.491
  173    HA   LYS  21           HA       LYS  21 -23.726  -3.527 -15.176
  174    HB2  LYS  21           2HB      LYS  21 -21.547  -2.922 -13.800
  175    HB3  LYS  21           3HB      LYS  21 -20.910  -4.394 -14.563
  176    HG2  LYS  21           2HG      LYS  21 -20.203  -2.655 -15.933
  177    HG3  LYS  21           3HG      LYS  21 -21.550  -3.393 -16.806
  178    HD2  LYS  21           2HD      LYS  21 -23.045  -1.548 -15.993
  179    HD3  LYS  21           3HD      LYS  21 -21.665  -0.846 -15.115
  180    HE2  LYS  21           2HE      LYS  21 -20.433  -0.611 -17.265
  181    HE3  LYS  21           3HE      LYS  21 -21.808  -1.304 -18.133
  182    HZ1  LYS  21           HZ1      LYS  21 -23.148   0.596 -17.392
  183    HZ2  LYS  21           HZ2      LYS  21 -21.876   1.236 -16.586
  184    HZ3  LYS  21           HZ3      LYS  21 -21.841   1.122 -18.211
  185    H    PHE  22           H        PHE  22 -22.178  -6.587 -14.025
  186    HA   PHE  22           HA       PHE  22 -22.753  -7.720 -16.730
  187    HB2  PHE  22           2HB      PHE  22 -21.128  -9.370 -16.365
  188    HB3  PHE  22           3HB      PHE  22 -20.447  -7.813 -15.970
  189    HD1  PHE  22           HD1      PHE  22 -21.808 -10.980 -14.472
  190    HD2  PHE  22           HD2      PHE  22 -19.413  -7.453 -13.854
  191    HE1  PHE  22           HE1      PHE  22 -20.999 -11.909 -12.325
  192    HE2  PHE  22           HE2      PHE  22 -18.587  -8.399 -11.706
  193    HZ   PHE  22           HZ       PHE  22 -19.382 -10.625 -10.939
  194    H    GLU  23           H        GLU  23 -24.335  -7.753 -13.831
  195    HA   GLU  23           HA       GLU  23 -24.905 -10.243 -13.061
  196    HB2  GLU  23           2HB      GLU  23 -25.601  -8.239 -11.907
  197    HB3  GLU  23           3HB      GLU  23 -26.782  -7.858 -13.161
  198    HG2  GLU  23           2HG      GLU  23 -28.145  -9.771 -12.457
  199    HG3  GLU  23           3HG      GLU  23 -26.867 -10.304 -11.347
  200    H    GLY  24           H        GLY  24 -26.398  -8.726 -15.880
  201    HA2  GLY  24           HA2      GLY  24 -27.825  -9.861 -17.532
  202    HA3  GLY  24           HA3      GLY  24 -28.408 -10.946 -16.260
  203    H    GLN  25           H        GLN  25 -28.103  -7.444 -16.869
  204    HA   GLN  25           HA       GLN  25 -30.168  -6.737 -14.953
  205    HB2  GLN  25           2HB      GLN  25 -29.310  -4.467 -15.280
  206    HB3  GLN  25           3HB      GLN  25 -28.040  -5.608 -14.838
  207    HG2  GLN  25           2HG      GLN  25 -27.024  -5.513 -16.960
  208    HG3  GLN  25           3HG      GLN  25 -28.498  -4.962 -17.764
  209   HE21  GLN  25          1HE2      GLN  25 -26.256  -3.798 -15.159
  210   HE22  GLN  25          2HE2      GLN  25 -26.295  -2.124 -15.731
  211    H    SER  26           H        SER  26 -30.316  -7.573 -18.052
  212    HA   SER  26           HA       SER  26 -31.895  -5.724 -19.436
  213    HB2  SER  26           2HB      SER  26 -32.170  -8.750 -19.544
  214    HB3  SER  26           3HB      SER  26 -32.578  -7.590 -20.823
  215    HG   SER  26           HG       SER  26 -30.523  -8.551 -21.166
  216    H    ARG  27           H        ARG  27 -32.774  -7.079 -16.541
  217    HA   ARG  27           HA       ARG  27 -35.711  -7.124 -16.981
  218    HB2  ARG  27           2HB      ARG  27 -35.928  -7.307 -14.519
  219    HB3  ARG  27           3HB      ARG  27 -35.089  -8.600 -15.336
  220    HG2  ARG  27           2HG      ARG  27 -34.115  -8.092 -13.190
  221    HG3  ARG  27           3HG      ARG  27 -32.934  -7.868 -14.494
  222    HD2  ARG  27           2HD      ARG  27 -33.029  -5.491 -14.314
  223    HD3  ARG  27           3HD      ARG  27 -34.545  -5.541 -13.408
  224    HE   ARG  27           HE       ARG  27 -33.339  -6.612 -11.518
  225   HH11  ARG  27          1HH1      ARG  27 -31.148  -4.680 -13.442
  226   HH12  ARG  27          2HH1      ARG  27 -29.776  -5.364 -12.588
  227   HH21  ARG  27          2HH2      ARG  27 -31.734  -7.161 -10.453
  228   HH22  ARG  27          1HH2      ARG  27 -30.078  -6.785 -10.949
  229    H    LYS  28           H        LYS  28 -37.075  -5.715 -15.370
  230    HA   LYS  28           HA       LYS  28 -37.153  -3.192 -16.595
  231    HB2  LYS  28           2HB      LYS  28 -39.000  -2.772 -14.972
  232    HB3  LYS  28           3HB      LYS  28 -39.096  -4.323 -15.803
  233    HG2  LYS  28           2HG      LYS  28 -37.831  -5.125 -13.542
  234    HG3  LYS  28           3HG      LYS  28 -38.594  -3.683 -12.928
  235    HD2  LYS  28           2HD      LYS  28 -40.034  -5.557 -12.475
  236    HD3  LYS  28           3HD      LYS  28 -40.774  -4.572 -13.722
  237    HE2  LYS  28           2HE      LYS  28 -41.212  -6.660 -14.533
  238    HE3  LYS  28           3HE      LYS  28 -39.757  -6.252 -15.427
  239    HZ1  LYS  28           HZ1      LYS  28 -39.614  -8.485 -14.527
  240    HZ2  LYS  28           HZ2      LYS  28 -38.505  -7.594 -13.730
  241    HZ3  LYS  28           HZ3      LYS  28 -39.922  -7.992 -13.012
  242    H    PHE  29           H        PHE  29 -36.656  -1.144 -16.118
  243    HA   PHE  29           HA       PHE  29 -35.671  -0.152 -13.612
  244    HB2  PHE  29           2HB      PHE  29 -33.336   0.235 -14.181
  245    HB3  PHE  29           3HB      PHE  29 -33.691  -1.464 -14.241
  246    HD1  PHE  29           HD1      PHE  29 -33.358   1.511 -16.590
  247    HD2  PHE  29           HD2      PHE  29 -32.799  -2.716 -15.964
  248    HE1  PHE  29           HE1      PHE  29 -32.327   1.313 -18.826
  249    HE2  PHE  29           HE2      PHE  29 -31.737  -2.901 -18.189
  250    HZ   PHE  29           HZ       PHE  29 -31.494  -0.887 -19.631
  251    H    ILE  30           H        ILE  30 -34.718   2.018 -13.732
  252    HA   ILE  30           HA       ILE  30 -35.379   3.553 -16.197
  253    HB   ILE  30           HB       ILE  30 -35.637   5.559 -14.591
  254   HG12  ILE  30          2HG1      ILE  30 -36.689   5.152 -12.448
  255   HG13  ILE  30          3HG1      ILE  30 -36.447   3.410 -12.594
  256   HG21  ILE  30          1HG2      ILE  30 -38.030   5.186 -14.548
  257   HG22  ILE  30          2HG2      ILE  30 -37.291   4.640 -16.073
  258   HG23  ILE  30          3HG2      ILE  30 -37.772   3.447 -14.838
  259   HD11  ILE  30          3HD1      ILE  30 -34.179   5.454 -12.509
  260   HD12  ILE  30          1HD1      ILE  30 -34.791   4.577 -11.102
  261   HD13  ILE  30          2HD1      ILE  30 -34.022   3.681 -12.414
  262    H    ILE  31           H        ILE  31 -34.182   5.590 -16.315
  263    HA   ILE  31           HA       ILE  31 -31.484   5.492 -15.074
  264    HB   ILE  31           HB       ILE  31 -32.046   6.654 -17.809
  265   HG12  ILE  31          2HG1      ILE  31 -32.574   4.214 -17.940
  266   HG13  ILE  31          3HG1      ILE  31 -31.207   4.720 -18.950
  267   HG21  ILE  31          1HG2      ILE  31 -30.100   7.509 -16.645
  268   HG22  ILE  31          2HG2      ILE  31 -29.519   5.882 -16.297
  269   HG23  ILE  31          3HG2      ILE  31 -29.553   6.478 -17.977
  270   HD11  ILE  31          3HD1      ILE  31 -30.809   2.575 -17.675
  271   HD12  ILE  31          1HD1      ILE  31 -29.586   3.830 -17.444
  272   HD13  ILE  31          2HD1      ILE  31 -30.812   3.565 -16.193
  273    H    ALA  32           H        ALA  32 -31.380   7.075 -13.737
  274    HA   ALA  32           HA       ALA  32 -32.602   9.692 -14.493
  275    HB1  ALA  32           3HB      ALA  32 -33.126  10.036 -12.042
  276    HB2  ALA  32           1HB      ALA  32 -34.086   8.776 -12.857
  277    HB3  ALA  32           2HB      ALA  32 -32.751   8.326 -11.793
  278    H    ASN  33           H        ASN  33 -31.686  11.611 -13.814
  279    HA   ASN  33           HA       ASN  33 -28.750  11.390 -13.404
  280    HB2  ASN  33           2HB      ASN  33 -28.781  13.883 -13.646
  281    HB3  ASN  33           3HB      ASN  33 -29.245  12.963 -15.056
  282   HD21  ASN  33          2HD2      ASN  33 -29.876  15.337 -15.492
  283   HD22  ASN  33          1HD2      ASN  33 -31.571  15.665 -15.170
  284    H    ALA  34           H        ALA  34 -28.172  10.868 -11.397
  285    HA   ALA  34           HA       ALA  34 -29.582  11.736  -9.037
  286    HB1  ALA  34           3HB      ALA  34 -26.841  10.444  -9.343
  287    HB2  ALA  34           1HB      ALA  34 -27.821  10.500  -7.868
  288    HB3  ALA  34           2HB      ALA  34 -28.384   9.564  -9.262
  289    H    ARG  35           H        ARG  35 -27.484  13.447 -10.957
  290    HA   ARG  35           HA       ARG  35 -26.320  15.103  -8.765
  291    HB2  ARG  35           2HB      ARG  35 -25.662  15.064 -11.733
  292    HB3  ARG  35           3HB      ARG  35 -24.791  15.946 -10.486
  293    HG2  ARG  35           2HG      ARG  35 -24.959  12.921 -10.794
  294    HG3  ARG  35           3HG      ARG  35 -23.572  13.943 -11.113
  295    HD2  ARG  35           2HD      ARG  35 -24.834  13.399  -8.392
  296    HD3  ARG  35           3HD      ARG  35 -23.321  12.739  -8.976
  297    HE   ARG  35           HE       ARG  35 -23.790  15.408  -7.880
  298   HH11  ARG  35          1HH1      ARG  35 -21.519  13.579  -9.834
  299   HH12  ARG  35          2HH1      ARG  35 -20.215  14.683  -9.497
  300   HH21  ARG  35          1HH2      ARG  35 -22.089  16.770  -7.514
  301   HH22  ARG  35          2HH2      ARG  35 -20.535  16.435  -8.217
  302    H    VAL  36           H        VAL  36 -29.145  15.244 -10.354
  303    HA   VAL  36           HA       VAL  36 -29.169  18.224 -10.516
  304    HB   VAL  36           HB       VAL  36 -29.743  16.681 -12.571
  305   HG11  VAL  36          1HG1      VAL  36 -32.119  16.292 -12.896
  306   HG12  VAL  36          2HG1      VAL  36 -31.549  15.378 -11.483
  307   HG13  VAL  36          3HG1      VAL  36 -32.492  16.877 -11.287
  308   HG21  VAL  36          3HG2      VAL  36 -31.435  19.096 -11.884
  309   HG22  VAL  36          1HG2      VAL  36 -29.790  19.111 -12.576
  310   HG23  VAL  36          2HG2      VAL  36 -31.122  18.407 -13.500
  311    H    GLU  37           H        GLU  37 -30.666  19.375  -9.301
  312    HA   GLU  37           HA       GLU  37 -31.421  18.337  -6.817
  313    HB2  GLU  37           2HB      GLU  37 -31.120  20.725  -7.473
  314    HB3  GLU  37           3HB      GLU  37 -32.679  20.681  -8.304
  315    HG2  GLU  37           2HG      GLU  37 -33.830  20.244  -6.168
  316    HG3  GLU  37           3HG      GLU  37 -32.278  20.126  -5.330
  317    H    ASN  38           H        ASN  38 -33.341  18.270  -9.789
  318    HA   ASN  38           HA       ASN  38 -35.781  17.375  -8.450
  319    HB2  ASN  38           2HB      ASN  38 -35.619  18.879 -10.512
  320    HB3  ASN  38           3HB      ASN  38 -35.143  17.444 -11.424
  321   HD21  ASN  38          2HD2      ASN  38 -37.003  17.427 -12.765
  322   HD22  ASN  38          1HD2      ASN  38 -38.609  17.145 -12.115
  323    H    CYS  39           H        CYS  39 -32.967  15.698  -9.408
  324    HA   CYS  39           HA       CYS  39 -32.458  13.563 -10.061
  325    HB2  CYS  39           2HB      CYS  39 -34.345  13.199  -7.718
  326    HB3  CYS  39           3HB      CYS  39 -33.350  11.889  -8.378
  327    HG   CYS  39           HG       CYS  39 -32.084  14.863  -7.653
  328    H    ALA  40           H        ALA  40 -33.695  14.064 -12.189
  329    HA   ALA  40           HA       ALA  40 -36.244  12.595 -12.377
  330    HB1  ALA  40           3HB      ALA  40 -36.228  14.969 -12.934
  331    HB2  ALA  40           1HB      ALA  40 -35.047  14.666 -14.236
  332    HB3  ALA  40           2HB      ALA  40 -36.684  13.973 -14.318
  333    H    VAL  41           H        VAL  41 -36.870  11.427 -14.185
  334    HA   VAL  41           HA       VAL  41 -35.026   9.368 -15.003
  335    HB   VAL  41           HB       VAL  41 -37.978   9.830 -15.602
  336   HG11  VAL  41          1HG1      VAL  41 -36.256   7.342 -15.977
  337   HG12  VAL  41          2HG1      VAL  41 -38.024   7.402 -16.147
  338   HG13  VAL  41          3HG1      VAL  41 -37.004   8.289 -17.278
  339   HG21  VAL  41          3HG2      VAL  41 -38.379   8.109 -13.904
  340   HG22  VAL  41          1HG2      VAL  41 -36.632   7.985 -13.575
  341   HG23  VAL  41          2HG2      VAL  41 -37.527   9.470 -13.188
  342    H    ILE  42           H        ILE  42 -33.565  10.345 -16.312
  343    HA   ILE  42           HA       ILE  42 -34.213  11.854 -18.708
  344    HB   ILE  42           HB       ILE  42 -31.820  11.618 -19.211
  345   HG12  ILE  42          2HG1      ILE  42 -31.625   9.928 -16.673
  346   HG13  ILE  42          3HG1      ILE  42 -31.488   9.295 -18.318
  347   HG21  ILE  42          1HG2      ILE  42 -32.239  12.321 -16.272
  348   HG22  ILE  42          2HG2      ILE  42 -31.017  12.978 -17.378
  349   HG23  ILE  42          3HG2      ILE  42 -32.721  13.367 -17.627
  350   HD11  ILE  42          3HD1      ILE  42 -29.513  10.777 -18.670
  351   HD12  ILE  42          1HD1      ILE  42 -29.593  11.202 -16.933
  352   HD13  ILE  42          2HD1      ILE  42 -29.309   9.526 -17.429
  353    H    TYR  43           H        TYR  43 -33.968   8.461 -17.946
  354    HA   TYR  43           HA       TYR  43 -34.969   7.751 -20.590
  355    HB2  TYR  43           2HB      TYR  43 -32.372   7.897 -20.839
  356    HB3  TYR  43           3HB      TYR  43 -32.338   6.425 -19.916
  357    HD1  TYR  43           HD2      TYR  43 -33.896   7.959 -22.955
  358    HD2  TYR  43           HD1      TYR  43 -32.627   4.322 -21.002
  359    HE1  TYR  43           HE2      TYR  43 -34.391   6.670 -25.028
  360    HE2  TYR  43           HE1      TYR  43 -33.126   3.038 -23.077
  361    HH   TYR  43           HH       TYR  43 -34.389   4.614 -26.040
  362    H    CYS  44           H        CYS  44 -35.489   5.421 -20.841
  363    HA   CYS  44           HA       CYS  44 -36.038   4.091 -18.256
  364    HB2  CYS  44           2HB      CYS  44 -38.485   4.014 -18.954
  365    HB3  CYS  44           3HB      CYS  44 -37.866   5.607 -18.465
  366    HG   CYS  44           HG       CYS  44 -39.501   5.952 -20.486
  367    H    ASN  45           H        ASN  45 -36.502   1.878 -18.340
  368    HA   ASN  45           HA       ASN  45 -36.041   0.541 -20.936
  369    HB2  ASN  45           2HB      ASN  45 -35.016  -0.196 -18.740
  370    HB3  ASN  45           3HB      ASN  45 -36.605  -0.793 -18.271
  371   HD21  ASN  45          2HD2      ASN  45 -33.962  -1.091 -20.686
  372   HD22  ASN  45          1HD2      ASN  45 -34.408  -2.721 -21.166
  373    H    ASP  46           H        ASP  46 -37.451  -0.944 -21.846
  374    HA   ASP  46           HA       ASP  46 -40.288  -0.320 -21.847
  375    HB2  ASP  46           2HB      ASP  46 -38.734  -2.734 -22.882
  376    HB3  ASP  46           3HB      ASP  46 -40.460  -2.480 -23.137
  377    H    GLY  47           H        GLY  47 -38.315  -2.774 -20.142
  378    HA2  GLY  47           HA2      GLY  47 -40.307  -4.371 -18.994
  379    HA3  GLY  47           HA3      GLY  47 -38.758  -3.969 -18.243
  380    H    PHE  48           H        PHE  48 -39.031  -1.219 -17.683
  381    HA   PHE  48           HA       PHE  48 -40.769  -1.393 -15.364
  382    HB2  PHE  48           2HB      PHE  48 -39.251  -0.005 -14.618
  383    HB3  PHE  48           3HB      PHE  48 -38.619   0.302 -16.214
  384    HD1  PHE  48           HD1      PHE  48 -39.311   2.301 -17.536
  385    HD2  PHE  48           HD2      PHE  48 -40.855   1.539 -13.579
  386    HE1  PHE  48           HE1      PHE  48 -40.091   4.637 -17.362
  387    HE2  PHE  48           HE2      PHE  48 -41.648   3.875 -13.432
  388    HZ   PHE  48           HZ       PHE  48 -41.263   5.439 -15.327
  389    H    CYS  49           H        CYS  49 -41.056  -0.120 -18.616
  390    HA   CYS  49           HA       CYS  49 -43.404   1.520 -18.271
  391    HB2  CYS  49           2HB      CYS  49 -41.797   1.552 -20.230
  392    HB3  CYS  49           3HB      CYS  49 -42.540   0.033 -20.780
  393    HG   CYS  49           HG       CYS  49 -45.016   0.934 -20.784
  394    H    GLU  50           H        GLU  50 -42.887  -1.969 -18.914
  395    HA   GLU  50           HA       GLU  50 -45.763  -2.578 -18.990
  396    HB2  GLU  50           2HB      GLU  50 -43.359  -4.415 -18.693
  397    HB3  GLU  50           3HB      GLU  50 -45.020  -4.915 -19.016
  398    HG2  GLU  50           2HG      GLU  50 -45.003  -3.600 -21.140
  399    HG3  GLU  50           3HG      GLU  50 -43.311  -3.205 -20.870
  400    H    LEU  51           H        LEU  51 -43.200  -2.625 -16.549
  401    HA   LEU  51           HA       LEU  51 -44.487  -3.913 -14.421
  402    HB2  LEU  51           2HB      LEU  51 -42.119  -3.098 -14.440
  403    HB3  LEU  51           3HB      LEU  51 -42.697  -1.463 -14.398
  404    HG   LEU  51           HG       LEU  51 -43.680  -1.614 -12.259
  405   HD11  LEU  51          1HD1      LEU  51 -43.263  -3.497 -10.759
  406   HD12  LEU  51          2HD1      LEU  51 -44.260  -3.999 -12.123
  407   HD13  LEU  51          3HD1      LEU  51 -42.532  -4.430 -12.086
  408   HD21  LEU  51          3HD2      LEU  51 -41.599  -1.750 -10.955
  409   HD22  LEU  51          1HD2      LEU  51 -40.784  -2.544 -12.318
  410   HD23  LEU  51          2HD2      LEU  51 -41.364  -0.868 -12.471
  411    H    CYS  52           H        CYS  52 -44.563  -0.388 -15.222
  412    HA   CYS  52           HA       CYS  52 -46.782   0.066 -13.363
  413    HB2  CYS  52           2HB      CYS  52 -45.622   1.904 -15.505
  414    HB3  CYS  52           3HB      CYS  52 -46.657   2.358 -14.143
  415    HG   CYS  52           HG       CYS  52 -43.567   1.181 -14.198
  416    H    GLY  53           H        GLY  53 -46.463  -0.607 -16.776
  417    HA2  GLY  53           HA2      GLY  53 -48.053  -1.231 -18.353
  418    HA3  GLY  53           HA3      GLY  53 -49.359  -0.922 -17.207
  419    H    TYR  54           H        TYR  54 -46.870   1.488 -17.994
  420    HA   TYR  54           HA       TYR  54 -49.017   3.353 -18.905
  421    HB2  TYR  54           2HB      TYR  54 -46.199   3.912 -17.948
  422    HB3  TYR  54           3HB      TYR  54 -47.421   5.117 -18.342
  423    HD1  TYR  54           HD1      TYR  54 -49.615   3.146 -16.737
  424    HD2  TYR  54           HD2      TYR  54 -45.949   5.268 -15.888
  425    HE1  TYR  54           HE1      TYR  54 -50.274   3.336 -14.361
  426    HE2  TYR  54           HE2      TYR  54 -46.635   5.477 -13.502
  427    HH   TYR  54           HH       TYR  54 -49.717   4.121 -12.279
  428    H    SER  55           H        SER  55 -46.391   4.853 -19.961
  429    HA   SER  55           HA       SER  55 -45.698   3.496 -22.435
  430    HB2  SER  55           2HB      SER  55 -47.847   4.433 -23.141
  431    HB3  SER  55           3HB      SER  55 -47.375   6.033 -22.541
  432    HG   SER  55           HG       SER  55 -47.027   5.719 -24.834
  433    H    ARG  56           H        ARG  56 -43.732   4.357 -23.184
  434    HA   ARG  56           HA       ARG  56 -42.189   5.744 -21.194
  435    HB2  ARG  56           2HB      ARG  56 -41.522   4.958 -24.057
  436    HB3  ARG  56           3HB      ARG  56 -40.369   5.719 -22.951
  437    HG2  ARG  56           2HG      ARG  56 -40.827   3.869 -21.291
  438    HG3  ARG  56           3HG      ARG  56 -41.774   3.039 -22.523
  439    HD2  ARG  56           2HD      ARG  56 -38.869   3.841 -22.999
  440    HD3  ARG  56           3HD      ARG  56 -39.301   2.373 -22.137
  441    HE   ARG  56           HE       ARG  56 -40.119   1.374 -24.077
  442   HH11  ARG  56          2HH1      ARG  56 -39.065   4.614 -24.968
  443   HH12  ARG  56          1HH1      ARG  56 -39.028   4.182 -26.656
  444   HH21  ARG  56          2HH2      ARG  56 -39.961   0.904 -26.041
  445   HH22  ARG  56          1HH2      ARG  56 -39.555   2.084 -27.291
  446    H    ALA  57           H        ALA  57 -43.803   7.005 -24.031
  447    HA   ALA  57           HA       ALA  57 -42.632   9.615 -24.083
  448    HB1  ALA  57           3HB      ALA  57 -44.017   8.656 -25.893
  449    HB2  ALA  57           1HB      ALA  57 -45.442   8.680 -24.826
  450    HB3  ALA  57           2HB      ALA  57 -44.680  10.203 -25.332
  451    H    GLU  58           H        GLU  58 -44.653   8.165 -21.688
  452    HA   GLU  58           HA       GLU  58 -45.673  10.710 -20.591
  453    HB2  GLU  58           2HB      GLU  58 -46.170   7.868 -19.647
  454    HB3  GLU  58           3HB      GLU  58 -47.037   9.305 -19.184
  455    HG2  GLU  58           2HG      GLU  58 -47.048   8.250 -22.051
  456    HG3  GLU  58           3HG      GLU  58 -48.176   7.722 -20.833
  457    H    VAL  59           H        VAL  59 -43.009   8.441 -20.113
  458    HA   VAL  59           HA       VAL  59 -42.836   9.105 -17.224
  459    HB   VAL  59           HB       VAL  59 -41.281   7.462 -16.907
  460   HG11  VAL  59          1HG1      VAL  59 -43.593   6.664 -17.371
  461   HG12  VAL  59          2HG1      VAL  59 -43.117   6.333 -19.051
  462   HG13  VAL  59          3HG1      VAL  59 -42.356   5.451 -17.725
  463   HG21  VAL  59          3HG2      VAL  59 -39.611   7.692 -18.529
  464   HG22  VAL  59          1HG2      VAL  59 -40.327   6.105 -18.851
  465   HG23  VAL  59          2HG2      VAL  59 -40.741   7.474 -19.871
  466    H    MET  60           H        MET  60 -41.526  10.221 -20.168
  467    HA   MET  60           HA       MET  60 -38.921  10.881 -19.708
  468    HB2  MET  60           2HB      MET  60 -41.096  12.440 -21.174
  469    HB3  MET  60           3HB      MET  60 -39.412  12.941 -21.180
  470    HG2  MET  60           2HG      MET  60 -40.471  10.335 -22.281
  471    HG3  MET  60           3HG      MET  60 -39.968  11.741 -23.193
  472    HE1  MET  60           3HE      MET  60 -37.339   8.339 -21.726
  473    HE2  MET  60           1HE      MET  60 -38.650   8.922 -20.682
  474    HE3  MET  60           2HE      MET  60 -39.016   8.314 -22.310
  475    H    GLN  61           H        GLN  61 -38.011  11.749 -18.075
  476    HA   GLN  61           HA       GLN  61 -37.232  13.284 -16.685
  477    HB2  GLN  61           2HB      GLN  61 -38.953  15.287 -18.153
  478    HB3  GLN  61           3HB      GLN  61 -37.491  15.627 -17.240
  479    HG2  GLN  61           2HG      GLN  61 -36.084  14.924 -18.932
  480    HG3  GLN  61           3HG      GLN  61 -37.130  13.621 -19.451
  481   HE21  GLN  61          2HE2      GLN  61 -37.233  13.940 -21.625
  482   HE22  GLN  61          1HE2      GLN  61 -38.023  15.336 -22.322
  483    H    ARG  62           H        ARG  62 -39.882  11.831 -15.963
  484    HA   ARG  62           HA       ARG  62 -40.965  13.590 -13.884
  485    HB2  ARG  62           2HB      ARG  62 -41.156  10.643 -14.604
  486    HB3  ARG  62           3HB      ARG  62 -41.504  11.113 -12.953
  487    HG2  ARG  62           2HG      ARG  62 -43.576  11.160 -13.815
  488    HG3  ARG  62           3HG      ARG  62 -43.130  12.864 -13.922
  489    HD2  ARG  62           2HD      ARG  62 -42.876  10.891 -16.210
  490    HD3  ARG  62           3HD      ARG  62 -44.362  11.770 -15.912
  491    HE   ARG  62           HE       ARG  62 -41.949  12.799 -17.159
  492   HH11  ARG  62          1HH1      ARG  62 -44.783  13.905 -15.402
  493   HH12  ARG  62          2HH1      ARG  62 -44.663  15.503 -16.086
  494   HH21  ARG  62          1HH2      ARG  62 -41.877  14.747 -17.979
  495   HH22  ARG  62          2HH2      ARG  62 -43.033  15.987 -17.524
  496    HA   PRO  63           HA       PRO  63 -37.791  12.902 -10.767
  497    HB2  PRO  63           2HB      PRO  63 -40.035  12.494  -8.821
  498    HB3  PRO  63           3HB      PRO  63 -38.608  13.565  -8.691
  499    HG2  PRO  63           2HG      PRO  63 -41.046  14.604  -9.289
  500    HG3  PRO  63           3HG      PRO  63 -39.586  15.174 -10.159
  501    HD2  PRO  63           2HD      PRO  63 -41.624  13.123 -11.076
  502    HD3  PRO  63           3HD      PRO  63 -40.943  14.521 -11.966
  503    H    CYS  64           H        CYS  64 -36.720  11.082 -10.049
  504    HA   CYS  64           HA       CYS  64 -37.631   8.436 -10.663
  505    HB2  CYS  64           2HB      CYS  64 -35.297   9.300 -10.636
  506    HB3  CYS  64           3HB      CYS  64 -35.364   9.410  -8.875
  507    HG   CYS  64           HG       CYS  64 -33.930   7.337  -9.591
  508    H    THR  65           H        THR  65 -38.215  10.390  -7.836
  509    HA   THR  65           HA       THR  65 -38.585   8.505  -5.828
  510    HB   THR  65           HB       THR  65 -40.275  11.003  -5.994
  511    HG1  THR  65           HG1      THR  65 -38.517  12.159  -5.238
  512   HG21  THR  65          1HG2      THR  65 -38.727   9.629  -3.763
  513   HG22  THR  65          2HG2      THR  65 -39.747  11.078  -3.585
  514   HG23  THR  65          3HG2      THR  65 -40.480   9.525  -4.012
  515    H    CYS  66           H        CYS  66 -39.636   6.774  -6.390
  516    HA   CYS  66           HA       CYS  66 -41.969   6.366  -7.783
  517    HB2  CYS  66           2HB      CYS  66 -42.116   4.191  -6.676
  518    HB3  CYS  66           3HB      CYS  66 -40.419   4.590  -7.007
  519    HG   CYS  66           HG       CYS  66 -40.597   3.414  -4.672
  520    H    ASP  67           H        ASP  67 -41.931   7.900  -4.727
  521    HA   ASP  67           HA       ASP  67 -44.523   7.540  -3.685
  522    HB2  ASP  67           2HB      ASP  67 -42.740   8.945  -2.683
  523    HB3  ASP  67           3HB      ASP  67 -42.903  10.100  -4.003
  524    H    PHE  68           H        PHE  68 -43.472   9.506  -6.526
  525    HA   PHE  68           HA       PHE  68 -46.048  10.705  -6.997
  526    HB2  PHE  68           2HB      PHE  68 -43.610  10.306  -8.768
  527    HB3  PHE  68           3HB      PHE  68 -45.037  11.194  -9.274
  528    HD1  PHE  68           HD2      PHE  68 -45.874  13.139  -7.726
  529    HD2  PHE  68           HD1      PHE  68 -41.879  11.527  -7.668
  530    HE1  PHE  68           HE2      PHE  68 -45.047  15.220  -6.650
  531    HE2  PHE  68           HE1      PHE  68 -41.056  13.597  -6.569
  532    HZ   PHE  68           HZ       PHE  68 -42.639  15.449  -6.064
  533    H    LEU  69           H        LEU  69 -45.122   7.475  -7.470
  534    HA   LEU  69           HA       LEU  69 -47.596   6.999  -9.019
  535    HB2  LEU  69           2HB      LEU  69 -46.574   5.147 -10.237
  536    HB3  LEU  69           3HB      LEU  69 -45.896   6.717 -10.606
  537    HG   LEU  69           HG       LEU  69 -43.911   6.161  -9.130
  538   HD11  LEU  69          1HD1      LEU  69 -44.801   4.289  -7.788
  539   HD12  LEU  69          2HD1      LEU  69 -45.087   3.349  -9.263
  540   HD13  LEU  69          3HD1      LEU  69 -43.432   3.751  -8.754
  541   HD21  LEU  69          3HD2      LEU  69 -42.864   4.742 -10.843
  542   HD22  LEU  69          1HD2      LEU  69 -44.465   4.344 -11.505
  543   HD23  LEU  69          2HD2      LEU  69 -43.851   6.010 -11.582
  544    H    HIS  70           H        HIS  70 -46.894   6.970  -6.029
  545    HA   HIS  70           HA       HIS  70 -47.006   4.248  -5.209
  546    HB2  HIS  70           2HB      HIS  70 -47.209   4.971  -3.059
  547    HB3  HIS  70           3HB      HIS  70 -46.384   6.312  -3.813
  548    HD2  HIS  70           HD2      HIS  70 -48.656   8.172  -4.829
  549    HE1  HIS  70           HE1      HIS  70 -50.565   7.741  -1.044
  550    HE2  HIS  70           HE2      HIS  70 -50.444   9.147  -3.162
  551    H    GLY  71           H        GLY  71 -48.608   2.915  -4.424
  552    HA2  GLY  71           HA2      GLY  71 -51.368   3.381  -5.491
  553    HA3  GLY  71           HA3      GLY  71 -50.572   1.818  -5.341
  554    HA   PRO  72           HA       PRO  72 -53.272   2.927  -1.625
  555    HB2  PRO  72           2HB      PRO  72 -55.239   1.018  -1.842
  556    HB3  PRO  72           3HB      PRO  72 -55.271   2.587  -2.698
  557    HG2  PRO  72           2HG      PRO  72 -54.320  -0.089  -3.759
  558    HG3  PRO  72           3HG      PRO  72 -55.462   1.060  -4.529
  559    HD2  PRO  72           2HD      PRO  72 -52.837   1.026  -5.209
  560    HD3  PRO  72           3HD      PRO  72 -53.721   2.574  -5.068
  561    H    ARG  73           H        ARG  73 -51.530   0.121  -2.607
  562    HA   ARG  73           HA       ARG  73 -51.445  -0.933   0.201
  563    HB2  ARG  73           2HB      ARG  73 -50.661  -2.203  -2.451
  564    HB3  ARG  73           3HB      ARG  73 -50.279  -2.901  -0.875
  565    HG2  ARG  73           2HG      ARG  73 -52.643  -3.003  -0.260
  566    HG3  ARG  73           3HG      ARG  73 -53.114  -2.267  -1.801
  567    HD2  ARG  73           2HD      ARG  73 -52.263  -4.174  -3.040
  568    HD3  ARG  73           3HD      ARG  73 -51.627  -4.913  -1.559
  569    HE   ARG  73           HE       ARG  73 -54.264  -4.593  -0.943
  570   HH11  ARG  73          1HH1      ARG  73 -52.826  -6.144  -3.772
  571   HH12  ARG  73          2HH1      ARG  73 -54.118  -7.309  -3.856
  572   HH21  ARG  73          1HH2      ARG  73 -55.874  -6.076  -1.183
  573   HH22  ARG  73          2HH2      ARG  73 -55.799  -7.249  -2.463
  574    H    THR  74           H        THR  74 -49.681   1.248  -1.715
  575    HA   THR  74           HA       THR  74 -47.025   0.427  -0.851
  576    HB   THR  74           HB       THR  74 -47.765   3.229  -1.674
  577    HG1  THR  74           HG1      THR  74 -46.798   1.428  -3.568
  578   HG21  THR  74          1HG2      THR  74 -45.440   3.140  -2.654
  579   HG22  THR  74          2HG2      THR  74 -45.473   2.986  -0.893
  580   HG23  THR  74          3HG2      THR  74 -45.234   1.543  -1.898
  581    H    GLN  75           H        GLN  75 -45.881   1.000   0.882
  582    HA   GLN  75           HA       GLN  75 -47.356   2.219   3.123
  583    HB2  GLN  75           2HB      GLN  75 -44.508   1.189   3.115
  584    HB3  GLN  75           3HB      GLN  75 -45.515   1.594   4.502
  585    HG2  GLN  75           2HG      GLN  75 -45.904  -0.755   2.614
  586    HG3  GLN  75           3HG      GLN  75 -45.311  -0.777   4.275
  587   HE21  GLN  75          2HE2      GLN  75 -48.256  -0.753   2.281
  588   HE22  GLN  75          1HE2      GLN  75 -49.334  -0.775   3.666
  589    H    ARG  76           H        ARG  76 -46.995   4.189   3.990
  590    HA   ARG  76           HA       ARG  76 -45.711   6.208   2.352
  591    HB2  ARG  76           2HB      ARG  76 -46.560   6.473   5.232
  592    HB3  ARG  76           3HB      ARG  76 -46.352   7.775   4.062
  593    HG2  ARG  76           2HG      ARG  76 -48.567   5.685   4.135
  594    HG3  ARG  76           3HG      ARG  76 -48.715   7.429   4.328
  595    HD2  ARG  76           2HD      ARG  76 -47.993   7.732   1.941
  596    HD3  ARG  76           3HD      ARG  76 -47.872   5.982   1.775
  597    HE   ARG  76           HE       ARG  76 -50.164   5.769   1.661
  598   HH11  ARG  76          2HH1      ARG  76 -49.508   9.100   2.550
  599   HH12  ARG  76          1HH1      ARG  76 -51.161   9.584   2.287
  600   HH21  ARG  76          1HH2      ARG  76 -52.250   6.455   1.374
  601   HH22  ARG  76          2HH2      ARG  76 -52.665   8.122   1.639
  602    H    ARG  77           H        ARG  77 -44.730   4.546   5.331
  603    HA   ARG  77           HA       ARG  77 -42.227   5.840   5.706
  604    HB2  ARG  77           2HB      ARG  77 -41.559   3.929   6.972
  605    HB3  ARG  77           3HB      ARG  77 -43.249   4.319   7.328
  606    HG2  ARG  77           2HG      ARG  77 -43.912   2.442   5.754
  607    HG3  ARG  77           3HG      ARG  77 -42.199   1.990   5.659
  608    HD2  ARG  77           2HD      ARG  77 -42.156   1.665   8.109
  609    HD3  ARG  77           3HD      ARG  77 -43.864   2.108   8.205
  610    HE   ARG  77           HE       ARG  77 -42.718  -0.425   7.258
  611   HH11  ARG  77          1HH2      ARG  77 -45.666   1.479   7.436
  612   HH12  ARG  77          2HH2      ARG  77 -46.645   0.139   6.882
  613   HH21  ARG  77          1HH1      ARG  77 -44.092  -2.138   6.854
  614   HH22  ARG  77          2HH1      ARG  77 -45.812  -1.866   6.797
  615    H    ALA  78           H        ALA  78 -43.047   3.192   3.505
  616    HA   ALA  78           HA       ALA  78 -40.362   2.631   2.609
  617    HB1  ALA  78           3HB      ALA  78 -43.044   2.135   1.213
  618    HB2  ALA  78           1HB      ALA  78 -41.504   1.456   0.786
  619    HB3  ALA  78           2HB      ALA  78 -42.210   1.031   2.339
  620    H    ALA  79           H        ALA  79 -43.046   4.631   1.262
  621    HA   ALA  79           HA       ALA  79 -41.495   5.586  -0.991
  622    HB1  ALA  79           3HB      ALA  79 -43.986   6.743   0.350
  623    HB2  ALA  79           1HB      ALA  79 -43.396   7.127  -1.278
  624    HB3  ALA  79           2HB      ALA  79 -43.982   5.491  -0.919
  625    H    ALA  80           H        ALA  80 -41.991   6.848   2.296
  626    HA   ALA  80           HA       ALA  80 -40.738   9.375   1.883
  627    HB1  ALA  80           3HB      ALA  80 -41.179   7.713   4.394
  628    HB2  ALA  80           1HB      ALA  80 -40.715   9.431   4.366
  629    HB3  ALA  80           2HB      ALA  80 -42.290   8.926   3.715
  630    H    GLN  81           H        GLN  81 -39.425   6.362   3.434
  631    HA   GLN  81           HA       GLN  81 -36.729   7.111   3.717
  632    HB2  GLN  81           2HB      GLN  81 -38.039   4.452   3.055
  633    HB3  GLN  81           3HB      GLN  81 -36.300   4.623   3.314
  634    HG2  GLN  81           2HG      GLN  81 -36.612   5.422   5.576
  635    HG3  GLN  81           3HG      GLN  81 -38.362   5.477   5.387
  636   HE21  GLN  81          2HE2      GLN  81 -35.566   3.178   5.370
  637   HE22  GLN  81          1HE2      GLN  81 -36.530   1.818   5.926
  638    H    ILE  82           H        ILE  82 -38.370   5.862   0.730
  639    HA   ILE  82           HA       ILE  82 -35.971   5.966  -0.860
  640    HB   ILE  82           HB       ILE  82 -38.916   5.958  -1.512
  641   HG12  ILE  82          2HG1      ILE  82 -36.674   3.959  -2.108
  642   HG13  ILE  82          3HG1      ILE  82 -37.592   3.947  -0.600
  643   HG21  ILE  82          1HG2      ILE  82 -38.189   5.685  -3.927
  644   HG22  ILE  82          2HG2      ILE  82 -37.944   7.305  -3.258
  645   HG23  ILE  82          3HG2      ILE  82 -36.558   6.206  -3.423
  646   HD11  ILE  82          3HD1      ILE  82 -39.705   3.776  -1.923
  647   HD12  ILE  82          1HD1      ILE  82 -38.690   3.472  -3.367
  648   HD13  ILE  82          2HD1      ILE  82 -38.624   2.365  -1.982
  649    H    ALA  83           H        ALA  83 -38.643   8.377  -0.492
  650    HA   ALA  83           HA       ALA  83 -37.525  10.407  -2.058
  651    HB1  ALA  83           3HB      ALA  83 -39.799  10.404  -1.057
  652    HB2  ALA  83           1HB      ALA  83 -39.080  10.742   0.534
  653    HB3  ALA  83           2HB      ALA  83 -38.916  11.925  -0.770
  654    H    GLN  84           H        GLN  84 -36.668   9.529   1.283
  655    HA   GLN  84           HA       GLN  84 -34.885  11.804   1.716
  656    HB2  GLN  84           2HB      GLN  84 -34.688   9.137   3.144
  657    HB3  GLN  84           3HB      GLN  84 -34.066  10.699   3.634
  658    HG2  GLN  84           2HG      GLN  84 -36.842   9.642   3.795
  659    HG3  GLN  84           3HG      GLN  84 -35.889  10.348   5.035
  660   HE21  GLN  84          1HE2      GLN  84 -38.287  10.924   2.658
  661   HE22  GLN  84          2HE2      GLN  84 -38.420  12.674   2.896
  662    H    ALA  85           H        ALA  85 -34.484   8.457   0.422
  663    HA   ALA  85           HA       ALA  85 -31.597   8.579   0.357
  664    HB1  ALA  85           3HB      ALA  85 -32.862   6.453   0.419
  665    HB2  ALA  85           1HB      ALA  85 -33.551   6.808  -1.182
  666    HB3  ALA  85           2HB      ALA  85 -31.808   6.539  -1.005
  667    H    LEU  86           H        LEU  86 -34.159   9.565  -1.871
  668    HA   LEU  86           HA       LEU  86 -32.265  10.239  -4.001
  669    HB2  LEU  86           2HB      LEU  86 -35.166  11.065  -3.834
  670    HB3  LEU  86           3HB      LEU  86 -34.118  10.982  -5.238
  671    HG   LEU  86           HG       LEU  86 -35.651   8.810  -3.834
  672   HD11  LEU  86          1HD1      LEU  86 -36.295   9.903  -5.990
  673   HD12  LEU  86          2HD1      LEU  86 -34.845   9.220  -6.736
  674   HD13  LEU  86          3HD1      LEU  86 -36.115   8.142  -6.113
  675   HD21  LEU  86          3HD2      LEU  86 -34.366   7.023  -4.980
  676   HD22  LEU  86          1HD2      LEU  86 -33.103   8.196  -5.420
  677   HD23  LEU  86          2HD2      LEU  86 -33.399   7.757  -3.725
  678    H    LEU  87           H        LEU  87 -33.928  12.012  -1.396
  679    HA   LEU  87           HA       LEU  87 -33.039  14.647  -1.959
  680    HB2  LEU  87           2HB      LEU  87 -34.807  14.434  -0.526
  681    HB3  LEU  87           3HB      LEU  87 -34.178  13.008   0.254
  682    HG   LEU  87           HG       LEU  87 -32.887  15.546   0.863
  683   HD11  LEU  87          1HD1      LEU  87 -35.283  15.984   1.139
  684   HD12  LEU  87          2HD1      LEU  87 -35.448  14.500   2.103
  685   HD13  LEU  87          3HD1      LEU  87 -34.509  15.879   2.727
  686   HD21  LEU  87          3HD2      LEU  87 -31.843  13.571   1.840
  687   HD22  LEU  87          1HD2      LEU  87 -32.529  14.601   3.084
  688   HD23  LEU  87          2HD2      LEU  87 -33.381  13.125   2.607
  689    H    GLY  88           H        GLY  88 -31.452  11.879  -0.418
  690    HA2  GLY  88           HA2      GLY  88 -29.092  11.630  -0.855
  691    HA3  GLY  88           HA3      GLY  88 -28.848  13.357  -0.623
  692    H    ALA  89           H        ALA  89 -30.890  11.651   1.706
  693    HA   ALA  89           HA       ALA  89 -29.226  12.340   3.927
  694    HB1  ALA  89           3HB      ALA  89 -30.780  10.878   5.198
  695    HB2  ALA  89           1HB      ALA  89 -31.643  11.996   4.129
  696    HB3  ALA  89           2HB      ALA  89 -31.471  10.285   3.674
  697    H    GLU  90           H        GLU  90 -29.820   9.228   2.310
  698    HA   GLU  90           HA       GLU  90 -27.072   8.460   2.222
  699    HB2  GLU  90           2HB      GLU  90 -27.300   6.293   3.388
  700    HB3  GLU  90           3HB      GLU  90 -27.343   7.666   4.485
  701    HG2  GLU  90           2HG      GLU  90 -29.817   7.466   4.662
  702    HG3  GLU  90           3HG      GLU  90 -29.785   6.088   3.557
  703    H    GLU  91           H        GLU  91 -26.796   6.956   0.504
  704    HA   GLU  91           HA       GLU  91 -29.231   6.237  -1.065
  705    HB2  GLU  91           2HB      GLU  91 -26.253   5.847  -1.537
  706    HB3  GLU  91           3HB      GLU  91 -27.506   5.022  -2.453
  707    HG2  GLU  91           2HG      GLU  91 -27.228   6.914  -3.778
  708    HG3  GLU  91           3HG      GLU  91 -28.604   7.345  -2.807
  709    H    ARG  92           H        ARG  92 -30.325   4.585  -0.693
  710    HA   ARG  92           HA       ARG  92 -29.313   2.085   0.553
  711    HB2  ARG  92           2HB      ARG  92 -29.825   3.772   2.398
  712    HB3  ARG  92           3HB      ARG  92 -31.476   3.853   1.809
  713    HG2  ARG  92           2HG      ARG  92 -31.462   2.418   3.716
  714    HG3  ARG  92           3HG      ARG  92 -31.743   1.402   2.310
  715    HD2  ARG  92           2HD      ARG  92 -30.213   0.284   3.801
  716    HD3  ARG  92           3HD      ARG  92 -29.322   0.737   2.342
  717    HE   ARG  92           HE       ARG  92 -29.068   2.824   4.319
  718   HH11  ARG  92          1HH1      ARG  92 -27.811  -0.422   3.803
  719   HH12  ARG  92          2HH1      ARG  92 -26.392  -0.081   4.759
  720   HH21  ARG  92          2HH2      ARG  92 -27.399   3.163   5.445
  721   HH22  ARG  92          1HH2      ARG  92 -26.135   1.951   5.705
  722    H    LYS  93           H        LYS  93 -30.449   0.350  -0.055
  723    HA   LYS  93           HA       LYS  93 -32.683   0.674  -1.931
  724    HB2  LYS  93           2HB      LYS  93 -31.007  -0.914  -2.477
  725    HB3  LYS  93           3HB      LYS  93 -31.174  -1.758  -0.943
  726    HG2  LYS  93           2HG      LYS  93 -33.644  -1.494  -2.651
  727    HG3  LYS  93           3HG      LYS  93 -32.362  -2.510  -3.286
  728    HD2  LYS  93           2HD      LYS  93 -33.626  -2.899  -0.534
  729    HD3  LYS  93           3HD      LYS  93 -34.092  -3.766  -2.005
  730    HE2  LYS  93           2HE      LYS  93 -31.750  -4.559  -2.270
  731    HE3  LYS  93           3HE      LYS  93 -31.315  -3.768  -0.750
  732    HZ1  LYS  93           HZ1      LYS  93 -32.920  -5.226   0.386
  733    HZ2  LYS  93           HZ2      LYS  93 -33.312  -5.959  -1.026
  734    HZ3  LYS  93           HZ3      LYS  93 -31.812  -6.123  -0.408
  735    H    VAL  94           H        VAL  94 -34.742   0.356  -1.561
  736    HA   VAL  94           HA       VAL  94 -35.747  -0.672   1.059
  737    HB   VAL  94           HB       VAL  94 -37.020   1.740  -0.244
  738   HG11  VAL  94          1HG1      VAL  94 -36.972   0.760   2.646
  739   HG12  VAL  94          2HG1      VAL  94 -37.860   2.175   2.040
  740   HG13  VAL  94          3HG1      VAL  94 -38.319   0.568   1.502
  741   HG21  VAL  94          3HG2      VAL  94 -35.887   3.251   1.372
  742   HG22  VAL  94          1HG2      VAL  94 -34.825   1.911   1.865
  743   HG23  VAL  94          2HG2      VAL  94 -34.760   2.568   0.210
  744    H    GLU  95           H        GLU  95 -37.817  -1.542   0.978
  745    HA   GLU  95           HA       GLU  95 -38.659  -2.591  -1.643
  746    HB2  GLU  95           2HB      GLU  95 -40.189  -3.951  -0.306
  747    HB3  GLU  95           3HB      GLU  95 -38.512  -4.092   0.266
  748    HG2  GLU  95           2HG      GLU  95 -38.979  -2.573   2.146
  749    HG3  GLU  95           3HG      GLU  95 -40.621  -2.304   1.575
  750    H    ILE  96           H        ILE  96 -40.955  -2.357  -2.308
  751    HA   ILE  96           HA       ILE  96 -42.624  -0.403  -1.137
  752    HB   ILE  96           HB       ILE  96 -42.593   0.898  -3.581
  753   HG12  ILE  96          2HG1      ILE  96 -40.336   1.749  -4.026
  754   HG13  ILE  96          3HG1      ILE  96 -39.645   0.583  -2.896
  755   HG21  ILE  96          1HG2      ILE  96 -41.916   2.842  -2.485
  756   HG22  ILE  96          2HG2      ILE  96 -42.808   1.884  -1.304
  757   HG23  ILE  96          3HG2      ILE  96 -41.026   1.943  -1.252
  758   HD11  ILE  96          3HD1      ILE  96 -40.492  -1.252  -4.315
  759   HD12  ILE  96          1HD1      ILE  96 -41.169  -0.056  -5.437
  760   HD13  ILE  96          2HD1      ILE  96 -39.402  -0.183  -5.201
  761    H    ALA  97           H        ALA  97 -44.678  -0.278  -2.109
  762    HA   ALA  97           HA       ALA  97 -45.277  -2.596  -3.831
  763    HB1  ALA  97           3HB      ALA  97 -47.319  -0.690  -2.699
  764    HB2  ALA  97           1HB      ALA  97 -47.554  -2.341  -3.229
  765    HB3  ALA  97           2HB      ALA  97 -46.647  -2.030  -1.739
  766    H    PHE  98           H        PHE  98 -46.284  -2.528  -5.785
  767    HA   PHE  98           HA       PHE  98 -46.519   0.103  -7.190
  768    HB2  PHE  98           2HB      PHE  98 -45.577  -2.570  -8.239
  769    HB3  PHE  98           3HB      PHE  98 -46.329  -1.398  -9.299
  770    HD1  PHE  98           HD1      PHE  98 -43.290  -1.980  -7.147
  771    HD2  PHE  98           HD2      PHE  98 -45.252   0.570 -10.040
  772    HE1  PHE  98           HE1      PHE  98 -41.165  -0.787  -7.571
  773    HE2  PHE  98           HE2      PHE  98 -43.121   1.765 -10.429
  774    HZ   PHE  98           HZ       PHE  98 -41.085   1.113  -9.174
  775    H    TYR  99           H        TYR  99 -48.328   0.500  -8.372
  776    HA   TYR  99           HA       TYR  99 -50.353  -1.632  -8.545
  777    HB2  TYR  99           2HB      TYR  99 -52.184  -0.397  -8.067
  778    HB3  TYR  99           3HB      TYR  99 -51.064   0.005  -6.789
  779    HD1  TYR  99           HD2      TYR  99 -49.445   2.259  -8.166
  780    HD2  TYR  99           HD1      TYR  99 -53.671   1.358  -8.033
  781    HE1  TYR  99           HE2      TYR  99 -49.974   4.638  -8.573
  782    HE2  TYR  99           HE1      TYR  99 -54.186   3.761  -8.411
  783    HH   TYR  99           HH       TYR  99 -51.612   6.221  -8.819
  784    H    ARG 100           H        ARG 100 -51.169  -1.956 -10.467
  785    HA   ARG 100           HA       ARG 100 -49.794  -0.594 -12.701
  786    HB2  ARG 100           2HB      ARG 100 -51.202  -3.294 -12.613
  787    HB3  ARG 100           3HB      ARG 100 -50.142  -2.662 -13.883
  788    HG2  ARG 100           2HG      ARG 100 -48.303  -2.501 -12.105
  789    HG3  ARG 100           3HG      ARG 100 -49.360  -3.360 -10.997
  790    HD2  ARG 100           2HD      ARG 100 -47.689  -4.822 -12.044
  791    HD3  ARG 100           3HD      ARG 100 -49.334  -5.352 -12.350
  792    HE   ARG 100           HE       ARG 100 -47.593  -3.875 -14.280
  793   HH11  ARG 100          1HH1      ARG 100 -50.377  -5.992 -13.825
  794   HH12  ARG 100          2HH1      ARG 100 -50.438  -6.418 -15.512
  795   HH21  ARG 100          1HH2      ARG 100 -47.714  -4.485 -16.403
  796   HH22  ARG 100          2HH2      ARG 100 -48.993  -5.545 -16.952
  797    H    LYS 101           H        LYS 101 -50.765  -0.081 -14.655
  798    HA   LYS 101           HA       LYS 101 -53.396   1.062 -14.688
  799    HB2  LYS 101           2HB      LYS 101 -51.637   1.809 -16.121
  800    HB3  LYS 101           3HB      LYS 101 -51.419   0.218 -16.834
  801    HG2  LYS 101           2HG      LYS 101 -54.103   1.579 -17.136
  802    HG3  LYS 101           3HG      LYS 101 -52.731   2.169 -18.079
  803    HD2  LYS 101           2HD      LYS 101 -52.341  -0.006 -19.065
  804    HD3  LYS 101           3HD      LYS 101 -53.606  -0.752 -18.089
  805    HE2  LYS 101           2HE      LYS 101 -55.314   0.689 -19.128
  806    HE3  LYS 101           3HE      LYS 101 -54.069   1.506 -20.085
  807    HZ1  LYS 101           HZ1      LYS 101 -54.762  -1.378 -20.298
  808    HZ2  LYS 101           HZ2      LYS 101 -55.175  -0.227 -21.374
  809    HZ3  LYS 101           HZ3      LYS 101 -53.607  -0.626 -21.178
  810    H    ASP 102           H        ASP 102 -52.292  -2.190 -15.379
  811    HA   ASP 102           HA       ASP 102 -54.743  -3.188 -16.514
  812    HB2  ASP 102           2HB      ASP 102 -52.412  -4.110 -16.801
  813    HB3  ASP 102           3HB      ASP 102 -52.484  -4.678 -15.133
  814    H    GLY 103           H        GLY 103 -54.084  -2.260 -13.304
  815    HA2  GLY 103           HA2      GLY 103 -55.735  -2.204 -11.643
  816    HA3  GLY 103           HA3      GLY 103 -56.499  -3.652 -12.290
  817    H    SER 104           H        SER 104 -53.204  -4.335 -12.105
  818    HA   SER 104           HA       SER 104 -53.442  -6.011  -9.750
  819    HB2  SER 104           2HB      SER 104 -50.730  -5.291 -10.695
  820    HB3  SER 104           3HB      SER 104 -51.418  -6.871 -10.341
  821    HG   SER 104           HG       SER 104 -52.452  -6.806 -12.381
  822    H    CYS 105           H        CYS 105 -52.411  -5.731  -7.666
  823    HA   CYS 105           HA       CYS 105 -50.874  -3.271  -7.141
  824    HB2  CYS 105           2HB      CYS 105 -53.290  -2.630  -6.903
  825    HB3  CYS 105           3HB      CYS 105 -53.452  -3.844  -5.620
  826    HG   CYS 105           HG       CYS 105 -53.281  -1.473  -4.552
  827    H    PHE 106           H        PHE 106 -49.070  -4.099  -6.169
  828    HA   PHE 106           HA       PHE 106 -49.355  -5.962  -3.890
  829    HB2  PHE 106           2HB      PHE 106 -47.780  -7.612  -4.972
  830    HB3  PHE 106           3HB      PHE 106 -49.413  -7.567  -5.597
  831    HD1  PHE 106           HD1      PHE 106 -45.944  -6.287  -6.313
  832    HD2  PHE 106           HD2      PHE 106 -49.809  -7.334  -7.919
  833    HE1  PHE 106           HE1      PHE 106 -45.095  -5.927  -8.602
  834    HE2  PHE 106           HE2      PHE 106 -48.923  -7.037 -10.224
  835    HZ   PHE 106           HZ       PHE 106 -46.565  -6.320 -10.569
  836    H    LEU 107           H        LEU 107 -47.583  -6.263  -2.592
  837    HA   LEU 107           HA       LEU 107 -45.218  -4.485  -2.943
  838    HB2  LEU 107           2HB      LEU 107 -46.592  -4.209  -0.870
  839    HB3  LEU 107           3HB      LEU 107 -46.335  -5.891  -0.480
  840    HG   LEU 107           HG       LEU 107 -45.000  -4.406   0.886
  841   HD11  LEU 107          1HD1      LEU 107 -43.994  -6.682   0.187
  842   HD12  LEU 107          2HD1      LEU 107 -42.938  -5.734  -0.889
  843   HD13  LEU 107          3HD1      LEU 107 -42.891  -5.448   0.837
  844   HD21  LEU 107          3HD2      LEU 107 -43.135  -3.111   0.083
  845   HD22  LEU 107          1HD2      LEU 107 -43.527  -3.564  -1.588
  846   HD23  LEU 107          2HD2      LEU 107 -44.660  -2.561  -0.621
  847    H    CYS 108           H        CYS 108 -43.387  -5.410  -3.526
  848    HA   CYS 108           HA       CYS 108 -42.772  -8.210  -2.740
  849    HB2  CYS 108           2HB      CYS 108 -42.326  -7.007  -5.507
  850    HB3  CYS 108           3HB      CYS 108 -41.709  -8.576  -4.953
  851    HG   CYS 108           HG       CYS 108 -44.158  -9.482  -4.224
  852    H    LEU 109           H        LEU 109 -40.263  -8.561  -3.074
  853    HA   LEU 109           HA       LEU 109 -39.008  -6.490  -1.419
  854    HB2  LEU 109           2HB      LEU 109 -38.081  -9.225  -2.379
  855    HB3  LEU 109           3HB      LEU 109 -37.112  -8.133  -1.404
  856    HG   LEU 109           HG       LEU 109 -38.804  -8.212   0.415
  857   HD11  LEU 109          1HD1      LEU 109 -40.860  -8.926  -0.660
  858   HD12  LEU 109          2HD1      LEU 109 -40.071 -10.393  -1.301
  859   HD13  LEU 109          3HD1      LEU 109 -40.361 -10.200   0.441
  860   HD21  LEU 109          3HD2      LEU 109 -37.676 -10.897  -0.488
  861   HD22  LEU 109          1HD2      LEU 109 -36.784  -9.636   0.392
  862   HD23  LEU 109          2HD2      LEU 109 -38.141 -10.459   1.172
  863    H    VAL 110           H        VAL 110 -39.426  -5.053  -3.424
  864    HA   VAL 110           HA       VAL 110 -37.990  -5.295  -5.802
  865    HB   VAL 110           HB       VAL 110 -38.915  -2.712  -4.543
  866   HG11  VAL 110          1HG1      VAL 110 -38.442  -3.520  -7.432
  867   HG12  VAL 110          2HG1      VAL 110 -39.177  -1.989  -6.928
  868   HG13  VAL 110          3HG1      VAL 110 -37.494  -2.319  -6.522
  869   HG21  VAL 110          3HG2      VAL 110 -40.390  -4.695  -6.349
  870   HG22  VAL 110          1HG2      VAL 110 -40.833  -4.250  -4.686
  871   HG23  VAL 110          2HG2      VAL 110 -40.976  -3.066  -5.968
  872    H    ASP 111           H        ASP 111 -36.047  -4.437  -6.648
  873    HA   ASP 111           HA       ASP 111 -34.024  -3.981  -4.492
  874    HB2  ASP 111           2HB      ASP 111 -33.868  -6.002  -5.933
  875    HB3  ASP 111           3HB      ASP 111 -33.549  -4.940  -7.312
  876    H    VAL 112           H        VAL 112 -34.925  -1.767  -4.505
  877    HA   VAL 112           HA       VAL 112 -34.317   0.095  -6.581
  878    HB   VAL 112           HB       VAL 112 -35.034   0.590  -3.658
  879   HG11  VAL 112          1HG1      VAL 112 -36.150   2.601  -4.434
  880   HG12  VAL 112          2HG1      VAL 112 -34.464   2.657  -4.937
  881   HG13  VAL 112          3HG1      VAL 112 -35.737   2.241  -6.118
  882   HG21  VAL 112          3HG2      VAL 112 -37.396   0.612  -4.488
  883   HG22  VAL 112          1HG2      VAL 112 -36.808  -0.045  -6.041
  884   HG23  VAL 112          2HG2      VAL 112 -36.661  -0.984  -4.543
  885    H    VAL 113           H        VAL 113 -31.936  -0.615  -6.725
  886    HA   VAL 113           HA       VAL 113 -30.249   0.868  -4.755
  887    HB   VAL 113           HB       VAL 113 -30.113  -1.511  -4.551
  888   HG11  VAL 113          1HG1      VAL 113 -30.508  -2.264  -6.852
  889   HG12  VAL 113          2HG1      VAL 113 -28.935  -1.622  -7.343
  890   HG13  VAL 113          3HG1      VAL 113 -29.032  -2.953  -6.178
  891   HG21  VAL 113          3HG2      VAL 113 -28.166  -0.196  -3.924
  892   HG22  VAL 113          1HG2      VAL 113 -27.676  -1.762  -4.576
  893   HG23  VAL 113          2HG2      VAL 113 -27.517  -0.310  -5.579
  894    HA   PRO 114           HA       PRO 114 -28.962   3.357  -8.271
  895    HB2  PRO 114           2HB      PRO 114 -27.291   5.099  -7.048
  896    HB3  PRO 114           3HB      PRO 114 -29.007   5.000  -6.605
  897    HG2  PRO 114           2HG      PRO 114 -26.669   3.659  -5.223
  898    HG3  PRO 114           3HG      PRO 114 -27.952   4.707  -4.521
  899    HD2  PRO 114           2HD      PRO 114 -28.162   2.007  -4.467
  900    HD3  PRO 114           3HD      PRO 114 -29.582   3.064  -4.741
  901    H    VAL 115           H        VAL 115 -26.817   4.515  -9.178
  902    HA   VAL 115           HA       VAL 115 -24.557   2.563  -9.187
  903    HB   VAL 115           HB       VAL 115 -24.160   3.111 -11.554
  904   HG11  VAL 115          1HG1      VAL 115 -25.177   0.987 -10.837
  905   HG12  VAL 115          2HG1      VAL 115 -26.793   1.708 -10.990
  906   HG13  VAL 115          3HG1      VAL 115 -25.765   1.508 -12.424
  907   HG21  VAL 115          3HG2      VAL 115 -25.527   5.145 -11.734
  908   HG22  VAL 115          1HG2      VAL 115 -25.897   3.951 -12.978
  909   HG23  VAL 115          2HG2      VAL 115 -26.998   4.157 -11.588
  910    H    LYS 116           H        LYS 116 -22.621   3.251  -8.991
  911    HA   LYS 116           HA       LYS 116 -22.120   6.138  -8.514
  912    HB2  LYS 116           2HB      LYS 116 -20.830   3.770  -7.085
  913    HB3  LYS 116           3HB      LYS 116 -20.526   5.453  -6.784
  914    HG2  LYS 116           2HG      LYS 116 -21.940   5.031  -5.065
  915    HG3  LYS 116           3HG      LYS 116 -23.093   5.607  -6.247
  916    HD2  LYS 116           2HD      LYS 116 -24.075   3.723  -5.184
  917    HD3  LYS 116           3HD      LYS 116 -23.640   3.188  -6.804
  918    HE2  LYS 116           2HE      LYS 116 -21.442   2.300  -5.736
  919    HE3  LYS 116           3HE      LYS 116 -22.218   2.615  -4.178
  920    HZ1  LYS 116           HZ1      LYS 116 -24.083   1.157  -5.042
  921    HZ2  LYS 116           HZ2      LYS 116 -23.066   0.713  -6.281
  922    HZ3  LYS 116           HZ3      LYS 116 -22.690   0.392  -4.710
  923    H    ASN 117           H        ASN 117 -19.886   6.749  -8.590
  924    HA   ASN 117           HA       ASN 117 -18.408   5.510 -10.888
  925    HB2  ASN 117           2HB      ASN 117 -17.403   7.546 -11.335
  926    HB3  ASN 117           3HB      ASN 117 -19.050   7.983 -10.967
  927   HD21  ASN 117          2HD2      ASN 117 -19.404   8.867  -8.606
  928   HD22  ASN 117          1HD2      ASN 117 -18.024   9.741  -7.958
  929    H    GLU 118           H        GLU 118 -15.879   5.998 -10.584
  930    HA   GLU 118           HA       GLU 118 -15.009   4.110  -8.680
  931    HB2  GLU 118           2HB      GLU 118 -12.768   4.625  -9.432
  932    HB3  GLU 118           3HB      GLU 118 -13.878   4.546 -10.798
  933    HG2  GLU 118           2HG      GLU 118 -13.984   7.056 -10.825
  934    HG3  GLU 118           3HG      GLU 118 -12.820   7.100  -9.500
  935    H    ASP 119           H        ASP 119 -15.443   7.543  -8.184
  936    HA   ASP 119           HA       ASP 119 -13.832   7.781  -5.793
  937    HB2  ASP 119           2HB      ASP 119 -14.765   9.595  -7.354
  938    HB3  ASP 119           3HB      ASP 119 -16.306   9.382  -6.525
  939    H    GLY 120           H        GLY 120 -16.915   6.259  -6.396
  940    HA2  GLY 120           HA2      GLY 120 -18.105   4.943  -4.852
  941    HA3  GLY 120           HA3      GLY 120 -17.448   5.863  -3.499
  942    H    ALA 121           H        ALA 121 -18.511   8.027  -5.906
  943    HA   ALA 121           HA       ALA 121 -20.977   8.603  -4.370
  944    HB1  ALA 121           3HB      ALA 121 -19.234  10.390  -4.662
  945    HB2  ALA 121           1HB      ALA 121 -19.550  10.343  -6.419
  946    HB3  ALA 121           2HB      ALA 121 -20.830  10.835  -5.302
  947    H    VAL 122           H        VAL 122 -22.971   8.850  -5.181
  948    HA   VAL 122           HA       VAL 122 -23.682   7.263  -7.481
  949    HB   VAL 122           HB       VAL 122 -25.037   7.138  -5.529
  950   HG11  VAL 122          1HG1      VAL 122 -25.866  10.039  -5.940
  951   HG12  VAL 122          2HG1      VAL 122 -26.588   8.886  -4.837
  952   HG13  VAL 122          3HG1      VAL 122 -24.906   9.397  -4.586
  953   HG21  VAL 122          3HG2      VAL 122 -26.546   8.431  -7.824
  954   HG22  VAL 122          1HG2      VAL 122 -26.019   6.750  -7.743
  955   HG23  VAL 122          2HG2      VAL 122 -27.223   7.368  -6.585
  956    H    ILE 123           H        ILE 123 -23.043   7.997  -9.357
  957    HA   ILE 123           HA       ILE 123 -23.701  10.770 -10.123
  958    HB   ILE 123           HB       ILE 123 -22.373  10.666 -11.910
  959   HG12  ILE 123          2HG1      ILE 123 -23.084   8.770 -13.138
  960   HG13  ILE 123          3HG1      ILE 123 -21.346   8.758 -12.982
  961   HG21  ILE 123          1HG2      ILE 123 -20.944   8.827  -9.975
  962   HG22  ILE 123          2HG2      ILE 123 -20.220   9.998 -11.106
  963   HG23  ILE 123          3HG2      ILE 123 -21.176  10.564  -9.724
  964   HD11  ILE 123          3HD1      ILE 123 -21.570   6.993 -11.188
  965   HD12  ILE 123          1HD1      ILE 123 -23.309   6.931 -11.565
  966   HD13  ILE 123          2HD1      ILE 123 -22.131   6.507 -12.798
  967    H    MET 124           H        MET 124 -24.973   7.500 -10.652
  968    HA   MET 124           HA       MET 124 -27.311   8.890 -11.829
  969    HB2  MET 124           2HB      MET 124 -25.852   6.673 -13.235
  970    HB3  MET 124           3HB      MET 124 -27.613   6.700 -13.271
  971    HG2  MET 124           2HG      MET 124 -27.393   7.987 -15.053
  972    HG3  MET 124           3HG      MET 124 -27.128   9.289 -13.910
  973    HE1  MET 124           3HE      MET 124 -25.228  10.863 -14.168
  974    HE2  MET 124           1HE      MET 124 -24.239  10.789 -15.640
  975    HE3  MET 124           2HE      MET 124 -26.017  10.737 -15.756
  976    H    PHE 125           H        PHE 125 -29.172   8.068 -11.637
  977    HA   PHE 125           HA       PHE 125 -29.645   6.150  -9.391
  978    HB2  PHE 125           2HB      PHE 125 -31.088   8.627 -10.331
  979    HB3  PHE 125           3HB      PHE 125 -32.041   7.319  -9.654
  980    HD1  PHE 125           HD1      PHE 125 -30.444   6.315  -7.421
  981    HD2  PHE 125           HD2      PHE 125 -31.251  10.332  -8.699
  982    HE1  PHE 125           HE1      PHE 125 -29.939   7.128  -5.130
  983    HE2  PHE 125           HE2      PHE 125 -30.762  11.152  -6.402
  984    HZ   PHE 125           HZ       PHE 125 -30.070   9.558  -4.628
  985    H    ILE 126           H        ILE 126 -29.202   4.414 -10.761
  986    HA   ILE 126           HA       ILE 126 -31.395   3.786 -12.684
  987    HB   ILE 126           HB       ILE 126 -28.798   2.297 -12.305
  988   HG12  ILE 126          2HG1      ILE 126 -29.737   4.321 -14.395
  989   HG13  ILE 126          3HG1      ILE 126 -28.430   4.545 -13.254
  990   HG21  ILE 126          1HG2      ILE 126 -29.469   0.905 -14.089
  991   HG22  ILE 126          2HG2      ILE 126 -31.006   1.096 -13.222
  992   HG23  ILE 126          3HG2      ILE 126 -30.712   2.035 -14.649
  993   HD11  ILE 126          3HD1      ILE 126 -27.246   2.602 -14.283
  994   HD12  ILE 126          1HD1      ILE 126 -28.486   2.593 -15.556
  995   HD13  ILE 126          2HD1      ILE 126 -27.460   4.032 -15.345
  996    H    LEU 127           H        LEU 127 -32.738   3.838 -10.817
  997    HA   LEU 127           HA       LEU 127 -32.481   1.646  -8.869
  998    HB2  LEU 127           2HB      LEU 127 -34.631   3.796  -9.025
  999    HB3  LEU 127           3HB      LEU 127 -34.318   2.668  -7.716
 1000    HG   LEU 127           HG       LEU 127 -32.497   4.937  -8.635
 1001   HD11  LEU 127          1HD1      LEU 127 -33.633   4.429  -5.858
 1002   HD12  LEU 127          2HD1      LEU 127 -32.552   5.726  -6.310
 1003   HD13  LEU 127          3HD1      LEU 127 -34.199   5.679  -6.994
 1004   HD21  LEU 127          3HD2      LEU 127 -31.982   2.680  -6.700
 1005   HD22  LEU 127          1HD2      LEU 127 -31.072   3.106  -8.172
 1006   HD23  LEU 127          2HD2      LEU 127 -31.011   4.154  -6.747
 1007    H    ASN 128           H        ASN 128 -32.414   0.014 -10.255
 1008    HA   ASN 128           HA       ASN 128 -34.351  -0.948 -12.045
 1009    HB2  ASN 128           2HB      ASN 128 -32.421  -2.386 -10.165
 1010    HB3  ASN 128           3HB      ASN 128 -33.413  -3.237 -11.329
 1011   HD21  ASN 128          2HD2      ASN 128 -30.860  -0.602 -11.278
 1012   HD22  ASN 128          1HD2      ASN 128 -30.212  -1.183 -12.794
 1013    H    PHE 129           H        PHE 129 -36.580  -0.947 -11.495
 1014    HA   PHE 129           HA       PHE 129 -37.337  -1.738  -8.808
 1015    HB2  PHE 129           2HB      PHE 129 -39.057  -0.888 -11.143
 1016    HB3  PHE 129           3HB      PHE 129 -39.589  -1.191  -9.484
 1017    HD1  PHE 129           HD1      PHE 129 -38.413   0.201  -7.596
 1018    HD2  PHE 129           HD2      PHE 129 -38.618   1.368 -11.738
 1019    HE1  PHE 129           HE1      PHE 129 -38.090   2.574  -6.939
 1020    HE2  PHE 129           HE2      PHE 129 -38.330   3.742 -11.076
 1021    HZ   PHE 129           HZ       PHE 129 -38.043   4.349  -8.684
 1022    H    GLU 130           H        GLU 130 -36.198  -3.924  -9.448
 1023    HA   GLU 130           HA       GLU 130 -37.985  -5.751 -10.881
 1024    HB2  GLU 130           2HB      GLU 130 -36.409  -7.518 -10.236
 1025    HB3  GLU 130           3HB      GLU 130 -35.737  -6.180 -11.194
 1026    HG2  GLU 130           2HG      GLU 130 -34.520  -5.321  -9.477
 1027    HG3  GLU 130           3HG      GLU 130 -35.517  -5.976  -8.206
 1028    H    VAL 131           H        VAL 131 -39.712  -6.138 -10.071
 1029    HA   VAL 131           HA       VAL 131 -40.632  -6.722  -7.410
 1030    HB   VAL 131           HB       VAL 131 -41.572  -7.465 -10.190
 1031   HG11  VAL 131          1HG1      VAL 131 -42.551  -9.127  -8.595
 1032   HG12  VAL 131          2HG1      VAL 131 -43.207  -7.760  -7.661
 1033   HG13  VAL 131          3HG1      VAL 131 -43.754  -8.057  -9.318
 1034   HG21  VAL 131          3HG2      VAL 131 -41.629  -5.045  -9.583
 1035   HG22  VAL 131          1HG2      VAL 131 -43.239  -5.719  -9.828
 1036   HG23  VAL 131          2HG2      VAL 131 -42.638  -5.435  -8.177
 1037    H    VAL 132           H        VAL 132 -39.757  -8.314  -6.143
 1038    HA   VAL 132           HA       VAL 132 -39.553 -11.027  -7.307
 1039    HB   VAL 132           HB       VAL 132 -37.347 -10.139  -7.681
 1040   HG11  VAL 132          1HG1      VAL 132 -37.195  -8.421  -5.935
 1041   HG12  VAL 132          2HG1      VAL 132 -37.115  -9.678  -4.684
 1042   HG13  VAL 132          3HG1      VAL 132 -35.816  -9.519  -5.883
 1043   HG21  VAL 132          3HG2      VAL 132 -36.024 -11.863  -6.641
 1044   HG22  VAL 132          1HG2      VAL 132 -37.245 -12.131  -5.385
 1045   HG23  VAL 132          2HG2      VAL 132 -37.600 -12.533  -7.084
 1046    H    MET 133           H        MET 133 -40.022 -12.643  -5.978
 1047    HA   MET 133           HA       MET 133 -39.973 -12.272  -3.045
 1048    HB2  MET 133           2HB      MET 133 -42.409 -13.359  -4.527
 1049    HB3  MET 133           3HB      MET 133 -42.135 -13.466  -2.785
 1050    HG2  MET 133           2HG      MET 133 -41.999 -10.935  -2.727
 1051    HG3  MET 133           3HG      MET 133 -42.486 -10.942  -4.422
 1052    HE1  MET 133           3HE      MET 133 -43.724 -12.962  -1.158
 1053    HE2  MET 133           1HE      MET 133 -43.523 -11.249  -0.719
 1054    HE3  MET 133           2HE      MET 133 -45.146 -11.971  -0.777
 1055    H    GLU 134           H        GLU 134 -39.710 -14.205  -1.878
 1056    HA   GLU 134           HA       GLU 134 -38.218 -16.290  -3.243
 1057    HB2  GLU 134           2HB      GLU 134 -39.183 -16.105  -0.361
 1058    HB3  GLU 134           3HB      GLU 134 -38.056 -17.307  -1.003
 1059    HG2  GLU 134           2HG      GLU 134 -36.514 -15.433  -1.678
 1060    HG3  GLU 134           3HG      GLU 134 -37.589 -14.298  -0.861
 1061    H    LYS 135           H        LYS 135 -38.678 -18.504  -3.390
 1062    HA   LYS 135           HA       LYS 135 -41.527 -19.374  -3.241
 1063    HB2  LYS 135           2HB      LYS 135 -39.489 -19.730  -5.479
 1064    HB3  LYS 135           3HB      LYS 135 -40.983 -20.649  -5.341
 1065    HG2  LYS 135           2HG      LYS 135 -42.305 -18.535  -5.432
 1066    HG3  LYS 135           3HG      LYS 135 -40.798 -17.615  -5.623
 1067    HD2  LYS 135           2HD      LYS 135 -40.309 -18.848  -7.721
 1068    HD3  LYS 135           3HD      LYS 135 -41.827 -19.756  -7.538
 1069    HE2  LYS 135           2HE      LYS 135 -43.101 -17.620  -7.602
 1070    HE3  LYS 135           3HE      LYS 135 -41.589 -16.721  -7.791
 1071    HZ1  LYS 135           HZ1      LYS 135 -42.666 -17.106  -9.935
 1072    HZ2  LYS 135           HZ2      LYS 135 -41.237 -17.893  -9.902
 1073    HZ3  LYS 135           HZ3      LYS 135 -42.635 -18.723  -9.726
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1 -29.232 -38.913 -49.740
    2    H2   MET   1           2H       MET   1 -28.809 -38.854 -48.162
    3    H3   MET   1           3H       MET   1 -27.660 -39.071 -49.305
    4    HA   MET   1           HA       MET   1 -27.597 -36.819 -48.477
    5    HB2  MET   1           2HB      MET   1 -26.973 -37.340 -50.852
    6    HB3  MET   1           3HB      MET   1 -28.616 -36.917 -51.347
    7    HG2  MET   1           2HG      MET   1 -28.260 -34.606 -50.503
    8    HG3  MET   1           3HG      MET   1 -26.660 -35.069 -49.922
    9    HE1  MET   1           3HE      MET   1 -28.593 -35.731 -53.392
   10    HE2  MET   1           1HE      MET   1 -28.868 -34.024 -52.962
   11    HE3  MET   1           2HE      MET   1 -27.856 -34.440 -54.360
   12    HA   PRO   2           HA       PRO   2 -31.509 -35.279 -47.131
   13    HB2  PRO   2           2HB      PRO   2 -30.214 -32.555 -47.282
   14    HB3  PRO   2           3HB      PRO   2 -31.146 -33.292 -45.942
   15    HG2  PRO   2           2HG      PRO   2 -28.453 -33.222 -45.814
   16    HG3  PRO   2           3HG      PRO   2 -29.313 -34.735 -45.373
   17    HD2  PRO   2           2HD      PRO   2 -27.978 -34.032 -48.005
   18    HD3  PRO   2           3HD      PRO   2 -27.832 -35.522 -47.024
   19    H    VAL   3           H        VAL   3 -30.062 -33.684 -49.929
   20    HA   VAL   3           HA       VAL   3 -30.894 -32.586 -51.719
   21    HB   VAL   3           HB       VAL   3 -31.009 -34.995 -52.104
   22   HG11  VAL   3          1HG1      VAL   3 -33.067 -36.179 -52.443
   23   HG12  VAL   3          2HG1      VAL   3 -32.985 -35.631 -50.767
   24   HG13  VAL   3          3HG1      VAL   3 -34.027 -34.783 -51.937
   25   HG21  VAL   3          3HG2      VAL   3 -32.950 -33.423 -53.820
   26   HG22  VAL   3          1HG2      VAL   3 -31.177 -33.350 -53.926
   27   HG23  VAL   3          2HG2      VAL   3 -32.026 -34.865 -54.270
   28    H    ARG   4           H        ARG   4 -31.789 -31.241 -49.634
   29    HA   ARG   4           HA       ARG   4 -33.220 -29.655 -48.880
   30    HB2  ARG   4           2HB      ARG   4 -34.083 -29.456 -51.785
   31    HB3  ARG   4           3HB      ARG   4 -34.306 -28.230 -50.534
   32    HG2  ARG   4           2HG      ARG   4 -31.834 -28.053 -50.266
   33    HG3  ARG   4           3HG      ARG   4 -31.623 -29.208 -51.597
   34    HD2  ARG   4           2HD      ARG   4 -32.880 -27.660 -53.108
   35    HD3  ARG   4           3HD      ARG   4 -33.045 -26.520 -51.776
   36    HE   ARG   4           HE       ARG   4 -30.803 -25.910 -51.950
   37   HH11  ARG   4          1HH1      ARG   4 -31.338 -28.583 -54.159
   38   HH12  ARG   4          2HH1      ARG   4 -29.807 -28.343 -54.956
   39   HH21  ARG   4          1HH2      ARG   4 -28.874 -25.666 -53.010
   40   HH22  ARG   4          2HH2      ARG   4 -28.455 -26.735 -54.317
   41    H    ARG   5           H        ARG   5 -34.286 -32.412 -48.788
   42    HA   ARG   5           HA       ARG   5 -37.201 -32.187 -48.929
   43    HB2  ARG   5           2HB      ARG   5 -35.371 -34.208 -47.564
   44    HB3  ARG   5           3HB      ARG   5 -37.128 -34.348 -47.644
   45    HG2  ARG   5           2HG      ARG   5 -37.075 -34.466 -50.095
   46    HG3  ARG   5           3HG      ARG   5 -35.335 -34.174 -50.101
   47    HD2  ARG   5           2HD      ARG   5 -35.684 -36.516 -50.440
   48    HD3  ARG   5           3HD      ARG   5 -34.964 -36.275 -48.840
   49    HE   ARG   5           HE       ARG   5 -37.859 -36.370 -48.700
   50   HH11  ARG   5          1HH1      ARG   5 -35.122 -38.531 -49.032
   51   HH12  ARG   5          2HH1      ARG   5 -35.987 -39.880 -48.346
   52   HH21  ARG   5          1HH2      ARG   5 -38.900 -38.126 -47.821
   53   HH22  ARG   5          2HH2      ARG   5 -38.071 -39.649 -47.683
   54    H    GLY   6           H        GLY   6 -38.657 -32.258 -47.171
   55    HA2  GLY   6           HA2      GLY   6 -39.544 -31.653 -45.117
   56    HA3  GLY   6           HA3      GLY   6 -37.922 -31.703 -44.434
   57    H    HIS   7           H        HIS   7 -38.748 -29.879 -43.180
   58    HA   HIS   7           HA       HIS   7 -38.104 -27.271 -44.428
   59    HB2  HIS   7           2HB      HIS   7 -40.540 -27.471 -44.663
   60    HB3  HIS   7           3HB      HIS   7 -40.700 -27.847 -42.948
   61    HD2  HIS   7           HD2      HIS   7 -40.831 -25.827 -41.263
   62    HE1  HIS   7           HE1      HIS   7 -40.125 -22.639 -44.010
   63    HE2  HIS   7           HE2      HIS   7 -40.803 -23.216 -41.623
   64    H    VAL   8           H        VAL   8 -37.364 -25.715 -42.997
   65    HA   VAL   8           HA       VAL   8 -37.065 -26.410 -40.118
   66    HB   VAL   8           HB       VAL   8 -34.812 -25.162 -41.740
   67   HG11  VAL   8          1HG1      VAL   8 -34.809 -24.549 -39.342
   68   HG12  VAL   8          2HG1      VAL   8 -34.928 -26.264 -38.890
   69   HG13  VAL   8          3HG1      VAL   8 -33.477 -25.640 -39.704
   70   HG21  VAL   8          3HG2      VAL   8 -33.587 -27.300 -41.376
   71   HG22  VAL   8          1HG2      VAL   8 -35.076 -28.031 -40.734
   72   HG23  VAL   8          2HG2      VAL   8 -34.981 -27.509 -42.433
   73    H    ALA   9           H        ALA   9 -37.531 -24.732 -38.771
   74    HA   ALA   9           HA       ALA   9 -38.776 -22.342 -39.761
   75    HB1  ALA   9           3HB      ALA   9 -37.733 -23.109 -36.992
   76    HB2  ALA   9           1HB      ALA   9 -38.843 -21.771 -37.325
   77    HB3  ALA   9           2HB      ALA   9 -39.362 -23.436 -37.628
   78    HA   PRO  10           HA       PRO  10 -35.340 -19.560 -40.226
   79    HB2  PRO  10           2HB      PRO  10 -36.214 -17.165 -39.148
   80    HB3  PRO  10           3HB      PRO  10 -36.673 -17.825 -40.738
   81    HG2  PRO  10           2HG      PRO  10 -38.195 -18.039 -38.117
   82    HG3  PRO  10           3HG      PRO  10 -38.835 -17.606 -39.734
   83    HD2  PRO  10           2HD      PRO  10 -39.083 -20.104 -38.740
   84    HD3  PRO  10           3HD      PRO  10 -38.708 -19.857 -40.469
   85    H    GLN  11           H        GLN  11 -33.677 -20.242 -39.114
   86    HA   GLN  11           HA       GLN  11 -33.615 -20.670 -36.345
   87    HB2  GLN  11           2HB      GLN  11 -31.402 -21.418 -36.620
   88    HB3  GLN  11           3HB      GLN  11 -32.300 -21.895 -38.048
   89    HG2  GLN  11           2HG      GLN  11 -30.297 -19.601 -37.827
   90    HG3  GLN  11           3HG      GLN  11 -30.031 -21.157 -38.598
   91   HE21  GLN  11          2HE2      GLN  11 -30.158 -18.159 -39.565
   92   HE22  GLN  11          1HE2      GLN  11 -31.100 -18.342 -41.046
   93    H    ASN  12           H        ASN  12 -32.773 -17.737 -38.065
   94    HA   ASN  12           HA       ASN  12 -31.017 -16.624 -36.042
   95    HB2  ASN  12           2HB      ASN  12 -32.529 -15.479 -38.437
   96    HB3  ASN  12           3HB      ASN  12 -31.645 -14.452 -37.313
   97   HD21  ASN  12          2HD2      ASN  12 -30.586 -13.980 -39.516
   98   HD22  ASN  12          1HD2      ASN  12 -29.158 -14.949 -39.855
   99    H    THR  13           H        THR  13 -34.476 -16.065 -36.820
  100    HA   THR  13           HA       THR  13 -34.909 -14.383 -34.481
  101    HB   THR  13           HB       THR  13 -36.100 -14.342 -36.733
  102    HG1  THR  13           HG1      THR  13 -37.685 -14.317 -34.373
  103   HG21  THR  13          1HG2      THR  13 -38.121 -15.602 -37.005
  104   HG22  THR  13          2HG2      THR  13 -36.761 -16.716 -36.758
  105   HG23  THR  13          3HG2      THR  13 -37.894 -16.417 -35.435
  106    H    PHE  14           H        PHE  14 -35.467 -17.823 -35.264
  107    HA   PHE  14           HA       PHE  14 -36.863 -18.581 -32.906
  108    HB2  PHE  14           2HB      PHE  14 -36.517 -19.934 -34.947
  109    HB3  PHE  14           3HB      PHE  14 -34.812 -20.079 -34.574
  110    HD1  PHE  14           HD2      PHE  14 -38.235 -21.073 -33.505
  111    HD2  PHE  14           HD1      PHE  14 -34.002 -21.654 -32.901
  112    HE1  PHE  14           HE2      PHE  14 -38.705 -23.090 -32.129
  113    HE2  PHE  14           HE1      PHE  14 -34.476 -23.667 -31.525
  114    HZ   PHE  14           HZ       PHE  14 -36.827 -24.387 -31.138
  115    H    LEU  15           H        LEU  15 -33.379 -18.233 -33.583
  116    HA   LEU  15           HA       LEU  15 -32.577 -18.857 -30.846
  117    HB2  LEU  15           2HB      LEU  15 -30.969 -19.205 -32.594
  118    HB3  LEU  15           3HB      LEU  15 -31.093 -17.523 -33.127
  119    HG   LEU  15           HG       LEU  15 -30.090 -16.719 -31.069
  120   HD11  LEU  15          1HD1      LEU  15 -29.796 -19.636 -30.213
  121   HD12  LEU  15          2HD1      LEU  15 -29.110 -18.212 -29.379
  122   HD13  LEU  15          3HD1      LEU  15 -30.844 -18.442 -29.440
  123   HD21  LEU  15          3HD2      LEU  15 -28.476 -18.994 -32.282
  124   HD22  LEU  15          1HD2      LEU  15 -28.625 -17.349 -32.940
  125   HD23  LEU  15          2HD2      LEU  15 -27.824 -17.605 -31.380
  126    H    ASP  16           H        ASP  16 -32.991 -15.706 -32.583
  127    HA   ASP  16           HA       ASP  16 -32.435 -13.937 -30.567
  128    HB2  ASP  16           2HB      ASP  16 -33.202 -13.416 -32.910
  129    HB3  ASP  16           3HB      ASP  16 -34.861 -13.627 -32.347
  130    H    THR  17           H        THR  17 -35.405 -15.802 -30.834
  131    HA   THR  17           HA       THR  17 -36.799 -14.628 -28.574
  132    HB   THR  17           HB       THR  17 -37.012 -17.452 -29.708
  133    HG1  THR  17           HG1      THR  17 -37.500 -15.851 -31.222
  134   HG21  THR  17          1HG2      THR  17 -38.920 -15.870 -27.934
  135   HG22  THR  17          2HG2      THR  17 -39.317 -17.394 -28.760
  136   HG23  THR  17          3HG2      THR  17 -38.071 -17.374 -27.506
  137    H    ILE  18           H        ILE  18 -34.429 -17.275 -28.791
  138    HA   ILE  18           HA       ILE  18 -34.557 -17.953 -25.953
  139    HB   ILE  18           HB       ILE  18 -32.359 -18.512 -27.954
  140   HG12  ILE  18          2HG1      ILE  18 -34.403 -19.474 -28.839
  141   HG13  ILE  18          3HG1      ILE  18 -33.229 -20.681 -28.387
  142   HG21  ILE  18          1HG2      ILE  18 -31.832 -20.452 -26.444
  143   HG22  ILE  18          2HG2      ILE  18 -31.540 -18.868 -25.731
  144   HG23  ILE  18          3HG2      ILE  18 -32.987 -19.780 -25.267
  145   HD11  ILE  18          3HD1      ILE  18 -35.693 -19.878 -26.738
  146   HD12  ILE  18          1HD1      ILE  18 -35.572 -21.308 -27.780
  147   HD13  ILE  18          2HD1      ILE  18 -34.561 -21.190 -26.331
  148    H    ILE  19           H        ILE  19 -32.582 -15.799 -28.036
  149    HA   ILE  19           HA       ILE  19 -30.828 -14.919 -26.022
  150    HB   ILE  19           HB       ILE  19 -31.982 -13.164 -28.210
  151   HG12  ILE  19          2HG1      ILE  19 -30.947 -14.978 -29.374
  152   HG13  ILE  19          3HG1      ILE  19 -29.871 -13.605 -29.453
  153   HG21  ILE  19          1HG2      ILE  19 -30.914 -11.874 -26.443
  154   HG22  ILE  19          2HG2      ILE  19 -29.510 -12.948 -26.440
  155   HG23  ILE  19          3HG2      ILE  19 -29.833 -11.902 -27.841
  156   HD11  ILE  19          3HD1      ILE  19 -28.519 -14.651 -27.590
  157   HD12  ILE  19          1HD1      ILE  19 -29.600 -16.066 -27.695
  158   HD13  ILE  19          2HD1      ILE  19 -28.608 -15.619 -29.091
  159    H    ARG  20           H        ARG  20 -34.112 -13.533 -26.923
  160    HA   ARG  20           HA       ARG  20 -34.341 -11.780 -24.706
  161    HB2  ARG  20           2HB      ARG  20 -36.218 -13.118 -26.662
  162    HB3  ARG  20           3HB      ARG  20 -36.926 -12.600 -25.147
  163    HG2  ARG  20           2HG      ARG  20 -37.249 -10.685 -26.173
  164    HG3  ARG  20           3HG      ARG  20 -35.600 -10.351 -25.685
  165    HD2  ARG  20           2HD      ARG  20 -36.501 -11.367 -28.409
  166    HD3  ARG  20           3HD      ARG  20 -36.148  -9.686 -28.028
  167    HE   ARG  20           HE       ARG  20 -34.280 -11.696 -28.782
  168   HH11  ARG  20          2HH1      ARG  20 -34.287  -9.136 -26.359
  169   HH12  ARG  20          1HH1      ARG  20 -32.538  -9.004 -26.483
  170   HH21  ARG  20          1HH2      ARG  20 -32.311 -10.899 -29.295
  171   HH22  ARG  20          2HH2      ARG  20 -31.490  -9.851 -28.136
  172    H    LYS  21           H        LYS  21 -34.810 -15.238 -24.808
  173    HA   LYS  21           HA       LYS  21 -36.043 -15.497 -22.199
  174    HB2  LYS  21           2HB      LYS  21 -35.690 -17.293 -24.143
  175    HB3  LYS  21           3HB      LYS  21 -34.189 -17.620 -23.257
  176    HG2  LYS  21           2HG      LYS  21 -35.734 -19.180 -22.452
  177    HG3  LYS  21           3HG      LYS  21 -35.611 -17.962 -21.177
  178    HD2  LYS  21           2HD      LYS  21 -37.757 -16.933 -22.002
  179    HD3  LYS  21           3HD      LYS  21 -37.799 -18.123 -23.306
  180    HE2  LYS  21           2HE      LYS  21 -39.315 -18.872 -21.624
  181    HE3  LYS  21           3HE      LYS  21 -37.924 -19.958 -21.618
  182    HZ1  LYS  21           HZ1      LYS  21 -37.090 -18.761 -19.657
  183    HZ2  LYS  21           HZ2      LYS  21 -38.363 -17.734 -19.688
  184    HZ3  LYS  21           HZ3      LYS  21 -38.594 -19.314 -19.365
  185    H    PHE  22           H        PHE  22 -32.579 -15.526 -23.166
  186    HA   PHE  22           HA       PHE  22 -31.901 -15.403 -20.263
  187    HB2  PHE  22           2HB      PHE  22 -29.804 -16.320 -20.685
  188    HB3  PHE  22           3HB      PHE  22 -31.013 -17.302 -21.471
  189    HD1  PHE  22           HD2      PHE  22 -28.351 -14.718 -22.116
  190    HD2  PHE  22           HD1      PHE  22 -30.778 -17.878 -23.757
  191    HE1  PHE  22           HE2      PHE  22 -26.972 -14.705 -24.169
  192    HE2  PHE  22           HE1      PHE  22 -29.371 -17.881 -25.809
  193    HZ   PHE  22           HZ       PHE  22 -27.465 -16.298 -26.013
  194    H    GLU  23           H        GLU  23 -32.266 -13.138 -22.581
  195    HA   GLU  23           HA       GLU  23 -30.078 -11.628 -22.884
  196    HB2  GLU  23           2HB      GLU  23 -32.248 -11.251 -23.985
  197    HB3  GLU  23           3HB      GLU  23 -32.966 -10.772 -22.472
  198    HG2  GLU  23           2HG      GLU  23 -32.723  -8.841 -23.771
  199    HG3  GLU  23           3HG      GLU  23 -31.573  -8.712 -22.465
  200    H    GLY  24           H        GLY  24 -32.000 -11.617 -19.912
  201    HA2  GLY  24           HA2      GLY  24 -31.713 -10.688 -17.830
  202    HA3  GLY  24           HA3      GLY  24 -30.058 -10.293 -18.290
  203    H    GLN  25           H        GLN  25 -31.844  -8.689 -20.541
  204    HA   GLN  25           HA       GLN  25 -31.970  -6.153 -18.996
  205    HB2  GLN  25           2HB      GLN  25 -32.018  -6.554 -22.009
  206    HB3  GLN  25           3HB      GLN  25 -31.937  -5.028 -21.136
  207    HG2  GLN  25           2HG      GLN  25 -29.745  -5.729 -20.138
  208    HG3  GLN  25           3HG      GLN  25 -29.783  -7.183 -21.138
  209   HE21  GLN  25          2HE2      GLN  25 -29.291  -7.003 -23.439
  210   HE22  GLN  25          1HE2      GLN  25 -28.751  -5.458 -24.093
  211    H    SER  26           H        SER  26 -34.086  -8.575 -19.801
  212    HA   SER  26           HA       SER  26 -36.479  -7.057 -20.392
  213    HB2  SER  26           2HB      SER  26 -36.218  -9.850 -19.220
  214    HB3  SER  26           3HB      SER  26 -37.629  -9.160 -20.046
  215    HG   SER  26           HG       SER  26 -36.329 -10.503 -21.419
  216    H    ARG  27           H        ARG  27 -34.683  -7.398 -17.533
  217    HA   ARG  27           HA       ARG  27 -36.725  -7.159 -15.490
  218    HB2  ARG  27           2HB      ARG  27 -33.788  -6.406 -15.539
  219    HB3  ARG  27           3HB      ARG  27 -34.857  -6.237 -14.143
  220    HG2  ARG  27           2HG      ARG  27 -35.422  -8.814 -14.609
  221    HG3  ARG  27           3HG      ARG  27 -33.845  -8.754 -15.455
  222    HD2  ARG  27           2HD      ARG  27 -33.165  -7.496 -13.230
  223    HD3  ARG  27           3HD      ARG  27 -34.579  -8.299 -12.544
  224    HE   ARG  27           HE       ARG  27 -33.305 -10.391 -13.745
  225   HH11  ARG  27          2HH1      ARG  27 -32.151  -8.082 -11.354
  226   HH12  ARG  27          1HH1      ARG  27 -30.827  -9.125 -10.888
  227   HH21  ARG  27          1HH2      ARG  27 -31.653 -11.681 -13.026
  228   HH22  ARG  27          2HH2      ARG  27 -30.587 -11.113 -11.776
  229    H    LYS  28           H        LYS  28 -37.075  -5.253 -14.206
  230    HA   LYS  28           HA       LYS  28 -37.743  -2.981 -16.000
  231    HB2  LYS  28           2HB      LYS  28 -38.882  -2.617 -13.411
  232    HB3  LYS  28           3HB      LYS  28 -39.692  -2.788 -14.937
  233    HG2  LYS  28           2HG      LYS  28 -38.795  -5.141 -13.261
  234    HG3  LYS  28           3HG      LYS  28 -40.321  -4.339 -13.048
  235    HD2  LYS  28           2HD      LYS  28 -40.943  -4.884 -15.430
  236    HD3  LYS  28           3HD      LYS  28 -39.457  -5.834 -15.547
  237    HE2  LYS  28           2HE      LYS  28 -40.271  -7.134 -13.522
  238    HE3  LYS  28           3HE      LYS  28 -41.793  -6.249 -13.622
  239    HZ1  LYS  28           HZ1      LYS  28 -42.108  -7.169 -15.865
  240    HZ2  LYS  28           HZ2      LYS  28 -40.698  -7.992 -15.775
  241    HZ3  LYS  28           HZ3      LYS  28 -41.935  -8.380 -14.786
  242    H    PHE  29           H        PHE  29 -36.951  -0.993 -15.848
  243    HA   PHE  29           HA       PHE  29 -35.702   0.098 -13.521
  244    HB2  PHE  29           2HB      PHE  29 -33.380   0.159 -14.197
  245    HB3  PHE  29           3HB      PHE  29 -33.896  -1.497 -14.084
  246    HD1  PHE  29           HD1      PHE  29 -32.739   1.133 -16.388
  247    HD2  PHE  29           HD2      PHE  29 -33.964  -2.983 -15.988
  248    HE1  PHE  29           HE1      PHE  29 -31.688   0.597 -18.579
  249    HE2  PHE  29           HE2      PHE  29 -32.908  -3.511 -18.169
  250    HZ   PHE  29           HZ       PHE  29 -31.764  -1.722 -19.465
  251    H    ILE  30           H        ILE  30 -34.749   2.126 -13.789
  252    HA   ILE  30           HA       ILE  30 -35.316   3.552 -16.339
  253    HB   ILE  30           HB       ILE  30 -35.758   5.584 -14.811
  254   HG12  ILE  30          2HG1      ILE  30 -36.837   5.217 -12.693
  255   HG13  ILE  30          3HG1      ILE  30 -36.600   3.473 -12.792
  256   HG21  ILE  30          1HG2      ILE  30 -37.797   3.354 -15.048
  257   HG22  ILE  30          2HG2      ILE  30 -38.141   5.090 -14.837
  258   HG23  ILE  30          3HG2      ILE  30 -37.332   4.515 -16.311
  259   HD11  ILE  30          3HD1      ILE  30 -34.329   5.505 -12.657
  260   HD12  ILE  30          1HD1      ILE  30 -35.004   4.631 -11.272
  261   HD13  ILE  30          2HD1      ILE  30 -34.178   3.729 -12.543
  262    H    ILE  31           H        ILE  31 -34.155   5.653 -16.400
  263    HA   ILE  31           HA       ILE  31 -31.475   5.548 -15.112
  264    HB   ILE  31           HB       ILE  31 -32.001   6.659 -17.876
  265   HG12  ILE  31          2HG1      ILE  31 -32.549   4.230 -17.993
  266   HG13  ILE  31          3HG1      ILE  31 -31.151   4.695 -18.971
  267   HG21  ILE  31          1HG2      ILE  31 -29.476   5.886 -16.365
  268   HG22  ILE  31          2HG2      ILE  31 -29.524   6.465 -18.052
  269   HG23  ILE  31          3HG2      ILE  31 -30.050   7.517 -16.728
  270   HD11  ILE  31          3HD1      ILE  31 -30.811   3.612 -16.181
  271   HD12  ILE  31          1HD1      ILE  31 -30.885   2.555 -17.615
  272   HD13  ILE  31          2HD1      ILE  31 -29.589   3.758 -17.453
  273    H    ALA  32           H        ALA  32 -31.395   7.154 -13.784
  274    HA   ALA  32           HA       ALA  32 -32.611   9.762 -14.595
  275    HB1  ALA  32           3HB      ALA  32 -32.827   8.402 -11.899
  276    HB2  ALA  32           1HB      ALA  32 -33.161  10.123 -12.138
  277    HB3  ALA  32           2HB      ALA  32 -34.128   8.887 -12.984
  278    H    ASN  33           H        ASN  33 -31.745  11.697 -13.888
  279    HA   ASN  33           HA       ASN  33 -28.810  11.533 -13.461
  280    HB2  ASN  33           2HB      ASN  33 -28.938  14.050 -13.657
  281    HB3  ASN  33           3HB      ASN  33 -29.312  13.117 -15.085
  282   HD21  ASN  33          2HD2      ASN  33 -30.087  15.364 -15.649
  283   HD22  ASN  33          1HD2      ASN  33 -31.785  15.656 -15.308
  284    H    ALA  34           H        ALA  34 -28.238  10.987 -11.438
  285    HA   ALA  34           HA       ALA  34 -29.622  11.945  -9.082
  286    HB1  ALA  34           3HB      ALA  34 -26.916  10.580  -9.334
  287    HB2  ALA  34           1HB      ALA  34 -27.917  10.681  -7.882
  288    HB3  ALA  34           2HB      ALA  34 -28.470   9.724  -9.266
  289    H    ARG  35           H        ARG  35 -27.529  13.545 -11.076
  290    HA   ARG  35           HA       ARG  35 -26.236  15.204  -8.958
  291    HB2  ARG  35           2HB      ARG  35 -25.788  15.113 -11.962
  292    HB3  ARG  35           3HB      ARG  35 -24.864  16.086 -10.826
  293    HG2  ARG  35           2HG      ARG  35 -24.920  13.034 -10.867
  294    HG3  ARG  35           3HG      ARG  35 -23.685  14.065 -11.564
  295    HD2  ARG  35           2HD      ARG  35 -22.681  13.495  -9.597
  296    HD3  ARG  35           3HD      ARG  35 -23.390  15.045  -9.175
  297    HE   ARG  35           HE       ARG  35 -24.569  12.347  -8.469
  298   HH11  ARG  35          1HH2      ARG  35 -23.923  15.632  -7.393
  299   HH12  ARG  35          2HH2      ARG  35 -24.533  15.289  -5.799
  300   HH21  ARG  35          1HH1      ARG  35 -25.248  11.990  -6.512
  301   HH22  ARG  35          2HH1      ARG  35 -25.312  13.266  -5.307
  302    H    VAL  36           H        VAL  36 -29.142  15.351 -10.482
  303    HA   VAL  36           HA       VAL  36 -29.175  18.337 -10.565
  304    HB   VAL  36           HB       VAL  36 -29.734  16.847 -12.669
  305   HG11  VAL  36          1HG1      VAL  36 -32.099  16.451 -13.017
  306   HG12  VAL  36          2HG1      VAL  36 -31.546  15.511 -11.613
  307   HG13  VAL  36          3HG1      VAL  36 -32.493  17.001 -11.400
  308   HG21  VAL  36          3HG2      VAL  36 -31.429  19.238 -11.916
  309   HG22  VAL  36          1HG2      VAL  36 -29.783  19.272 -12.607
  310   HG23  VAL  36          2HG2      VAL  36 -31.115  18.595 -13.552
  311    H    GLU  37           H        GLU  37 -30.683  19.436  -9.318
  312    HA   GLU  37           HA       GLU  37 -31.440  18.283  -6.888
  313    HB2  GLU  37           2HB      GLU  37 -32.657  20.333  -6.466
  314    HB3  GLU  37           3HB      GLU  37 -31.115  20.667  -7.256
  315    HG2  GLU  37           2HG      GLU  37 -32.320  20.957  -9.434
  316    HG3  GLU  37           3HG      GLU  37 -33.851  20.665  -8.609
  317    H    ASN  38           H        ASN  38 -33.286  18.197  -9.822
  318    HA   ASN  38           HA       ASN  38 -35.782  17.368  -8.498
  319    HB2  ASN  38           2HB      ASN  38 -35.617  18.982 -10.450
  320    HB3  ASN  38           3HB      ASN  38 -35.156  17.614 -11.467
  321   HD21  ASN  38          2HD2      ASN  38 -37.748  18.677  -9.178
  322   HD22  ASN  38          1HD2      ASN  38 -39.034  17.917 -10.102
  323    H    CYS  39           H        CYS  39 -33.008  15.665  -9.460
  324    HA   CYS  39           HA       CYS  39 -32.540  13.528 -10.101
  325    HB2  CYS  39           2HB      CYS  39 -34.525  13.120  -7.846
  326    HB3  CYS  39           3HB      CYS  39 -33.351  11.916  -8.408
  327    HG   CYS  39           HG       CYS  39 -32.452  13.031  -6.165
  328    H    ALA  40           H        ALA  40 -33.860  14.066 -12.258
  329    HA   ALA  40           HA       ALA  40 -36.281  12.386 -12.411
  330    HB1  ALA  40           3HB      ALA  40 -36.622  14.734 -12.858
  331    HB2  ALA  40           1HB      ALA  40 -35.428  14.684 -14.190
  332    HB3  ALA  40           2HB      ALA  40 -36.948  13.776 -14.287
  333    H    VAL  41           H        VAL  41 -36.893  11.312 -14.288
  334    HA   VAL  41           HA       VAL  41 -34.974   9.353 -15.111
  335    HB   VAL  41           HB       VAL  41 -37.942   9.742 -15.636
  336   HG11  VAL  41          1HG1      VAL  41 -37.044   8.266 -17.404
  337   HG12  VAL  41          2HG1      VAL  41 -36.196   7.314 -16.171
  338   HG13  VAL  41          3HG1      VAL  41 -37.971   7.327 -16.238
  339   HG21  VAL  41          3HG2      VAL  41 -36.458   7.862 -13.740
  340   HG22  VAL  41          1HG2      VAL  41 -37.353   9.314 -13.256
  341   HG23  VAL  41          2HG2      VAL  41 -38.221   7.961 -13.969
  342    H    ILE  42           H        ILE  42 -33.530  10.355 -16.422
  343    HA   ILE  42           HA       ILE  42 -34.186  11.826 -18.837
  344    HB   ILE  42           HB       ILE  42 -31.778  11.626 -19.311
  345   HG12  ILE  42          2HG1      ILE  42 -31.599   9.973 -16.747
  346   HG13  ILE  42          3HG1      ILE  42 -31.414   9.324 -18.382
  347   HG21  ILE  42          1HG2      ILE  42 -32.735  13.381 -17.767
  348   HG22  ILE  42          2HG2      ILE  42 -32.258  12.363 -16.390
  349   HG23  ILE  42          3HG2      ILE  42 -31.029  13.025 -17.485
  350   HD11  ILE  42          3HD1      ILE  42 -29.454  10.840 -18.697
  351   HD12  ILE  42          1HD1      ILE  42 -29.590  11.279 -16.966
  352   HD13  ILE  42          2HD1      ILE  42 -29.263   9.603 -17.438
  353    H    TYR  43           H        TYR  43 -33.879   8.446 -18.060
  354    HA   TYR  43           HA       TYR  43 -34.913   7.738 -20.714
  355    HB2  TYR  43           2HB      TYR  43 -32.321   7.801 -20.929
  356    HB3  TYR  43           3HB      TYR  43 -32.332   6.358 -19.959
  357    HD1  TYR  43           HD1      TYR  43 -33.427   7.834 -23.177
  358    HD2  TYR  43           HD2      TYR  43 -32.953   4.205 -20.884
  359    HE1  TYR  43           HE1      TYR  43 -33.785   6.481 -25.239
  360    HE2  TYR  43           HE2      TYR  43 -33.342   2.857 -22.943
  361    HH   TYR  43           HH       TYR  43 -33.844   4.376 -26.151
  362    H    CYS  44           H        CYS  44 -35.595   5.444 -20.902
  363    HA   CYS  44           HA       CYS  44 -35.967   4.101 -18.310
  364    HB2  CYS  44           2HB      CYS  44 -38.477   4.094 -18.671
  365    HB3  CYS  44           3HB      CYS  44 -37.773   5.666 -18.259
  366    HG   CYS  44           HG       CYS  44 -38.296   4.557 -21.325
  367    H    ASN  45           H        ASN  45 -36.433   1.896 -18.378
  368    HA   ASN  45           HA       ASN  45 -35.948   0.646 -20.993
  369    HB2  ASN  45           2HB      ASN  45 -34.779  -0.019 -18.859
  370    HB3  ASN  45           3HB      ASN  45 -36.285  -0.768 -18.331
  371   HD21  ASN  45          1HD2      ASN  45 -35.871  -3.019 -18.559
  372   HD22  ASN  45          2HD2      ASN  45 -35.197  -3.707 -19.997
  373    H    ASP  46           H        ASP  46 -37.158  -1.043 -21.884
  374    HA   ASP  46           HA       ASP  46 -40.026  -0.673 -21.919
  375    HB2  ASP  46           2HB      ASP  46 -38.350  -3.028 -22.866
  376    HB3  ASP  46           3HB      ASP  46 -40.054  -2.764 -23.246
  377    H    GLY  47           H        GLY  47 -37.902  -2.801 -20.037
  378    HA2  GLY  47           HA2      GLY  47 -39.726  -4.488 -18.750
  379    HA3  GLY  47           HA3      GLY  47 -38.286  -3.795 -18.003
  380    H    PHE  48           H        PHE  48 -38.962  -1.031 -17.828
  381    HA   PHE  48           HA       PHE  48 -40.755  -1.014 -15.558
  382    HB2  PHE  48           2HB      PHE  48 -39.627   0.926 -15.296
  383    HB3  PHE  48           3HB      PHE  48 -39.048   0.916 -16.951
  384    HD1  PHE  48           HD2      PHE  48 -41.888   1.998 -14.766
  385    HD2  PHE  48           HD1      PHE  48 -40.099   2.267 -18.683
  386    HE1  PHE  48           HE2      PHE  48 -43.681   3.545 -15.488
  387    HE2  PHE  48           HE1      PHE  48 -41.901   3.798 -19.402
  388    HZ   PHE  48           HZ       PHE  48 -43.721   4.408 -17.825
  389    H    CYS  49           H        CYS  49 -41.168  -0.432 -19.048
  390    HA   CYS  49           HA       CYS  49 -43.808   0.689 -18.939
  391    HB2  CYS  49           2HB      CYS  49 -42.114   0.754 -20.872
  392    HB3  CYS  49           3HB      CYS  49 -42.667  -0.887 -21.272
  393    HG   CYS  49           HG       CYS  49 -45.247  -0.241 -21.364
  394    H    GLU  50           H        GLU  50 -42.579  -2.664 -19.079
  395    HA   GLU  50           HA       GLU  50 -45.261  -3.852 -19.221
  396    HB2  GLU  50           2HB      GLU  50 -42.579  -5.101 -18.504
  397    HB3  GLU  50           3HB      GLU  50 -44.087  -5.967 -18.820
  398    HG2  GLU  50           2HG      GLU  50 -44.146  -4.945 -21.123
  399    HG3  GLU  50           3HG      GLU  50 -42.553  -4.259 -20.822
  400    H    LEU  51           H        LEU  51 -43.017  -2.935 -16.639
  401    HA   LEU  51           HA       LEU  51 -44.261  -4.300 -14.486
  402    HB2  LEU  51           2HB      LEU  51 -42.041  -3.258 -14.441
  403    HB3  LEU  51           3HB      LEU  51 -42.736  -1.671 -14.590
  404    HG   LEU  51           HG       LEU  51 -43.902  -1.856 -12.447
  405   HD11  LEU  51          1HD1      LEU  51 -44.056  -4.282 -12.181
  406   HD12  LEU  51          2HD1      LEU  51 -42.288  -4.393 -12.026
  407   HD13  LEU  51          3HD1      LEU  51 -43.241  -3.520 -10.812
  408   HD21  LEU  51          3HD2      LEU  51 -41.783  -0.702 -12.648
  409   HD22  LEU  51          1HD2      LEU  51 -41.968  -1.469 -11.062
  410   HD23  LEU  51          2HD2      LEU  51 -40.913  -2.215 -12.283
  411    H    CYS  52           H        CYS  52 -44.666  -0.853 -15.467
  412    HA   CYS  52           HA       CYS  52 -47.042  -0.649 -13.706
  413    HB2  CYS  52           2HB      CYS  52 -45.551   1.481 -15.290
  414    HB3  CYS  52           3HB      CYS  52 -46.776   1.743 -14.026
  415    HG   CYS  52           HG       CYS  52 -45.475   0.571 -12.091
  416    H    GLY  53           H        GLY  53 -46.411  -1.046 -17.105
  417    HA2  GLY  53           HA2      GLY  53 -47.908  -1.483 -18.805
  418    HA3  GLY  53           HA3      GLY  53 -49.254  -1.206 -17.706
  419    H    TYR  54           H        TYR  54 -47.084   1.504 -17.803
  420    HA   TYR  54           HA       TYR  54 -49.112   3.060 -19.290
  421    HB2  TYR  54           2HB      TYR  54 -46.825   3.826 -17.463
  422    HB3  TYR  54           3HB      TYR  54 -47.707   5.002 -18.418
  423    HD1  TYR  54           HD1      TYR  54 -50.029   5.591 -18.018
  424    HD2  TYR  54           HD2      TYR  54 -47.928   2.803 -15.499
  425    HE1  TYR  54           HE1      TYR  54 -51.746   5.901 -16.246
  426    HE2  TYR  54           HE2      TYR  54 -49.643   3.117 -13.710
  427    HH   TYR  54           HH       TYR  54 -52.437   5.328 -14.148
  428    H    SER  55           H        SER  55 -46.227   4.681 -19.587
  429    HA   SER  55           HA       SER  55 -45.245   3.593 -22.099
  430    HB2  SER  55           2HB      SER  55 -47.261   4.688 -22.939
  431    HB3  SER  55           3HB      SER  55 -46.855   6.179 -22.073
  432    HG   SER  55           HG       SER  55 -46.253   6.119 -24.355
  433    H    ARG  56           H        ARG  56 -43.337   4.654 -22.746
  434    HA   ARG  56           HA       ARG  56 -41.565   5.818 -20.790
  435    HB2  ARG  56           2HB      ARG  56 -41.572   6.150 -23.837
  436    HB3  ARG  56           3HB      ARG  56 -40.230   6.498 -22.751
  437    HG2  ARG  56           2HG      ARG  56 -40.276   4.005 -22.093
  438    HG3  ARG  56           3HG      ARG  56 -41.406   3.765 -23.438
  439    HD2  ARG  56           2HD      ARG  56 -39.769   4.731 -25.014
  440    HD3  ARG  56           3HD      ARG  56 -38.664   5.061 -23.672
  441    HE   ARG  56           HE       ARG  56 -39.450   2.228 -24.102
  442   HH11  ARG  56          2HH1      ARG  56 -36.951   4.645 -24.562
  443   HH12  ARG  56          1HH1      ARG  56 -35.740   3.449 -24.935
  444   HH21  ARG  56          1HH2      ARG  56 -37.925   0.795 -24.674
  445   HH22  ARG  56          2HH2      ARG  56 -36.283   1.313 -25.023
  446    H    ALA  57           H        ALA  57 -43.762   7.379 -23.120
  447    HA   ALA  57           HA       ALA  57 -42.946  10.073 -22.660
  448    HB1  ALA  57           3HB      ALA  57 -44.251   9.301 -24.612
  449    HB2  ALA  57           1HB      ALA  57 -45.636   8.941 -23.552
  450    HB3  ALA  57           2HB      ALA  57 -45.084  10.617 -23.764
  451    H    GLU  58           H        GLU  58 -44.831   7.947 -20.637
  452    HA   GLU  58           HA       GLU  58 -46.073  10.087 -19.056
  453    HB2  GLU  58           2HB      GLU  58 -46.025   7.083 -18.618
  454    HB3  GLU  58           3HB      GLU  58 -47.012   8.238 -17.758
  455    HG2  GLU  58           2HG      GLU  58 -47.245   7.934 -20.784
  456    HG3  GLU  58           3HG      GLU  58 -48.073   6.864 -19.693
  457    H    VAL  59           H        VAL  59 -43.064   8.326 -19.049
  458    HA   VAL  59           HA       VAL  59 -42.448   9.269 -16.273
  459    HB   VAL  59           HB       VAL  59 -40.545   7.656 -16.343
  460   HG11  VAL  59          1HG1      VAL  59 -42.668   7.264 -15.121
  461   HG12  VAL  59          2HG1      VAL  59 -43.331   6.455 -16.555
  462   HG13  VAL  59          3HG1      VAL  59 -41.923   5.771 -15.701
  463   HG21  VAL  59          3HG2      VAL  59 -41.983   6.396 -18.675
  464   HG22  VAL  59          1HG2      VAL  59 -40.430   7.268 -18.777
  465   HG23  VAL  59          2HG2      VAL  59 -40.552   5.786 -17.821
  466    H    MET  60           H        MET  60 -41.590   9.783 -19.586
  467    HA   MET  60           HA       MET  60 -39.014  10.554 -19.581
  468    HB2  MET  60           2HB      MET  60 -41.449  11.475 -21.079
  469    HB3  MET  60           3HB      MET  60 -40.025  12.497 -21.213
  470    HG2  MET  60           2HG      MET  60 -40.002   9.534 -21.825
  471    HG3  MET  60           3HG      MET  60 -40.217  10.815 -23.010
  472    HE1  MET  60           3HE      MET  60 -36.330   9.078 -21.636
  473    HE2  MET  60           1HE      MET  60 -37.708   9.060 -20.513
  474    HE3  MET  60           2HE      MET  60 -37.863   8.323 -22.123
  475    H    GLN  61           H        GLN  61 -37.946  11.605 -18.176
  476    HA   GLN  61           HA       GLN  61 -36.958  13.299 -17.142
  477    HB2  GLN  61           2HB      GLN  61 -38.774  15.155 -18.672
  478    HB3  GLN  61           3HB      GLN  61 -37.209  15.548 -17.951
  479    HG2  GLN  61           2HG      GLN  61 -35.994  14.446 -19.642
  480    HG3  GLN  61           3HG      GLN  61 -37.294  13.325 -20.024
  481   HE21  GLN  61          1HE2      GLN  61 -37.580  13.601 -22.190
  482   HE22  GLN  61          2HE2      GLN  61 -38.047  15.137 -22.897
  483    H    ARG  62           H        ARG  62 -39.317  12.002 -15.928
  484    HA   ARG  62           HA       ARG  62 -40.203  14.120 -14.028
  485    HB2  ARG  62           2HB      ARG  62 -41.104  11.264 -14.545
  486    HB3  ARG  62           3HB      ARG  62 -41.835  12.388 -13.389
  487    HG2  ARG  62           2HG      ARG  62 -42.318  13.970 -15.333
  488    HG3  ARG  62           3HG      ARG  62 -41.680  12.737 -16.439
  489    HD2  ARG  62           2HD      ARG  62 -44.060  12.517 -16.381
  490    HD3  ARG  62           3HD      ARG  62 -43.298  11.116 -15.576
  491    HE   ARG  62           HE       ARG  62 -43.709  13.041 -13.610
  492   HH11  ARG  62          1HH1      ARG  62 -45.593  10.781 -15.497
  493   HH12  ARG  62          2HH1      ARG  62 -46.971  10.834 -14.420
  494   HH21  ARG  62          2HH2      ARG  62 -45.572  13.145 -12.279
  495   HH22  ARG  62          1HH2      ARG  62 -46.929  12.111 -12.616
  496    HA   PRO  63           HA       PRO  63 -37.659  12.818 -10.675
  497    HB2  PRO  63           2HB      PRO  63 -40.181  12.619  -9.022
  498    HB3  PRO  63           3HB      PRO  63 -38.607  13.366  -8.600
  499    HG2  PRO  63           2HG      PRO  63 -40.655  14.928  -9.418
  500    HG3  PRO  63           3HG      PRO  63 -39.008  15.209 -10.071
  501    HD2  PRO  63           2HD      PRO  63 -41.319  13.745 -11.365
  502    HD3  PRO  63           3HD      PRO  63 -40.184  14.934 -12.077
  503    H    CYS  64           H        CYS  64 -36.761  10.968 -10.009
  504    HA   CYS  64           HA       CYS  64 -37.856   8.372 -10.599
  505    HB2  CYS  64           2HB      CYS  64 -35.487   9.078 -10.757
  506    HB3  CYS  64           3HB      CYS  64 -35.420   9.266  -9.009
  507    HG   CYS  64           HG       CYS  64 -36.287   6.686  -8.629
  508    H    THR  65           H        THR  65 -38.443  10.368  -7.880
  509    HA   THR  65           HA       THR  65 -38.517   8.580  -5.741
  510    HB   THR  65           HB       THR  65 -40.333  11.000  -5.938
  511    HG1  THR  65           HG1      THR  65 -38.582  12.230  -5.302
  512   HG21  THR  65          1HG2      THR  65 -38.687   9.735  -3.697
  513   HG22  THR  65          2HG2      THR  65 -39.716  11.177  -3.538
  514   HG23  THR  65          3HG2      THR  65 -40.446   9.601  -3.881
  515    H    CYS  66           H        CYS  66 -39.515   6.756  -6.158
  516    HA   CYS  66           HA       CYS  66 -41.787   6.025  -7.349
  517    HB2  CYS  66           2HB      CYS  66 -40.977   4.809  -4.681
  518    HB3  CYS  66           3HB      CYS  66 -41.856   4.022  -6.008
  519    HG   CYS  66           HG       CYS  66 -39.426   3.066  -5.940
  520    H    ASP  67           H        ASP  67 -42.027   7.994  -4.564
  521    HA   ASP  67           HA       ASP  67 -44.636   7.387  -3.574
  522    HB2  ASP  67           2HB      ASP  67 -42.967   9.054  -2.629
  523    HB3  ASP  67           3HB      ASP  67 -43.354  10.123  -3.969
  524    H    PHE  68           H        PHE  68 -43.560   9.143  -6.520
  525    HA   PHE  68           HA       PHE  68 -46.148  10.046  -7.339
  526    HB2  PHE  68           2HB      PHE  68 -45.150  10.840  -9.183
  527    HB3  PHE  68           3HB      PHE  68 -43.743  10.713  -8.157
  528    HD1  PHE  68           HD1      PHE  68 -42.961   7.827  -8.437
  529    HD2  PHE  68           HD2      PHE  68 -44.459  10.596 -11.377
  530    HE1  PHE  68           HE1      PHE  68 -41.816   6.548 -10.222
  531    HE2  PHE  68           HE2      PHE  68 -43.324   9.306 -13.166
  532    HZ   PHE  68           HZ       PHE  68 -41.998   7.280 -12.592
  533    H    LEU  69           H        LEU  69 -45.036   6.902  -7.131
  534    HA   LEU  69           HA       LEU  69 -47.107   5.817  -8.958
  535    HB2  LEU  69           2HB      LEU  69 -44.381   5.579  -9.304
  536    HB3  LEU  69           3HB      LEU  69 -44.675   4.189  -8.299
  537    HG   LEU  69           HG       LEU  69 -44.607   3.628 -10.647
  538   HD11  LEU  69          1HD1      LEU  69 -46.644   2.370 -10.936
  539   HD12  LEU  69          2HD1      LEU  69 -46.148   2.320  -9.235
  540   HD13  LEU  69          3HD1      LEU  69 -47.489   3.370  -9.739
  541   HD21  LEU  69          3HD2      LEU  69 -46.171   4.414 -12.306
  542   HD22  LEU  69          1HD2      LEU  69 -47.031   5.406 -11.114
  543   HD23  LEU  69          2HD2      LEU  69 -45.360   5.806 -11.567
  544    H    HIS  70           H        HIS  70 -47.006   6.558  -5.893
  545    HA   HIS  70           HA       HIS  70 -47.306   3.971  -4.632
  546    HB2  HIS  70           2HB      HIS  70 -47.602   5.026  -2.667
  547    HB3  HIS  70           3HB      HIS  70 -46.658   6.213  -3.519
  548    HD2  HIS  70           HD2      HIS  70 -48.756   8.023  -4.945
  549    HE1  HIS  70           HE1      HIS  70 -50.946   8.155  -1.290
  550    HE2  HIS  70           HE2      HIS  70 -50.603   9.278  -3.551
  551    H    GLY  71           H        GLY  71 -49.055   2.791  -4.121
  552    HA2  GLY  71           HA2      GLY  71 -51.773   3.637  -5.044
  553    HA3  GLY  71           HA3      GLY  71 -51.082   2.097  -5.553
  554    HA   PRO  72           HA       PRO  72 -53.745   1.706  -1.728
  555    HB2  PRO  72           2HB      PRO  72 -54.558  -0.764  -3.274
  556    HB3  PRO  72           3HB      PRO  72 -55.569   0.308  -2.254
  557    HG2  PRO  72           2HG      PRO  72 -55.635   0.571  -4.937
  558    HG3  PRO  72           3HG      PRO  72 -55.518   2.043  -3.913
  559    HD2  PRO  72           2HD      PRO  72 -53.296   0.590  -5.373
  560    HD3  PRO  72           3HD      PRO  72 -53.640   2.338  -5.292
  561    H    ARG  73           H        ARG  73 -51.253  -0.326  -2.970
  562    HA   ARG  73           HA       ARG  73 -51.102  -1.906  -0.409
  563    HB2  ARG  73           2HB      ARG  73 -49.924  -2.379  -3.190
  564    HB3  ARG  73           3HB      ARG  73 -49.476  -3.324  -1.775
  565    HG2  ARG  73           2HG      ARG  73 -52.280  -3.171  -2.947
  566    HG3  ARG  73           3HG      ARG  73 -51.117  -4.483  -3.165
  567    HD2  ARG  73           2HD      ARG  73 -51.134  -4.859  -0.684
  568    HD3  ARG  73           3HD      ARG  73 -52.417  -3.637  -0.547
  569    HE   ARG  73           HE       ARG  73 -53.182  -5.589  -2.490
  570   HH11  ARG  73          1HH1      ARG  73 -52.845  -5.358   0.990
  571   HH12  ARG  73          2HH1      ARG  73 -54.043  -6.590   1.279
  572   HH21  ARG  73          1HH2      ARG  73 -54.701  -7.149  -2.050
  573   HH22  ARG  73          2HH2      ARG  73 -55.061  -7.574  -0.403
  574    H    THR  74           H        THR  74 -49.714   0.859  -1.830
  575    HA   THR  74           HA       THR  74 -46.972   0.240  -1.068
  576    HB   THR  74           HB       THR  74 -47.938   2.982  -1.864
  577    HG1  THR  74           HG1      THR  74 -46.952   1.311  -3.824
  578   HG21  THR  74          1HG2      THR  74 -45.334   1.414  -2.177
  579   HG22  THR  74          2HG2      THR  74 -45.644   2.977  -2.972
  580   HG23  THR  74          3HG2      THR  74 -45.591   2.877  -1.207
  581    H    GLN  75           H        GLN  75 -45.758   0.957   0.560
  582    HA   GLN  75           HA       GLN  75 -47.175   2.213   2.837
  583    HB2  GLN  75           2HB      GLN  75 -44.379   1.049   2.791
  584    HB3  GLN  75           3HB      GLN  75 -45.351   1.502   4.190
  585    HG2  GLN  75           2HG      GLN  75 -45.843  -0.825   2.301
  586    HG3  GLN  75           3HG      GLN  75 -45.340  -0.888   3.984
  587   HE21  GLN  75          2HE2      GLN  75 -48.091  -1.181   1.967
  588   HE22  GLN  75          1HE2      GLN  75 -49.278  -0.899   3.230
  589    H    ARG  76           H        ARG  76 -46.799   4.175   3.575
  590    HA   ARG  76           HA       ARG  76 -45.372   6.073   1.898
  591    HB2  ARG  76           2HB      ARG  76 -46.466   6.578   4.654
  592    HB3  ARG  76           3HB      ARG  76 -46.066   7.777   3.424
  593    HG2  ARG  76           2HG      ARG  76 -48.370   5.798   3.422
  594    HG3  ARG  76           3HG      ARG  76 -48.459   7.551   3.450
  595    HD2  ARG  76           2HD      ARG  76 -47.524   5.819   1.110
  596    HD3  ARG  76           3HD      ARG  76 -49.093   6.581   1.250
  597    HE   ARG  76           HE       ARG  76 -46.638   7.806   0.328
  598   HH11  ARG  76          1HH2      ARG  76 -49.673   8.675   1.863
  599   HH12  ARG  76          2HH2      ARG  76 -49.649  10.270   1.162
  600   HH21  ARG  76          1HH1      ARG  76 -46.721   9.753  -0.587
  601   HH22  ARG  76          2HH1      ARG  76 -48.000  10.879  -0.179
  602    H    ARG  77           H        ARG  77 -44.608   4.478   4.972
  603    HA   ARG  77           HA       ARG  77 -42.083   5.690   5.492
  604    HB2  ARG  77           2HB      ARG  77 -41.502   3.637   6.635
  605    HB3  ARG  77           3HB      ARG  77 -43.142   4.167   7.044
  606    HG2  ARG  77           2HG      ARG  77 -44.161   2.410   5.833
  607    HG3  ARG  77           3HG      ARG  77 -42.666   1.975   4.996
  608    HD2  ARG  77           2HD      ARG  77 -41.676   1.275   7.187
  609    HD3  ARG  77           3HD      ARG  77 -43.238   1.593   7.942
  610    HE   ARG  77           HE       ARG  77 -44.070  -0.379   7.068
  611   HH11  ARG  77          1HH2      ARG  77 -41.052   0.211   5.294
  612   HH12  ARG  77          2HH2      ARG  77 -41.208  -1.365   4.504
  613   HH21  ARG  77          1HH1      ARG  77 -43.995  -2.386   5.984
  614   HH22  ARG  77          2HH1      ARG  77 -42.665  -2.650   4.853
  615    H    ALA  78           H        ALA  78 -42.881   3.196   3.136
  616    HA   ALA  78           HA       ALA  78 -40.147   2.608   2.350
  617    HB1  ALA  78           3HB      ALA  78 -41.257   1.370   0.542
  618    HB2  ALA  78           1HB      ALA  78 -42.006   0.982   2.085
  619    HB3  ALA  78           2HB      ALA  78 -42.800   2.056   0.903
  620    H    ALA  79           H        ALA  79 -42.822   4.549   0.938
  621    HA   ALA  79           HA       ALA  79 -41.269   5.575  -1.264
  622    HB1  ALA  79           3HB      ALA  79 -43.764   5.518  -1.136
  623    HB2  ALA  79           1HB      ALA  79 -43.708   6.758   0.145
  624    HB3  ALA  79           2HB      ALA  79 -43.143   7.139  -1.489
  625    H    ALA  80           H        ALA  80 -41.719   6.739   2.056
  626    HA   ALA  80           HA       ALA  80 -40.423   9.257   1.760
  627    HB1  ALA  80           3HB      ALA  80 -40.423   9.205   4.241
  628    HB2  ALA  80           1HB      ALA  80 -41.999   8.747   3.557
  629    HB3  ALA  80           2HB      ALA  80 -40.907   7.493   4.192
  630    H    GLN  81           H        GLN  81 -39.153   6.146   3.188
  631    HA   GLN  81           HA       GLN  81 -36.442   6.918   3.468
  632    HB2  GLN  81           2HB      GLN  81 -37.776   4.277   2.832
  633    HB3  GLN  81           3HB      GLN  81 -36.019   4.420   2.983
  634    HG2  GLN  81           2HG      GLN  81 -36.168   5.226   5.255
  635    HG3  GLN  81           3HG      GLN  81 -37.927   5.349   5.167
  636   HE21  GLN  81          2HE2      GLN  81 -39.149   3.320   4.841
  637   HE22  GLN  81          1HE2      GLN  81 -38.481   1.826   5.531
  638    H    ILE  82           H        ILE  82 -38.128   5.774   0.491
  639    HA   ILE  82           HA       ILE  82 -35.751   5.907  -1.144
  640    HB   ILE  82           HB       ILE  82 -38.705   5.901  -1.712
  641   HG12  ILE  82          2HG1      ILE  82 -36.422   4.078  -2.616
  642   HG13  ILE  82          3HG1      ILE  82 -37.188   3.900  -1.035
  643   HG21  ILE  82          1HG2      ILE  82 -36.475   6.346  -3.740
  644   HG22  ILE  82          2HG2      ILE  82 -38.129   5.843  -4.171
  645   HG23  ILE  82          3HG2      ILE  82 -37.854   7.414  -3.412
  646   HD11  ILE  82          3HD1      ILE  82 -39.362   3.580  -2.043
  647   HD12  ILE  82          1HD1      ILE  82 -38.646   3.693  -3.673
  648   HD13  ILE  82          2HD1      ILE  82 -38.146   2.373  -2.591
  649    H    ALA  83           H        ALA  83 -38.338   8.357  -0.631
  650    HA   ALA  83           HA       ALA  83 -37.173  10.448  -2.102
  651    HB1  ALA  83           3HB      ALA  83 -38.597  10.718   0.573
  652    HB2  ALA  83           1HB      ALA  83 -38.440  11.950  -0.682
  653    HB3  ALA  83           2HB      ALA  83 -39.412  10.480  -0.986
  654    H    GLN  84           H        GLN  84 -36.301   9.336   1.166
  655    HA   GLN  84           HA       GLN  84 -34.399  11.435   1.736
  656    HB2  GLN  84           2HB      GLN  84 -34.249   8.646   2.881
  657    HB3  GLN  84           3HB      GLN  84 -33.550  10.118   3.497
  658    HG2  GLN  84           2HG      GLN  84 -36.376   9.194   3.662
  659    HG3  GLN  84           3HG      GLN  84 -35.327   9.727   4.926
  660   HE21  GLN  84          1HE2      GLN  84 -37.796  10.674   2.743
  661   HE22  GLN  84          2HE2      GLN  84 -37.786  12.397   3.146
  662    H    ALA  85           H        ALA  85 -34.123   8.246   0.119
  663    HA   ALA  85           HA       ALA  85 -31.240   8.421  -0.192
  664    HB1  ALA  85           3HB      ALA  85 -33.305   6.749  -1.699
  665    HB2  ALA  85           1HB      ALA  85 -31.552   6.503  -1.705
  666    HB3  ALA  85           2HB      ALA  85 -32.473   6.269  -0.205
  667    H    LEU  86           H        LEU  86 -33.978   9.566  -2.121
  668    HA   LEU  86           HA       LEU  86 -32.266  10.179  -4.387
  669    HB2  LEU  86           2HB      LEU  86 -35.113  11.088  -4.014
  670    HB3  LEU  86           3HB      LEU  86 -34.165  11.000  -5.489
  671    HG   LEU  86           HG       LEU  86 -35.629   8.881  -4.002
  672   HD11  LEU  86          1HD1      LEU  86 -34.926   9.223  -6.931
  673   HD12  LEU  86          2HD1      LEU  86 -36.188   8.165  -6.256
  674   HD13  LEU  86          3HD1      LEU  86 -36.345   9.934  -6.149
  675   HD21  LEU  86          3HD2      LEU  86 -34.472   7.019  -5.116
  676   HD22  LEU  86          1HD2      LEU  86 -33.196   8.123  -5.688
  677   HD23  LEU  86          2HD2      LEU  86 -33.405   7.764  -3.961
  678    H    LEU  87           H        LEU  87 -33.701  12.144  -1.765
  679    HA   LEU  87           HA       LEU  87 -32.461  14.600  -2.761
  680    HB2  LEU  87           2HB      LEU  87 -32.874  15.560  -0.567
  681    HB3  LEU  87           3HB      LEU  87 -34.304  14.885  -1.339
  682    HG   LEU  87           HG       LEU  87 -33.548  12.815   0.299
  683   HD11  LEU  87          1HD1      LEU  87 -32.966  15.371   1.836
  684   HD12  LEU  87          2HD1      LEU  87 -33.087  13.731   2.504
  685   HD13  LEU  87          3HD1      LEU  87 -31.761  14.142   1.390
  686   HD21  LEU  87          3HD2      LEU  87 -35.274  15.216   1.068
  687   HD22  LEU  87          1HD2      LEU  87 -35.819  13.826   0.111
  688   HD23  LEU  87          2HD2      LEU  87 -35.360  13.601   1.804
  689    H    GLY  88           H        GLY  88 -31.340  11.894  -0.775
  690    HA2  GLY  88           HA2      GLY  88 -29.039  11.300  -1.149
  691    HA3  GLY  88           HA3      GLY  88 -28.572  12.999  -1.155
  692    H    ALA  89           H        ALA  89 -30.843  12.090   1.330
  693    HA   ALA  89           HA       ALA  89 -29.052  12.691   3.479
  694    HB1  ALA  89           3HB      ALA  89 -31.432  12.852   3.792
  695    HB2  ALA  89           1HB      ALA  89 -31.641  11.121   3.433
  696    HB3  ALA  89           2HB      ALA  89 -30.803  11.633   4.910
  697    H    GLU  90           H        GLU  90 -30.174   9.506   2.217
  698    HA   GLU  90           HA       GLU  90 -27.535   8.396   2.438
  699    HB2  GLU  90           2HB      GLU  90 -28.127   6.451   3.842
  700    HB3  GLU  90           3HB      GLU  90 -27.967   7.971   4.709
  701    HG2  GLU  90           2HG      GLU  90 -30.532   8.164   4.644
  702    HG3  GLU  90           3HG      GLU  90 -30.549   6.498   4.064
  703    H    GLU  91           H        GLU  91 -27.208   6.937   0.946
  704    HA   GLU  91           HA       GLU  91 -29.334   5.939  -0.904
  705    HB2  GLU  91           2HB      GLU  91 -27.306   6.811  -1.839
  706    HB3  GLU  91           3HB      GLU  91 -26.280   5.786  -0.836
  707    HG2  GLU  91           2HG      GLU  91 -28.333   4.590  -2.706
  708    HG3  GLU  91           3HG      GLU  91 -26.801   5.199  -3.338
  709    H    ARG  92           H        ARG  92 -30.275   4.083  -0.535
  710    HA   ARG  92           HA       ARG  92 -28.848   1.677   0.173
  711    HB2  ARG  92           2HB      ARG  92 -29.291   2.648   2.425
  712    HB3  ARG  92           3HB      ARG  92 -31.025   2.573   2.126
  713    HG2  ARG  92           2HG      ARG  92 -31.078   0.244   2.338
  714    HG3  ARG  92           3HG      ARG  92 -29.413   0.044   1.766
  715    HD2  ARG  92           2HD      ARG  92 -29.575  -0.561   4.070
  716    HD3  ARG  92           3HD      ARG  92 -28.517   0.825   3.822
  717    HE   ARG  92           HE       ARG  92 -31.253   0.833   5.065
  718   HH11  ARG  92          1HH1      ARG  92 -28.288   2.706   4.525
  719   HH12  ARG  92          2HH1      ARG  92 -28.935   4.017   5.520
  720   HH21  ARG  92          1HH2      ARG  92 -31.843   2.618   6.338
  721   HH22  ARG  92          2HH2      ARG  92 -30.702   3.963   6.428
  722    H    LYS  93           H        LYS  93 -30.268  -0.235   0.065
  723    HA   LYS  93           HA       LYS  93 -32.354  -0.033  -2.008
  724    HB2  LYS  93           2HB      LYS  93 -30.710  -1.931  -1.837
  725    HB3  LYS  93           3HB      LYS  93 -31.575  -2.464  -0.384
  726    HG2  LYS  93           2HG      LYS  93 -33.683  -2.437  -1.973
  727    HG3  LYS  93           3HG      LYS  93 -32.490  -2.372  -3.263
  728    HD2  LYS  93           2HD      LYS  93 -32.727  -4.527  -1.121
  729    HD3  LYS  93           3HD      LYS  93 -33.198  -4.678  -2.819
  730    HE2  LYS  93           2HE      LYS  93 -30.782  -4.119  -3.418
  731    HE3  LYS  93           3HE      LYS  93 -30.389  -4.292  -1.697
  732    HZ1  LYS  93           HZ1      LYS  93 -31.374  -6.615  -1.937
  733    HZ2  LYS  93           HZ2      LYS  93 -31.388  -6.343  -3.572
  734    HZ3  LYS  93           HZ3      LYS  93 -29.977  -6.376  -2.761
  735    H    VAL  94           H        VAL  94 -34.493  -0.107  -1.696
  736    HA   VAL  94           HA       VAL  94 -35.663  -0.686   0.991
  737    HB   VAL  94           HB       VAL  94 -36.752   1.559  -0.720
  738   HG11  VAL  94          1HG1      VAL  94 -38.186   0.689   1.127
  739   HG12  VAL  94          2HG1      VAL  94 -36.890   1.043   2.288
  740   HG13  VAL  94          3HG1      VAL  94 -37.703   2.351   1.401
  741   HG21  VAL  94          3HG2      VAL  94 -34.654   1.920   1.463
  742   HG22  VAL  94          1HG2      VAL  94 -34.487   2.354  -0.255
  743   HG23  VAL  94          2HG2      VAL  94 -35.628   3.227   0.758
  744    H    GLU  95           H        GLU  95 -37.805  -1.452   0.911
  745    HA   GLU  95           HA       GLU  95 -38.597  -2.811  -1.592
  746    HB2  GLU  95           2HB      GLU  95 -40.270  -3.858  -0.236
  747    HB3  GLU  95           3HB      GLU  95 -38.732  -3.888   0.662
  748    HG2  GLU  95           2HG      GLU  95 -39.520  -1.849   1.944
  749    HG3  GLU  95           3HG      GLU  95 -41.077  -1.980   1.126
  750    H    ILE  96           H        ILE  96 -40.836  -2.412  -2.473
  751    HA   ILE  96           HA       ILE  96 -42.482  -0.411  -1.419
  752    HB   ILE  96           HB       ILE  96 -42.445   0.824  -3.892
  753   HG12  ILE  96          2HG1      ILE  96 -40.319   1.746  -4.417
  754   HG13  ILE  96          3HG1      ILE  96 -39.538   0.870  -3.097
  755   HG21  ILE  96          1HG2      ILE  96 -41.040   2.012  -1.532
  756   HG22  ILE  96          2HG2      ILE  96 -41.884   2.831  -2.846
  757   HG23  ILE  96          3HG2      ILE  96 -42.808   1.871  -1.685
  758   HD11  ILE  96          3HD1      ILE  96 -39.236   0.035  -5.528
  759   HD12  ILE  96          1HD1      ILE  96 -39.477  -1.109  -4.216
  760   HD13  ILE  96          2HD1      ILE  96 -40.841  -0.703  -5.291
  761    H    ALA  97           H        ALA  97 -44.511  -0.336  -2.338
  762    HA   ALA  97           HA       ALA  97 -45.089  -2.582  -4.170
  763    HB1  ALA  97           3HB      ALA  97 -47.313  -2.541  -3.460
  764    HB2  ALA  97           1HB      ALA  97 -46.437  -2.145  -1.972
  765    HB3  ALA  97           2HB      ALA  97 -47.224  -0.875  -2.930
  766    H    PHE  98           H        PHE  98 -46.155  -2.339  -6.119
  767    HA   PHE  98           HA       PHE  98 -46.451   0.448  -7.190
  768    HB2  PHE  98           2HB      PHE  98 -45.633  -2.026  -8.741
  769    HB3  PHE  98           3HB      PHE  98 -45.876  -0.416  -9.404
  770    HD1  PHE  98           HD1      PHE  98 -44.453   1.508  -8.042
  771    HD2  PHE  98           HD2      PHE  98 -43.398  -2.663  -8.399
  772    HE1  PHE  98           HE1      PHE  98 -42.068   2.081  -7.689
  773    HE2  PHE  98           HE2      PHE  98 -41.027  -2.087  -8.039
  774    HZ   PHE  98           HZ       PHE  98 -40.352   0.292  -7.688
  775    H    TYR  99           H        TYR  99 -48.083   0.766  -8.732
  776    HA   TYR  99           HA       TYR  99 -50.166  -1.328  -8.910
  777    HB2  TYR  99           2HB      TYR  99 -51.929   0.157  -8.774
  778    HB3  TYR  99           3HB      TYR  99 -50.897   0.558  -7.416
  779    HD1  TYR  99           HD1      TYR  99 -49.483   2.686  -7.534
  780    HD2  TYR  99           HD2      TYR  99 -52.451   1.705 -10.509
  781    HE1  TYR  99           HE1      TYR  99 -49.482   5.051  -8.331
  782    HE2  TYR  99           HE2      TYR  99 -52.429   4.056 -11.310
  783    HH   TYR  99           HH       TYR  99 -51.528   6.144 -11.057
  784    H    ARG 100           H        ARG 100 -50.926  -1.759 -10.897
  785    HA   ARG 100           HA       ARG 100 -49.618  -0.486 -13.222
  786    HB2  ARG 100           2HB      ARG 100 -51.572  -2.821 -13.216
  787    HB3  ARG 100           3HB      ARG 100 -50.463  -2.319 -14.502
  788    HG2  ARG 100           2HG      ARG 100 -48.566  -2.777 -12.776
  789    HG3  ARG 100           3HG      ARG 100 -49.800  -3.587 -11.816
  790    HD2  ARG 100           2HD      ARG 100 -48.680  -5.270 -13.085
  791    HD3  ARG 100           3HD      ARG 100 -50.289  -5.089 -13.773
  792    HE   ARG 100           HE       ARG 100 -47.719  -3.958 -14.858
  793   HH11  ARG 100          1HH1      ARG 100 -51.021  -4.992 -15.551
  794   HH12  ARG 100          2HH1      ARG 100 -50.794  -4.889 -17.272
  795   HH21  ARG 100          1HH2      ARG 100 -47.463  -4.159 -17.078
  796   HH22  ARG 100          2HH2      ARG 100 -48.851  -4.372 -18.114
  797    H    LYS 101           H        LYS 101 -50.833   0.226 -15.089
  798    HA   LYS 101           HA       LYS 101 -53.130   1.850 -14.484
  799    HB2  LYS 101           2HB      LYS 101 -53.255   2.439 -16.771
  800    HB3  LYS 101           3HB      LYS 101 -51.577   2.358 -16.273
  801    HG2  LYS 101           2HG      LYS 101 -51.479   1.433 -18.321
  802    HG3  LYS 101           3HG      LYS 101 -51.546  -0.015 -17.308
  803    HD2  LYS 101           2HD      LYS 101 -54.091  -0.034 -17.831
  804    HD3  LYS 101           3HD      LYS 101 -53.766   1.231 -19.012
  805    HE2  LYS 101           2HE      LYS 101 -52.410  -1.487 -18.890
  806    HE3  LYS 101           3HE      LYS 101 -53.833  -1.154 -19.892
  807    HZ1  LYS 101           HZ1      LYS 101 -51.175   0.154 -20.208
  808    HZ2  LYS 101           HZ2      LYS 101 -51.828  -0.951 -21.217
  809    HZ3  LYS 101           HZ3      LYS 101 -52.510   0.525 -21.089
  810    H    ASP 102           H        ASP 102 -52.994  -1.480 -15.261
  811    HA   ASP 102           HA       ASP 102 -55.804  -1.848 -15.889
  812    HB2  ASP 102           2HB      ASP 102 -53.917  -3.324 -16.616
  813    HB3  ASP 102           3HB      ASP 102 -53.691  -3.821 -14.940
  814    H    GLY 103           H        GLY 103 -54.270  -1.075 -12.946
  815    HA2  GLY 103           HA2      GLY 103 -55.293  -0.721 -10.897
  816    HA3  GLY 103           HA3      GLY 103 -56.651  -1.749 -11.351
  817    H    SER 104           H        SER 104 -53.673  -3.344 -11.926
  818    HA   SER 104           HA       SER 104 -54.049  -5.124  -9.596
  819    HB2  SER 104           2HB      SER 104 -53.480  -6.045 -11.817
  820    HB3  SER 104           3HB      SER 104 -51.924  -5.189 -11.765
  821    HG   SER 104           HG       SER 104 -51.877  -7.426 -11.015
  822    H    CYS 105           H        CYS 105 -52.795  -5.152  -7.755
  823    HA   CYS 105           HA       CYS 105 -50.626  -3.112  -7.479
  824    HB2  CYS 105           2HB      CYS 105 -52.883  -3.635  -5.503
  825    HB3  CYS 105           3HB      CYS 105 -51.564  -2.467  -5.318
  826    HG   CYS 105           HG       CYS 105 -53.940  -2.557  -7.647
  827    H    PHE 106           H        PHE 106 -48.789  -3.855  -6.527
  828    HA   PHE 106           HA       PHE 106 -48.862  -6.201  -4.708
  829    HB2  PHE 106           2HB      PHE 106 -47.045  -7.281  -6.209
  830    HB3  PHE 106           3HB      PHE 106 -48.735  -7.444  -6.632
  831    HD1  PHE 106           HD1      PHE 106 -45.658  -5.428  -7.477
  832    HD2  PHE 106           HD2      PHE 106 -49.573  -6.754  -8.718
  833    HE1  PHE 106           HE1      PHE 106 -45.311  -4.396  -9.709
  834    HE2  PHE 106           HE2      PHE 106 -49.202  -5.773 -10.948
  835    HZ   PHE 106           HZ       PHE 106 -47.061  -4.571 -11.453
  836    H    LEU 107           H        LEU 107 -47.229  -6.427  -3.314
  837    HA   LEU 107           HA       LEU 107 -44.845  -4.634  -3.419
  838    HB2  LEU 107           2HB      LEU 107 -46.414  -4.374  -1.457
  839    HB3  LEU 107           3HB      LEU 107 -46.158  -6.052  -1.064
  840    HG   LEU 107           HG       LEU 107 -44.976  -4.623   0.430
  841   HD11  LEU 107          1HD1      LEU 107 -42.712  -5.717  -1.259
  842   HD12  LEU 107          2HD1      LEU 107 -42.801  -5.553   0.481
  843   HD13  LEU 107          3HD1      LEU 107 -43.776  -6.802  -0.334
  844   HD21  LEU 107          3HD2      LEU 107 -43.382  -3.566  -1.875
  845   HD22  LEU 107          1HD2      LEU 107 -44.580  -2.665  -0.886
  846   HD23  LEU 107          2HD2      LEU 107 -43.077  -3.230  -0.159
  847    H    CYS 108           H        CYS 108 -42.952  -5.629  -3.743
  848    HA   CYS 108           HA       CYS 108 -42.529  -8.481  -3.031
  849    HB2  CYS 108           2HB      CYS 108 -42.346  -7.218  -5.761
  850    HB3  CYS 108           3HB      CYS 108 -41.152  -8.440  -5.325
  851    HG   CYS 108           HG       CYS 108 -43.054  -9.616  -6.701
  852    H    LEU 109           H        LEU 109 -40.012  -8.935  -3.463
  853    HA   LEU 109           HA       LEU 109 -38.552  -7.036  -1.763
  854    HB2  LEU 109           2HB      LEU 109 -37.647  -9.602  -3.121
  855    HB3  LEU 109           3HB      LEU 109 -36.752  -8.701  -1.902
  856    HG   LEU 109           HG       LEU 109 -39.397 -10.159  -1.465
  857   HD11  LEU 109          1HD1      LEU 109 -36.552 -10.749  -0.548
  858   HD12  LEU 109          2HD1      LEU 109 -37.999 -11.659  -0.075
  859   HD13  LEU 109          3HD1      LEU 109 -37.475 -11.651  -1.771
  860   HD21  LEU 109          3HD2      LEU 109 -39.273  -8.220   0.040
  861   HD22  LEU 109          1HD2      LEU 109 -38.994  -9.710   0.944
  862   HD23  LEU 109          2HD2      LEU 109 -37.618  -8.669   0.516
  863    H    VAL 110           H        VAL 110 -39.127  -5.424  -3.586
  864    HA   VAL 110           HA       VAL 110 -37.831  -5.464  -6.082
  865    HB   VAL 110           HB       VAL 110 -38.716  -3.034  -4.541
  866   HG11  VAL 110          1HG1      VAL 110 -38.343  -3.513  -7.528
  867   HG12  VAL 110          2HG1      VAL 110 -39.055  -2.048  -6.829
  868   HG13  VAL 110          3HG1      VAL 110 -37.365  -2.413  -6.531
  869   HG21  VAL 110          3HG2      VAL 110 -40.253  -4.772  -6.529
  870   HG22  VAL 110          1HG2      VAL 110 -40.607  -4.607  -4.796
  871   HG23  VAL 110          2HG2      VAL 110 -40.829  -3.233  -5.859
  872    H    ASP 111           H        ASP 111 -35.998  -4.323  -6.958
  873    HA   ASP 111           HA       ASP 111 -33.813  -4.310  -4.898
  874    HB2  ASP 111           2HB      ASP 111 -33.945  -6.068  -6.756
  875    HB3  ASP 111           3HB      ASP 111 -33.422  -4.783  -7.847
  876    H    VAL 112           H        VAL 112 -34.576  -2.035  -4.462
  877    HA   VAL 112           HA       VAL 112 -34.132  -0.059  -6.526
  878    HB   VAL 112           HB       VAL 112 -34.835   0.320  -3.591
  879   HG11  VAL 112          1HG1      VAL 112 -34.242   2.433  -4.774
  880   HG12  VAL 112          2HG1      VAL 112 -35.448   2.043  -6.028
  881   HG13  VAL 112          3HG1      VAL 112 -35.956   2.362  -4.364
  882   HG21  VAL 112          3HG2      VAL 112 -36.611  -0.177  -6.021
  883   HG22  VAL 112          1HG2      VAL 112 -36.432  -1.241  -4.616
  884   HG23  VAL 112          2HG2      VAL 112 -37.184   0.337  -4.410
  885    H    VAL 113           H        VAL 113 -31.869  -0.752  -6.803
  886    HA   VAL 113           HA       VAL 113 -29.993   0.543  -4.836
  887    HB   VAL 113           HB       VAL 113 -29.390  -1.696  -6.807
  888   HG11  VAL 113          1HG1      VAL 113 -27.375  -0.351  -6.326
  889   HG12  VAL 113          2HG1      VAL 113 -27.706  -0.447  -4.582
  890   HG13  VAL 113          3HG1      VAL 113 -27.280  -1.905  -5.503
  891   HG21  VAL 113          3HG2      VAL 113 -29.193  -3.102  -4.791
  892   HG22  VAL 113          1HG2      VAL 113 -29.736  -1.736  -3.790
  893   HG23  VAL 113          2HG2      VAL 113 -30.834  -2.483  -4.984
  894    HA   PRO 114           HA       PRO 114 -29.219   3.172  -8.516
  895    HB2  PRO 114           2HB      PRO 114 -27.960   5.256  -7.431
  896    HB3  PRO 114           3HB      PRO 114 -29.626   4.839  -6.990
  897    HG2  PRO 114           2HG      PRO 114 -27.112   4.122  -5.477
  898    HG3  PRO 114           3HG      PRO 114 -28.617   4.910  -4.875
  899    HD2  PRO 114           2HD      PRO 114 -28.146   2.182  -4.705
  900    HD3  PRO 114           3HD      PRO 114 -29.775   2.901  -4.847
  901    H    VAL 115           H        VAL 115 -27.002   4.644  -9.191
  902    HA   VAL 115           HA       VAL 115 -24.697   2.752  -9.126
  903    HB   VAL 115           HB       VAL 115 -24.157   3.409 -11.435
  904   HG11  VAL 115          1HG1      VAL 115 -25.664   1.794 -12.463
  905   HG12  VAL 115          2HG1      VAL 115 -25.131   1.231 -10.871
  906   HG13  VAL 115          3HG1      VAL 115 -26.765   1.895 -11.071
  907   HG21  VAL 115          3HG2      VAL 115 -25.854   4.235 -12.935
  908   HG22  VAL 115          1HG2      VAL 115 -27.019   4.379 -11.589
  909   HG23  VAL 115          2HG2      VAL 115 -25.562   5.397 -11.635
  910    H    LYS 116           H        LYS 116 -22.895   3.433  -8.583
  911    HA   LYS 116           HA       LYS 116 -22.330   6.319  -8.167
  912    HB2  LYS 116           2HB      LYS 116 -21.335   3.930  -6.568
  913    HB3  LYS 116           3HB      LYS 116 -20.860   5.585  -6.277
  914    HG2  LYS 116           2HG      LYS 116 -22.868   6.175  -5.348
  915    HG3  LYS 116           3HG      LYS 116 -23.805   5.009  -6.248
  916    HD2  LYS 116           2HD      LYS 116 -21.854   4.229  -4.031
  917    HD3  LYS 116           3HD      LYS 116 -23.530   4.695  -3.716
  918    HE2  LYS 116           2HE      LYS 116 -24.304   2.884  -5.273
  919    HE3  LYS 116           3HE      LYS 116 -22.624   2.343  -5.435
  920    HZ1  LYS 116           HZ1      LYS 116 -23.834   1.110  -3.697
  921    HZ2  LYS 116           HZ2      LYS 116 -22.604   1.953  -3.022
  922    HZ3  LYS 116           HZ3      LYS 116 -24.144   2.499  -2.879
  923    H    ASN 117           H        ASN 117 -20.163   6.901  -8.088
  924    HA   ASN 117           HA       ASN 117 -18.505   5.644 -10.252
  925    HB2  ASN 117           2HB      ASN 117 -17.457   7.670 -10.613
  926    HB3  ASN 117           3HB      ASN 117 -19.118   8.132 -10.330
  927   HD21  ASN 117          2HD2      ASN 117 -19.600   9.017  -8.021
  928   HD22  ASN 117          1HD2      ASN 117 -18.251   9.866  -7.279
  929    H    GLU 118           H        GLU 118 -15.981   6.078  -9.746
  930    HA   GLU 118           HA       GLU 118 -15.282   4.150  -7.786
  931    HB2  GLU 118           2HB      GLU 118 -12.990   4.649  -8.363
  932    HB3  GLU 118           3HB      GLU 118 -13.992   4.565  -9.809
  933    HG2  GLU 118           2HG      GLU 118 -14.067   7.065  -9.889
  934    HG3  GLU 118           3HG      GLU 118 -13.039   7.132  -8.457
  935    H    ASP 119           H        ASP 119 -15.656   7.615  -7.350
  936    HA   ASP 119           HA       ASP 119 -14.280   7.772  -4.809
  937    HB2  ASP 119           2HB      ASP 119 -14.909   9.671  -6.421
  938    HB3  ASP 119           3HB      ASP 119 -16.543   9.549  -5.768
  939    H    GLY 120           H        GLY 120 -17.313   6.385  -5.716
  940    HA2  GLY 120           HA2      GLY 120 -18.693   5.099  -4.334
  941    HA3  GLY 120           HA3      GLY 120 -18.122   5.950  -2.899
  942    H    ALA 121           H        ALA 121 -18.882   8.239  -5.277
  943    HA   ALA 121           HA       ALA 121 -21.450   8.851  -3.958
  944    HB1  ALA 121           3HB      ALA 121 -19.659  10.599  -4.115
  945    HB2  ALA 121           1HB      ALA 121 -19.819  10.549  -5.890
  946    HB3  ALA 121           2HB      ALA 121 -21.181  11.084  -4.894
  947    H    VAL 122           H        VAL 122 -23.365   9.096  -4.870
  948    HA   VAL 122           HA       VAL 122 -23.887   7.428  -7.173
  949    HB   VAL 122           HB       VAL 122 -25.252   7.173  -5.283
  950   HG11  VAL 122          1HG1      VAL 122 -25.267   9.457  -4.309
  951   HG12  VAL 122          2HG1      VAL 122 -26.368   9.979  -5.609
  952   HG13  VAL 122          3HG1      VAL 122 -26.876   8.738  -4.454
  953   HG21  VAL 122          3HG2      VAL 122 -26.222   6.759  -7.491
  954   HG22  VAL 122          1HG2      VAL 122 -27.447   7.258  -6.304
  955   HG23  VAL 122          2HG2      VAL 122 -26.883   8.406  -7.527
  956    H    ILE 123           H        ILE 123 -23.270   8.189  -9.036
  957    HA   ILE 123           HA       ILE 123 -23.915  10.951  -9.817
  958    HB   ILE 123           HB       ILE 123 -22.442  10.875 -11.483
  959   HG12  ILE 123          2HG1      ILE 123 -23.043   9.014 -12.813
  960   HG13  ILE 123          3HG1      ILE 123 -21.326   8.991 -12.506
  961   HG21  ILE 123          1HG2      ILE 123 -20.352  10.188 -10.551
  962   HG22  ILE 123          2HG2      ILE 123 -21.400  10.724  -9.225
  963   HG23  ILE 123          3HG2      ILE 123 -21.145   8.993  -9.503
  964   HD11  ILE 123          3HD1      ILE 123 -22.078   6.741 -12.433
  965   HD12  ILE 123          1HD1      ILE 123 -21.740   7.187 -10.751
  966   HD13  ILE 123          2HD1      ILE 123 -23.413   7.122 -11.359
  967    H    MET 124           H        MET 124 -25.117   7.685 -10.478
  968    HA   MET 124           HA       MET 124 -27.390   9.081 -11.764
  969    HB2  MET 124           2HB      MET 124 -25.872   6.882 -13.143
  970    HB3  MET 124           3HB      MET 124 -27.629   6.929 -13.262
  971    HG2  MET 124           2HG      MET 124 -27.252   8.220 -15.030
  972    HG3  MET 124           3HG      MET 124 -27.126   9.508 -13.846
  973    HE1  MET 124           3HE      MET 124 -24.120  11.098 -15.279
  974    HE2  MET 124           1HE      MET 124 -25.874  11.003 -15.589
  975    HE3  MET 124           2HE      MET 124 -25.266  11.131 -13.925
  976    H    PHE 125           H        PHE 125 -29.267   8.219 -11.670
  977    HA   PHE 125           HA       PHE 125 -29.774   6.327  -9.404
  978    HB2  PHE 125           2HB      PHE 125 -31.216   8.776 -10.432
  979    HB3  PHE 125           3HB      PHE 125 -32.178   7.480  -9.740
  980    HD1  PHE 125           HD2      PHE 125 -30.763   6.521  -7.430
  981    HD2  PHE 125           HD1      PHE 125 -31.253  10.527  -8.882
  982    HE1  PHE 125           HE2      PHE 125 -30.096   7.395  -5.198
  983    HE2  PHE 125           HE1      PHE 125 -30.612  11.413  -6.644
  984    HZ   PHE 125           HZ       PHE 125 -29.960   9.852  -4.832
  985    H    ILE 126           H        ILE 126 -29.281   4.577 -10.745
  986    HA   ILE 126           HA       ILE 126 -31.416   3.911 -12.717
  987    HB   ILE 126           HB       ILE 126 -28.827   2.442 -12.240
  988   HG12  ILE 126          2HG1      ILE 126 -29.734   4.407 -14.402
  989   HG13  ILE 126          3HG1      ILE 126 -28.461   4.683 -13.234
  990   HG21  ILE 126          1HG2      ILE 126 -29.456   1.029 -14.038
  991   HG22  ILE 126          2HG2      ILE 126 -30.991   1.189 -13.163
  992   HG23  ILE 126          3HG2      ILE 126 -30.734   2.133 -14.591
  993   HD11  ILE 126          3HD1      ILE 126 -27.233   2.719 -14.174
  994   HD12  ILE 126          1HD1      ILE 126 -28.443   2.658 -15.474
  995   HD13  ILE 126          2HD1      ILE 126 -27.431   4.112 -15.287
  996    H    LEU 127           H        LEU 127 -32.823   3.996 -10.901
  997    HA   LEU 127           HA       LEU 127 -32.674   1.740  -9.009
  998    HB2  LEU 127           2HB      LEU 127 -34.673   4.022  -9.171
  999    HB3  LEU 127           3HB      LEU 127 -34.628   2.759  -7.950
 1000    HG   LEU 127           HG       LEU 127 -32.434   4.832  -8.486
 1001   HD11  LEU 127          1HD1      LEU 127 -34.034   4.366  -5.941
 1002   HD12  LEU 127          2HD1      LEU 127 -32.661   5.458  -6.116
 1003   HD13  LEU 127          3HD1      LEU 127 -34.159   5.767  -7.035
 1004   HD21  LEU 127          3HD2      LEU 127 -31.308   2.855  -7.955
 1005   HD22  LEU 127          1HD2      LEU 127 -31.403   3.691  -6.398
 1006   HD23  LEU 127          2HD2      LEU 127 -32.518   2.367  -6.748
 1007    H    ASN 128           H        ASN 128 -32.529   0.143 -10.258
 1008    HA   ASN 128           HA       ASN 128 -34.398  -0.946 -12.062
 1009    HB2  ASN 128           2HB      ASN 128 -32.513  -2.225 -10.028
 1010    HB3  ASN 128           3HB      ASN 128 -33.456  -3.162 -11.171
 1011   HD21  ASN 128          2HD2      ASN 128 -30.900  -0.539 -11.144
 1012   HD22  ASN 128          1HD2      ASN 128 -30.215  -1.153 -12.630
 1013    H    PHE 129           H        PHE 129 -36.629  -0.956 -11.629
 1014    HA   PHE 129           HA       PHE 129 -37.475  -1.608  -8.907
 1015    HB2  PHE 129           2HB      PHE 129 -39.133  -0.811 -11.315
 1016    HB3  PHE 129           3HB      PHE 129 -39.645  -0.962  -9.634
 1017    HD1  PHE 129           HD1      PHE 129 -37.569   0.509  -8.119
 1018    HD2  PHE 129           HD2      PHE 129 -39.411   1.435 -11.910
 1019    HE1  PHE 129           HE1      PHE 129 -37.078   2.914  -7.778
 1020    HE2  PHE 129           HE2      PHE 129 -38.931   3.842 -11.549
 1021    HZ   PHE 129           HZ       PHE 129 -37.751   4.583  -9.487
 1022    H    GLU 130           H        GLU 130 -36.280  -3.760  -9.709
 1023    HA   GLU 130           HA       GLU 130 -38.100  -5.523 -11.191
 1024    HB2  GLU 130           2HB      GLU 130 -36.417  -7.276 -10.715
 1025    HB3  GLU 130           3HB      GLU 130 -35.895  -5.864 -11.678
 1026    HG2  GLU 130           2HG      GLU 130 -34.700  -4.903  -9.899
 1027    HG3  GLU 130           3HG      GLU 130 -35.444  -5.943  -8.701
 1028    H    VAL 131           H        VAL 131 -39.786  -6.010 -10.332
 1029    HA   VAL 131           HA       VAL 131 -40.482  -6.775  -7.639
 1030    HB   VAL 131           HB       VAL 131 -41.709  -7.185 -10.375
 1031   HG11  VAL 131          1HG1      VAL 131 -43.783  -7.937  -9.392
 1032   HG12  VAL 131          2HG1      VAL 131 -42.503  -9.084  -8.995
 1033   HG13  VAL 131          3HG1      VAL 131 -43.074  -7.914  -7.773
 1034   HG21  VAL 131          3HG2      VAL 131 -43.355  -5.560  -9.540
 1035   HG22  VAL 131          1HG2      VAL 131 -42.540  -5.500  -7.965
 1036   HG23  VAL 131          2HG2      VAL 131 -41.722  -4.888  -9.417
 1037    H    VAL 132           H        VAL 132 -39.659  -8.491  -6.579
 1038    HA   VAL 132           HA       VAL 132 -39.636 -11.081  -7.972
 1039    HB   VAL 132           HB       VAL 132 -37.400 -10.335  -8.398
 1040   HG11  VAL 132          1HG1      VAL 132 -37.031  -8.761  -6.553
 1041   HG12  VAL 132          2HG1      VAL 132 -36.983 -10.110  -5.395
 1042   HG13  VAL 132          3HG1      VAL 132 -35.736  -9.957  -6.650
 1043   HG21  VAL 132          3HG2      VAL 132 -37.799 -12.738  -7.959
 1044   HG22  VAL 132          1HG2      VAL 132 -36.160 -12.223  -7.535
 1045   HG23  VAL 132          2HG2      VAL 132 -37.354 -12.490  -6.252
 1046    H    MET 133           H        MET 133 -40.191 -12.800  -6.684
 1047    HA   MET 133           HA       MET 133 -41.523 -12.071  -4.223
 1048    HB2  MET 133           2HB      MET 133 -41.346 -14.674  -5.793
 1049    HB3  MET 133           3HB      MET 133 -42.348 -14.431  -4.358
 1050    HG2  MET 133           2HG      MET 133 -43.572 -12.606  -5.496
 1051    HG3  MET 133           3HG      MET 133 -42.580 -12.833  -6.933
 1052    HE1  MET 133           3HE      MET 133 -44.382 -15.532  -4.524
 1053    HE2  MET 133           1HE      MET 133 -45.496 -14.159  -4.729
 1054    HE3  MET 133           2HE      MET 133 -45.879 -15.735  -5.454
 1055    H    GLU 134           H        GLU 134 -41.500 -13.503  -2.425
 1056    HA   GLU 134           HA       GLU 134 -38.926 -13.665  -1.124
 1057    HB2  GLU 134           2HB      GLU 134 -41.620 -14.804  -0.281
 1058    HB3  GLU 134           3HB      GLU 134 -40.186 -14.682   0.743
 1059    HG2  GLU 134           2HG      GLU 134 -40.223 -12.201   0.477
 1060    HG3  GLU 134           3HG      GLU 134 -41.701 -12.332  -0.475
 1061    H    LYS 135           H        LYS 135 -37.777 -15.442  -0.354
 1062    HA   LYS 135           HA       LYS 135 -38.383 -18.165  -1.320
 1063    HB2  LYS 135           2HB      LYS 135 -37.024 -17.044  -3.110
 1064    HB3  LYS 135           3HB      LYS 135 -35.772 -16.713  -1.918
 1065    HG2  LYS 135           2HG      LYS 135 -35.074 -18.604  -3.174
 1066    HG3  LYS 135           3HG      LYS 135 -35.504 -19.204  -1.573
 1067    HD2  LYS 135           2HD      LYS 135 -37.694 -19.994  -2.465
 1068    HD3  LYS 135           3HD      LYS 135 -37.279 -19.332  -4.062
 1069    HE2  LYS 135           2HE      LYS 135 -35.303 -20.837  -4.162
 1070    HE3  LYS 135           3HE      LYS 135 -35.714 -21.487  -2.570
 1071    HZ1  LYS 135           HZ1      LYS 135 -37.425 -21.708  -4.991
 1072    HZ2  LYS 135           HZ2      LYS 135 -36.539 -22.917  -4.350
 1073    HZ3  LYS 135           HZ3      LYS 135 -37.804 -22.310  -3.519
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1 -14.151 -23.733 -31.729
    2    H2   MET   1           2H       MET   1 -14.311 -22.652 -32.940
    3    H3   MET   1           3H       MET   1 -15.471 -22.757 -31.791
    4    HA   MET   1           HA       MET   1 -14.093 -20.803 -31.480
    5    HB2  MET   1           2HB      MET   1 -13.554 -21.098 -29.103
    6    HB3  MET   1           3HB      MET   1 -15.152 -21.710 -29.497
    7    HG2  MET   1           2HG      MET   1 -14.301 -24.028 -29.444
    8    HG3  MET   1           3HG      MET   1 -12.667 -23.431 -29.118
    9    HE1  MET   1           3HE      MET   1 -14.170 -25.668 -27.402
   10    HE2  MET   1           1HE      MET   1 -12.512 -25.109 -27.084
   11    HE3  MET   1           2HE      MET   1 -13.698 -25.174 -25.762
   12    HA   PRO   2           HA       PRO   2  -9.762 -21.220 -32.368
   13    HB2  PRO   2           2HB      PRO   2  -8.700 -18.973 -31.244
   14    HB3  PRO   2           3HB      PRO   2  -9.784 -18.923 -32.668
   15    HG2  PRO   2           2HG      PRO   2 -10.537 -18.536 -29.749
   16    HG3  PRO   2           3HG      PRO   2 -10.935 -17.475 -31.140
   17    HD2  PRO   2           2HD      PRO   2 -12.691 -19.321 -30.224
   18    HD3  PRO   2           3HD      PRO   2 -12.523 -19.010 -31.977
   19    H    VAL   3           H        VAL   3  -7.650 -21.504 -31.384
   20    HA   VAL   3           HA       VAL   3  -7.688 -22.965 -28.869
   21    HB   VAL   3           HB       VAL   3  -5.262 -23.211 -29.193
   22   HG11  VAL   3          1HG1      VAL   3  -6.869 -23.836 -31.704
   23   HG12  VAL   3          2HG1      VAL   3  -5.373 -24.629 -31.169
   24   HG13  VAL   3          3HG1      VAL   3  -6.853 -24.802 -30.211
   25   HG21  VAL   3          3HG2      VAL   3  -4.738 -21.068 -30.335
   26   HG22  VAL   3          1HG2      VAL   3  -4.156 -22.471 -31.238
   27   HG23  VAL   3          2HG2      VAL   3  -5.618 -21.624 -31.776
   28    H    ARG   4           H        ARG   4  -6.350 -22.545 -27.029
   29    HA   ARG   4           HA       ARG   4  -5.843 -19.659 -26.410
   30    HB2  ARG   4           2HB      ARG   4  -7.257 -21.670 -24.605
   31    HB3  ARG   4           3HB      ARG   4  -6.792 -20.024 -24.159
   32    HG2  ARG   4           2HG      ARG   4  -8.294 -19.130 -25.953
   33    HG3  ARG   4           3HG      ARG   4  -8.811 -20.788 -26.315
   34    HD2  ARG   4           2HD      ARG   4  -9.576 -21.016 -23.922
   35    HD3  ARG   4           3HD      ARG   4  -9.157 -19.323 -23.669
   36    HE   ARG   4           HE       ARG   4 -11.018 -18.638 -24.895
   37   HH11  ARG   4          1HH1      ARG   4 -10.754 -22.116 -25.262
   38   HH12  ARG   4          2HH1      ARG   4 -12.354 -22.250 -25.946
   39   HH21  ARG   4          1HH2      ARG   4 -13.047 -18.894 -25.757
   40   HH22  ARG   4          2HH2      ARG   4 -13.618 -20.481 -26.185
   41    H    ARG   5           H        ARG   5  -4.349 -19.251 -24.755
   42    HA   ARG   5           HA       ARG   5  -2.576 -21.390 -23.770
   43    HB2  ARG   5           2HB      ARG   5  -0.541 -20.426 -24.706
   44    HB3  ARG   5           3HB      ARG   5  -1.643 -20.915 -25.987
   45    HG2  ARG   5           2HG      ARG   5  -2.348 -18.540 -26.294
   46    HG3  ARG   5           3HG      ARG   5  -1.222 -18.050 -25.010
   47    HD2  ARG   5           2HD      ARG   5   0.669 -18.953 -26.326
   48    HD3  ARG   5           3HD      ARG   5  -0.459 -19.446 -27.607
   49    HE   ARG   5           HE       ARG   5  -0.828 -16.667 -27.102
   50   HH11  ARG   5          1HH2      ARG   5   1.622 -18.729 -28.525
   51   HH12  ARG   5          2HH2      ARG   5   2.220 -17.459 -29.559
   52   HH21  ARG   5          1HH1      ARG   5  -0.016 -15.094 -28.444
   53   HH22  ARG   5          2HH1      ARG   5   1.312 -15.457 -29.508
   54    H    GLY   6           H        GLY   6  -0.931 -20.609 -22.278
   55    HA2  GLY   6           HA2      GLY   6  -0.137 -19.315 -20.522
   56    HA3  GLY   6           HA3      GLY   6  -1.089 -17.954 -21.101
   57    H    HIS   7           H        HIS   7  -1.167 -17.767 -18.665
   58    HA   HIS   7           HA       HIS   7  -2.948 -19.506 -17.151
   59    HB2  HIS   7           2HB      HIS   7  -2.506 -17.906 -15.332
   60    HB3  HIS   7           3HB      HIS   7  -1.025 -18.466 -16.095
   61    HD2  HIS   7           HD2      HIS   7  -3.102 -15.295 -15.526
   62    HE1  HIS   7           HE1      HIS   7   0.389 -14.052 -17.640
   63    HE2  HIS   7           HE2      HIS   7  -1.678 -13.251 -16.386
   64    H    VAL   8           H        VAL   8  -4.822 -18.763 -15.979
   65    HA   VAL   8           HA       VAL   8  -6.643 -17.075 -17.559
   66    HB   VAL   8           HB       VAL   8  -7.363 -19.256 -16.629
   67   HG11  VAL   8          1HG1      VAL   8  -8.001 -19.498 -14.302
   68   HG12  VAL   8          2HG1      VAL   8  -6.265 -19.171 -14.404
   69   HG13  VAL   8          3HG1      VAL   8  -7.386 -17.883 -13.913
   70   HG21  VAL   8          3HG2      VAL   8  -8.985 -17.518 -17.292
   71   HG22  VAL   8          1HG2      VAL   8  -9.576 -18.558 -15.988
   72   HG23  VAL   8          2HG2      VAL   8  -9.019 -16.921 -15.617
   73    H    ALA   9           H        ALA   9  -7.590 -15.190 -16.835
   74    HA   ALA   9           HA       ALA   9  -6.191 -13.389 -15.084
   75    HB1  ALA   9           3HB      ALA   9  -7.652 -12.678 -16.945
   76    HB2  ALA   9           1HB      ALA   9  -9.060 -13.394 -16.125
   77    HB3  ALA   9           2HB      ALA   9  -8.228 -11.999 -15.414
   78    HA   PRO  10           HA       PRO  10  -7.529 -14.280 -10.923
   79    HB2  PRO  10           2HB      PRO  10  -8.828 -11.559 -10.953
   80    HB3  PRO  10           3HB      PRO  10  -7.859 -12.322  -9.658
   81    HG2  PRO  10           2HG      PRO  10  -6.696 -10.537 -11.333
   82    HG3  PRO  10           3HG      PRO  10  -5.835 -12.047 -10.896
   83    HD2  PRO  10           2HD      PRO  10  -7.297 -11.393 -13.452
   84    HD3  PRO  10           3HD      PRO  10  -5.784 -12.307 -13.202
   85    H    GLN  11           H        GLN  11  -8.989 -15.775 -10.724
   86    HA   GLN  11           HA       GLN  11 -11.177 -16.049 -12.398
   87    HB2  GLN  11           2HB      GLN  11 -11.625 -18.097 -11.377
   88    HB3  GLN  11           3HB      GLN  11  -9.886 -17.876 -11.349
   89    HG2  GLN  11           2HG      GLN  11 -11.812 -17.549  -9.005
   90    HG3  GLN  11           3HG      GLN  11 -10.714 -18.893  -9.287
   91   HE21  GLN  11          2HE2      GLN  11 -11.000 -16.624  -7.104
   92   HE22  GLN  11          1HE2      GLN  11  -9.309 -16.159  -6.907
   93    H    ASN  12           H        ASN  12 -11.258 -14.469  -9.263
   94    HA   ASN  12           HA       ASN  12 -14.094 -14.838  -8.777
   95    HB2  ASN  12           2HB      ASN  12 -11.939 -12.984  -7.653
   96    HB3  ASN  12           3HB      ASN  12 -13.635 -12.824  -7.208
   97   HD21  ASN  12          1HD2      ASN  12 -12.477 -13.213  -5.036
   98   HD22  ASN  12          2HD2      ASN  12 -12.436 -14.896  -4.530
   99    H    THR  13           H        THR  13 -12.188 -12.096 -10.087
  100    HA   THR  13           HA       THR  13 -14.563 -10.542 -10.768
  101    HB   THR  13           HB       THR  13 -12.278  -9.693 -10.089
  102    HG1  THR  13           HG1      THR  13 -12.568  -7.859 -11.360
  103   HG21  THR  13          1HG2      THR  13 -11.628 -10.031 -13.040
  104   HG22  THR  13          2HG2      THR  13 -10.627  -9.244 -11.793
  105   HG23  THR  13          3HG2      THR  13 -10.940 -10.985 -11.719
  106    H    PHE  14           H        PHE  14 -12.282 -12.619 -12.540
  107    HA   PHE  14           HA       PHE  14 -13.245 -12.265 -15.179
  108    HB2  PHE  14           2HB      PHE  14 -11.198 -13.466 -14.450
  109    HB3  PHE  14           3HB      PHE  14 -12.190 -14.736 -13.766
  110    HD1  PHE  14           HD1      PHE  14 -11.494 -12.991 -17.027
  111    HD2  PHE  14           HD2      PHE  14 -12.743 -16.629 -15.072
  112    HE1  PHE  14           HE1      PHE  14 -11.440 -14.183 -19.207
  113    HE2  PHE  14           HE2      PHE  14 -12.688 -17.816 -17.253
  114    HZ   PHE  14           HZ       PHE  14 -12.035 -16.598 -19.321
  115    H    LEU  15           H        LEU  15 -14.380 -14.372 -12.535
  116    HA   LEU  15           HA       LEU  15 -16.666 -15.386 -14.041
  117    HB2  LEU  15           2HB      LEU  15 -15.821 -16.721 -12.228
  118    HB3  LEU  15           3HB      LEU  15 -16.032 -15.395 -11.076
  119    HG   LEU  15           HG       LEU  15 -18.452 -15.499 -11.295
  120   HD11  LEU  15          1HD1      LEU  15 -18.049 -17.891 -13.148
  121   HD12  LEU  15          2HD1      LEU  15 -19.606 -17.267 -12.528
  122   HD13  LEU  15          3HD1      LEU  15 -18.654 -16.308 -13.644
  123   HD21  LEU  15          3HD2      LEU  15 -18.825 -17.672 -10.218
  124   HD22  LEU  15          1HD2      LEU  15 -17.238 -18.242 -10.786
  125   HD23  LEU  15          2HD2      LEU  15 -17.344 -16.909  -9.615
  126    H    ASP  16           H        ASP  16 -16.377 -12.777 -11.548
  127    HA   ASP  16           HA       ASP  16 -18.958 -11.896 -11.401
  128    HB2  ASP  16           2HB      ASP  16 -16.914 -10.952 -10.254
  129    HB3  ASP  16           3HB      ASP  16 -16.629  -9.980 -11.698
  130    H    THR  17           H        THR  17 -16.766 -11.187 -14.089
  131    HA   THR  17           HA       THR  17 -18.552  -9.451 -15.581
  132    HB   THR  17           HB       THR  17 -16.362 -11.307 -16.603
  133    HG1  THR  17           HG1      THR  17 -15.137  -9.428 -16.547
  134   HG21  THR  17          1HG2      THR  17 -16.267  -9.731 -18.544
  135   HG22  THR  17          2HG2      THR  17 -17.783 -10.632 -18.489
  136   HG23  THR  17          3HG2      THR  17 -17.744  -8.938 -17.949
  137    H    ILE  18           H        ILE  18 -18.241 -12.982 -15.465
  138    HA   ILE  18           HA       ILE  18 -20.163 -13.491 -17.610
  139    HB   ILE  18           HB       ILE  18 -19.187 -15.341 -15.428
  140   HG12  ILE  18          2HG1      ILE  18 -17.236 -14.553 -16.625
  141   HG13  ILE  18          3HG1      ILE  18 -17.526 -16.256 -16.862
  142   HG21  ILE  18          1HG2      ILE  18 -21.120 -16.286 -16.448
  143   HG22  ILE  18          2HG2      ILE  18 -20.538 -15.921 -18.083
  144   HG23  ILE  18          3HG2      ILE  18 -19.734 -17.158 -17.087
  145   HD11  ILE  18          3HD1      ILE  18 -18.423 -15.764 -19.150
  146   HD12  ILE  18          1HD1      ILE  18 -18.206 -14.021 -18.851
  147   HD13  ILE  18          2HD1      ILE  18 -16.797 -15.092 -18.944
  148    H    ILE  19           H        ILE  19 -20.253 -13.214 -14.031
  149    HA   ILE  19           HA       ILE  19 -22.979 -13.895 -13.736
  150    HB   ILE  19           HB       ILE  19 -21.570 -11.669 -12.224
  151   HG12  ILE  19          2HG1      ILE  19 -20.227 -13.609 -11.822
  152   HG13  ILE  19          3HG1      ILE  19 -21.203 -13.318 -10.400
  153   HG21  ILE  19          1HG2      ILE  19 -23.971 -11.546 -11.968
  154   HG22  ILE  19          2HG2      ILE  19 -24.079 -13.286 -11.665
  155   HG23  ILE  19          3HG2      ILE  19 -23.296 -12.219 -10.478
  156   HD11  ILE  19          3HD1      ILE  19 -22.772 -15.136 -11.199
  157   HD12  ILE  19          1HD1      ILE  19 -21.622 -15.445 -12.528
  158   HD13  ILE  19          2HD1      ILE  19 -21.102 -15.679 -10.852
  159    H    ARG  20           H        ARG  20 -21.512 -10.613 -14.358
  160    HA   ARG  20           HA       ARG  20 -23.991  -9.296 -14.836
  161    HB2  ARG  20           2HB      ARG  20 -21.081  -8.749 -15.457
  162    HB3  ARG  20           3HB      ARG  20 -22.290  -7.877 -16.384
  163    HG2  ARG  20           2HG      ARG  20 -22.206  -6.402 -14.746
  164    HG3  ARG  20           3HG      ARG  20 -23.365  -7.458 -13.971
  165    HD2  ARG  20           2HD      ARG  20 -20.372  -7.449 -13.467
  166    HD3  ARG  20           3HD      ARG  20 -21.556  -6.585 -12.496
  167    HE   ARG  20           HE       ARG  20 -20.811  -9.328 -12.277
  168   HH11  ARG  20          1HH2      ARG  20 -23.997  -7.795 -12.008
  169   HH12  ARG  20          2HH2      ARG  20 -24.158  -8.333 -10.373
  170   HH21  ARG  20          1HH1      ARG  20 -21.122  -9.837 -10.150
  171   HH22  ARG  20          2HH1      ARG  20 -22.710  -9.640  -9.450
  172    H    LYS  21           H        LYS  21 -22.172 -11.384 -17.009
  173    HA   LYS  21           HA       LYS  21 -23.668 -10.769 -19.395
  174    HB2  LYS  21           2HB      LYS  21 -21.447 -12.052 -19.005
  175    HB3  LYS  21           3HB      LYS  21 -22.512 -13.468 -18.820
  176    HG2  LYS  21           2HG      LYS  21 -23.414 -13.156 -21.047
  177    HG3  LYS  21           3HG      LYS  21 -22.559 -11.599 -21.236
  178    HD2  LYS  21           2HD      LYS  21 -20.401 -12.685 -21.030
  179    HD3  LYS  21           3HD      LYS  21 -21.184 -14.223 -20.637
  180    HE2  LYS  21           2HE      LYS  21 -22.227 -14.268 -22.910
  181    HE3  LYS  21           3HE      LYS  21 -21.459 -12.723 -23.293
  182    HZ1  LYS  21           HZ1      LYS  21 -20.002 -15.246 -22.699
  183    HZ2  LYS  21           HZ2      LYS  21 -20.183 -14.586 -24.179
  184    HZ3  LYS  21           HZ3      LYS  21 -19.291 -13.815 -23.052
  185    H    PHE  22           H        PHE  22 -24.198 -13.309 -16.878
  186    HA   PHE  22           HA       PHE  22 -26.807 -13.903 -18.163
  187    HB2  PHE  22           2HB      PHE  22 -26.860 -15.981 -17.115
  188    HB3  PHE  22           3HB      PHE  22 -25.297 -15.766 -17.858
  189    HD1  PHE  22           HD2      PHE  22 -27.051 -15.612 -14.505
  190    HD2  PHE  22           HD1      PHE  22 -23.371 -16.294 -16.637
  191    HE1  PHE  22           HE2      PHE  22 -25.996 -16.408 -12.417
  192    HE2  PHE  22           HE1      PHE  22 -22.319 -17.123 -14.538
  193    HZ   PHE  22           HZ       PHE  22 -23.634 -17.186 -12.431
  194    H    GLU  23           H        GLU  23 -25.894 -11.885 -15.755
  195    HA   GLU  23           HA       GLU  23 -27.253 -12.245 -13.504
  196    HB2  GLU  23           2HB      GLU  23 -25.719 -10.378 -13.969
  197    HB3  GLU  23           3HB      GLU  23 -26.904  -9.627 -15.017
  198    HG2  GLU  23           2HG      GLU  23 -28.402  -9.448 -12.899
  199    HG3  GLU  23           3HG      GLU  23 -26.961  -9.905 -11.999
  200    H    GLY  24           H        GLY  24 -28.800 -11.276 -16.505
  201    HA2  GLY  24           HA2      GLY  24 -31.188 -11.345 -16.942
  202    HA3  GLY  24           HA3      GLY  24 -31.510 -10.971 -15.248
  203    H    GLN  25           H        GLN  25 -29.541  -9.506 -17.889
  204    HA   GLN  25           HA       GLN  25 -29.945  -6.765 -17.113
  205    HB2  GLN  25           2HB      GLN  25 -29.322  -7.964 -19.841
  206    HB3  GLN  25           3HB      GLN  25 -29.165  -6.262 -19.391
  207    HG2  GLN  25           2HG      GLN  25 -27.442  -6.891 -17.681
  208    HG3  GLN  25           3HG      GLN  25 -27.550  -8.571 -18.212
  209   HE21  GLN  25          2HE2      GLN  25 -25.147  -8.226 -18.580
  210   HE22  GLN  25          1HE2      GLN  25 -24.679  -7.509 -20.123
  211    H    SER  26           H        SER  26 -32.049  -9.026 -18.645
  212    HA   SER  26           HA       SER  26 -33.764  -7.191 -20.072
  213    HB2  SER  26           2HB      SER  26 -35.162  -9.256 -20.324
  214    HB3  SER  26           3HB      SER  26 -33.485  -9.434 -20.867
  215    HG   SER  26           HG       SER  26 -34.195 -11.206 -19.558
  216    H    ARG  27           H        ARG  27 -33.585  -7.896 -16.666
  217    HA   ARG  27           HA       ARG  27 -36.490  -7.464 -16.302
  218    HB2  ARG  27           2HB      ARG  27 -36.127  -7.299 -13.876
  219    HB3  ARG  27           3HB      ARG  27 -35.774  -8.821 -14.645
  220    HG2  ARG  27           2HG      ARG  27 -34.279  -8.182 -12.789
  221    HG3  ARG  27           3HG      ARG  27 -33.462  -8.647 -14.265
  222    HD2  ARG  27           2HD      ARG  27 -32.909  -6.340 -14.778
  223    HD3  ARG  27           3HD      ARG  27 -34.062  -5.742 -13.587
  224    HE   ARG  27           HE       ARG  27 -32.627  -6.426 -11.773
  225   HH11  ARG  27          1HH1      ARG  27 -30.911  -7.142 -14.765
  226   HH12  ARG  27          2HH1      ARG  27 -29.367  -6.907 -13.917
  227   HH21  ARG  27          1HH2      ARG  27 -30.738  -6.398 -10.900
  228   HH22  ARG  27          2HH2      ARG  27 -29.260  -6.587 -11.900
  229    H    LYS  28           H        LYS  28 -37.229  -5.730 -14.730
  230    HA   LYS  28           HA       LYS  28 -37.244  -3.463 -16.436
  231    HB2  LYS  28           2HB      LYS  28 -38.466  -3.460 -13.671
  232    HB3  LYS  28           3HB      LYS  28 -39.008  -2.636 -15.096
  233    HG2  LYS  28           2HG      LYS  28 -40.514  -4.294 -15.261
  234    HG3  LYS  28           3HG      LYS  28 -39.240  -5.240 -15.978
  235    HD2  LYS  28           2HD      LYS  28 -38.847  -6.351 -13.793
  236    HD3  LYS  28           3HD      LYS  28 -39.886  -5.168 -12.989
  237    HE2  LYS  28           2HE      LYS  28 -41.207  -7.115 -13.199
  238    HE3  LYS  28           3HE      LYS  28 -41.828  -5.950 -14.359
  239    HZ1  LYS  28           HZ1      LYS  28 -40.626  -7.156 -16.120
  240    HZ2  LYS  28           HZ2      LYS  28 -40.037  -8.233 -15.034
  241    HZ3  LYS  28           HZ3      LYS  28 -41.633  -8.165 -15.336
  242    H    PHE  29           H        PHE  29 -36.748  -1.297 -16.221
  243    HA   PHE  29           HA       PHE  29 -35.546  -0.169 -13.899
  244    HB2  PHE  29           2HB      PHE  29 -33.251   0.137 -14.563
  245    HB3  PHE  29           3HB      PHE  29 -33.594  -1.563 -14.532
  246    HD1  PHE  29           HD2      PHE  29 -32.867   1.337 -16.744
  247    HD2  PHE  29           HD1      PHE  29 -33.407  -2.929 -16.505
  248    HE1  PHE  29           HE2      PHE  29 -31.899   1.079 -19.020
  249    HE2  PHE  29           HE1      PHE  29 -32.443  -3.185 -18.776
  250    HZ   PHE  29           HZ       PHE  29 -31.684  -1.176 -20.037
  251    H    ILE  30           H        ILE  30 -34.663   1.888 -14.140
  252    HA   ILE  30           HA       ILE  30 -35.316   3.471 -16.543
  253    HB   ILE  30           HB       ILE  30 -35.944   5.357 -14.939
  254   HG12  ILE  30          2HG1      ILE  30 -36.972   4.836 -12.828
  255   HG13  ILE  30          3HG1      ILE  30 -36.557   3.128 -12.962
  256   HG21  ILE  30          1HG2      ILE  30 -37.437   4.126 -16.438
  257   HG22  ILE  30          2HG2      ILE  30 -37.813   2.984 -15.134
  258   HG23  ILE  30          3HG2      ILE  30 -38.260   4.702 -14.972
  259   HD11  ILE  30          3HD1      ILE  30 -34.487   5.362 -12.790
  260   HD12  ILE  30          1HD1      ILE  30 -35.121   4.464 -11.401
  261   HD13  ILE  30          2HD1      ILE  30 -34.198   3.604 -12.633
  262    H    ILE  31           H        ILE  31 -34.277   5.634 -16.419
  263    HA   ILE  31           HA       ILE  31 -31.579   5.564 -15.163
  264    HB   ILE  31           HB       ILE  31 -32.213   6.814 -17.836
  265   HG12  ILE  31          2HG1      ILE  31 -32.638   4.375 -18.098
  266   HG13  ILE  31          3HG1      ILE  31 -31.278   4.970 -19.061
  267   HG21  ILE  31          1HG2      ILE  31 -29.745   6.780 -18.100
  268   HG22  ILE  31          2HG2      ILE  31 -30.268   7.702 -16.684
  269   HG23  ILE  31          3HG2      ILE  31 -29.592   6.087 -16.468
  270   HD11  ILE  31          3HD1      ILE  31 -30.863   3.695 -16.360
  271   HD12  ILE  31          1HD1      ILE  31 -30.857   2.776 -17.889
  272   HD13  ILE  31          2HD1      ILE  31 -29.650   4.042 -17.606
  273    H    ALA  32           H        ALA  32 -31.436   7.133 -13.812
  274    HA   ALA  32           HA       ALA  32 -32.877   9.694 -14.332
  275    HB1  ALA  32           3HB      ALA  32 -32.877   8.094 -11.751
  276    HB2  ALA  32           1HB      ALA  32 -33.132   9.839 -11.748
  277    HB3  ALA  32           2HB      ALA  32 -34.213   8.755 -12.656
  278    H    ASN  33           H        ASN  33 -32.017  11.649 -13.602
  279    HA   ASN  33           HA       ASN  33 -29.060  11.603 -13.377
  280    HB2  ASN  33           2HB      ASN  33 -29.240  14.094 -13.435
  281    HB3  ASN  33           3HB      ASN  33 -29.687  13.241 -14.889
  282   HD21  ASN  33          2HD2      ASN  33 -30.458  15.594 -15.159
  283   HD22  ASN  33          1HD2      ASN  33 -32.160  15.803 -14.779
  284    H    ALA  34           H        ALA  34 -28.231  11.112 -11.486
  285    HA   ALA  34           HA       ALA  34 -29.597  11.379  -8.989
  286    HB1  ALA  34           3HB      ALA  34 -27.901   9.648  -9.518
  287    HB2  ALA  34           1HB      ALA  34 -26.648  10.906  -9.607
  288    HB3  ALA  34           2HB      ALA  34 -27.460  10.566  -8.070
  289    H    ARG  35           H        ARG  35 -27.866  13.701 -10.748
  290    HA   ARG  35           HA       ARG  35 -26.898  15.186  -8.355
  291    HB2  ARG  35           2HB      ARG  35 -26.223  15.763 -11.250
  292    HB3  ARG  35           3HB      ARG  35 -25.379  16.303  -9.808
  293    HG2  ARG  35           2HG      ARG  35 -25.400  13.543 -11.057
  294    HG3  ARG  35           3HG      ARG  35 -24.039  14.621 -10.812
  295    HD2  ARG  35           2HD      ARG  35 -25.522  13.018  -8.693
  296    HD3  ARG  35           3HD      ARG  35 -23.887  12.753  -9.297
  297    HE   ARG  35           HE       ARG  35 -23.914  15.360  -8.250
  298   HH11  ARG  35          1HH1      ARG  35 -24.239  12.084  -7.003
  299   HH12  ARG  35          2HH1      ARG  35 -23.753  12.571  -5.396
  300   HH21  ARG  35          1HH2      ARG  35 -23.264  15.877  -6.185
  301   HH22  ARG  35          2HH2      ARG  35 -23.175  14.644  -4.965
  302    H    VAL  36           H        VAL  36 -29.733  15.268  -9.893
  303    HA   VAL  36           HA       VAL  36 -29.983  18.242  -9.880
  304    HB   VAL  36           HB       VAL  36 -30.349  16.777 -12.034
  305   HG11  VAL  36          1HG1      VAL  36 -33.152  16.685 -10.861
  306   HG12  VAL  36          2HG1      VAL  36 -32.677  16.235 -12.483
  307   HG13  VAL  36          3HG1      VAL  36 -32.087  15.277 -11.107
  308   HG21  VAL  36          3HG2      VAL  36 -31.817  18.432 -12.945
  309   HG22  VAL  36          1HG2      VAL  36 -32.266  19.009 -11.317
  310   HG23  VAL  36          2HG2      VAL  36 -30.596  19.196 -11.920
  311    H    GLU  37           H        GLU  37 -31.586  19.225  -8.693
  312    HA   GLU  37           HA       GLU  37 -32.444  17.973  -6.322
  313    HB2  GLU  37           2HB      GLU  37 -32.097  20.408  -6.756
  314    HB3  GLU  37           3HB      GLU  37 -33.607  20.443  -7.674
  315    HG2  GLU  37           2HG      GLU  37 -34.877  19.846  -5.649
  316    HG3  GLU  37           3HG      GLU  37 -33.376  19.638  -4.739
  317    H    ASN  38           H        ASN  38 -34.125  18.093  -9.416
  318    HA   ASN  38           HA       ASN  38 -36.666  17.114  -8.338
  319    HB2  ASN  38           2HB      ASN  38 -36.364  18.718 -10.302
  320    HB3  ASN  38           3HB      ASN  38 -35.762  17.346 -11.235
  321   HD21  ASN  38          2HD2      ASN  38 -37.489  17.375 -12.749
  322   HD22  ASN  38          1HD2      ASN  38 -39.135  17.003 -12.272
  323    H    CYS  39           H        CYS  39 -33.750  15.527  -9.009
  324    HA   CYS  39           HA       CYS  39 -33.100  13.432  -9.642
  325    HB2  CYS  39           2HB      CYS  39 -35.443  12.651  -7.872
  326    HB3  CYS  39           3HB      CYS  39 -33.954  11.742  -8.152
  327    HG   CYS  39           HG       CYS  39 -32.415  13.879  -7.275
  328    H    ALA  40           H        ALA  40 -34.305  14.222 -11.893
  329    HA   ALA  40           HA       ALA  40 -36.708  12.700 -12.425
  330    HB1  ALA  40           3HB      ALA  40 -36.507  15.047 -13.068
  331    HB2  ALA  40           1HB      ALA  40 -35.205  14.629 -14.214
  332    HB3  ALA  40           2HB      ALA  40 -36.858  14.010 -14.452
  333    H    VAL  41           H        VAL  41 -37.173  11.373 -14.137
  334    HA   VAL  41           HA       VAL  41 -35.220   9.361 -14.865
  335    HB   VAL  41           HB       VAL  41 -38.166   9.725 -15.521
  336   HG11  VAL  41          1HG1      VAL  41 -38.105   7.275 -16.059
  337   HG12  VAL  41          2HG1      VAL  41 -37.158   8.235 -17.194
  338   HG13  VAL  41          3HG1      VAL  41 -36.332   7.330 -15.913
  339   HG21  VAL  41          3HG2      VAL  41 -36.810   7.929 -13.468
  340   HG22  VAL  41          1HG2      VAL  41 -37.780   9.377 -13.116
  341   HG23  VAL  41          2HG2      VAL  41 -38.552   7.980 -13.849
  342    H    ILE  42           H        ILE  42 -33.760  10.408 -16.159
  343    HA   ILE  42           HA       ILE  42 -34.441  11.968 -18.507
  344    HB   ILE  42           HB       ILE  42 -32.030  11.821 -19.001
  345   HG12  ILE  42          2HG1      ILE  42 -31.826  10.089 -16.490
  346   HG13  ILE  42          3HG1      ILE  42 -31.637   9.495 -18.144
  347   HG21  ILE  42          1HG2      ILE  42 -31.310  13.174 -17.123
  348   HG22  ILE  42          2HG2      ILE  42 -33.015  13.515 -17.421
  349   HG23  ILE  42          3HG2      ILE  42 -32.548  12.469 -16.064
  350   HD11  ILE  42          3HD1      ILE  42 -29.705  11.045 -18.429
  351   HD12  ILE  42          1HD1      ILE  42 -29.836  11.443 -16.688
  352   HD13  ILE  42          2HD1      ILE  42 -29.482   9.785 -17.198
  353    H    TYR  43           H        TYR  43 -34.084   8.566 -17.895
  354    HA   TYR  43           HA       TYR  43 -35.133   7.976 -20.560
  355    HB2  TYR  43           2HB      TYR  43 -32.597   8.098 -20.924
  356    HB3  TYR  43           3HB      TYR  43 -32.464   6.690 -19.930
  357    HD1  TYR  43           HD1      TYR  43 -33.971   7.985 -23.077
  358    HD2  TYR  43           HD2      TYR  43 -32.855   4.488 -20.802
  359    HE1  TYR  43           HE1      TYR  43 -34.382   6.544 -25.073
  360    HE2  TYR  43           HE2      TYR  43 -33.246   3.062 -22.796
  361    HH   TYR  43           HH       TYR  43 -33.798   3.009 -25.025
  362    H    CYS  44           H        CYS  44 -35.729   5.668 -20.885
  363    HA   CYS  44           HA       CYS  44 -36.045   4.160 -18.395
  364    HB2  CYS  44           2HB      CYS  44 -38.584   4.117 -18.720
  365    HB3  CYS  44           3HB      CYS  44 -37.883   5.628 -18.116
  366    HG   CYS  44           HG       CYS  44 -37.757   6.877 -20.368
  367    H    ASN  45           H        ASN  45 -36.561   1.956 -18.613
  368    HA   ASN  45           HA       ASN  45 -36.190   0.941 -21.372
  369    HB2  ASN  45           2HB      ASN  45 -34.756   0.234 -19.409
  370    HB3  ASN  45           3HB      ASN  45 -36.148  -0.658 -18.797
  371   HD21  ASN  45          2HD2      ASN  45 -35.637  -2.830 -19.228
  372   HD22  ASN  45          1HD2      ASN  45 -35.181  -3.384 -20.829
  373    H    ASP  46           H        ASP  46 -37.409  -0.937 -22.127
  374    HA   ASP  46           HA       ASP  46 -40.260  -0.516 -21.936
  375    HB2  ASP  46           2HB      ASP  46 -40.504  -2.267 -23.475
  376    HB3  ASP  46           3HB      ASP  46 -39.056  -1.394 -23.951
  377    H    GLY  47           H        GLY  47 -38.037  -2.548 -20.142
  378    HA2  GLY  47           HA2      GLY  47 -39.813  -4.302 -18.821
  379    HA3  GLY  47           HA3      GLY  47 -38.345  -3.612 -18.131
  380    H    PHE  48           H        PHE  48 -38.949  -0.889 -17.799
  381    HA   PHE  48           HA       PHE  48 -40.788  -0.728 -15.616
  382    HB2  PHE  48           2HB      PHE  48 -39.698   1.250 -15.506
  383    HB3  PHE  48           3HB      PHE  48 -39.181   1.167 -17.180
  384    HD1  PHE  48           HD1      PHE  48 -40.413   2.352 -18.966
  385    HD2  PHE  48           HD2      PHE  48 -41.920   2.290 -14.922
  386    HE1  PHE  48           HE1      PHE  48 -42.379   3.677 -19.663
  387    HE2  PHE  48           HE2      PHE  48 -43.849   3.670 -15.626
  388    HZ   PHE  48           HZ       PHE  48 -44.109   4.328 -18.010
  389    H    CYS  49           H        CYS  49 -41.240  -0.446 -19.104
  390    HA   CYS  49           HA       CYS  49 -43.895   0.691 -19.016
  391    HB2  CYS  49           2HB      CYS  49 -42.239   0.646 -20.997
  392    HB3  CYS  49           3HB      CYS  49 -42.873  -0.984 -21.323
  393    HG   CYS  49           HG       CYS  49 -45.422  -0.247 -21.331
  394    H    GLU  50           H        GLU  50 -42.686  -2.675 -19.050
  395    HA   GLU  50           HA       GLU  50 -45.375  -3.851 -18.999
  396    HB2  GLU  50           2HB      GLU  50 -42.696  -5.083 -18.245
  397    HB3  GLU  50           3HB      GLU  50 -44.216  -5.943 -18.519
  398    HG2  GLU  50           2HG      GLU  50 -44.224  -5.007 -20.876
  399    HG3  GLU  50           3HG      GLU  50 -42.593  -4.407 -20.580
  400    H    LEU  51           H        LEU  51 -43.070  -2.800 -16.553
  401    HA   LEU  51           HA       LEU  51 -44.189  -4.037 -14.250
  402    HB2  LEU  51           2HB      LEU  51 -41.946  -3.026 -14.443
  403    HB3  LEU  51           3HB      LEU  51 -42.649  -1.441 -14.616
  404    HG   LEU  51           HG       LEU  51 -43.603  -1.529 -12.376
  405   HD11  LEU  51          1HD1      LEU  51 -41.918  -4.056 -12.076
  406   HD12  LEU  51          2HD1      LEU  51 -42.735  -3.194 -10.756
  407   HD13  LEU  51          3HD1      LEU  51 -43.694  -3.976 -12.021
  408   HD21  LEU  51          3HD2      LEU  51 -41.458  -1.173 -11.211
  409   HD22  LEU  51          1HD2      LEU  51 -40.599  -1.958 -12.561
  410   HD23  LEU  51          2HD2      LEU  51 -41.463  -0.419 -12.812
  411    H    CYS  52           H        CYS  52 -44.607  -0.674 -15.414
  412    HA   CYS  52           HA       CYS  52 -46.897  -0.259 -13.590
  413    HB2  CYS  52           2HB      CYS  52 -45.429   1.616 -15.491
  414    HB3  CYS  52           3HB      CYS  52 -46.671   2.086 -14.307
  415    HG   CYS  52           HG       CYS  52 -44.314   2.780 -13.395
  416    H    GLY  53           H        GLY  53 -46.406  -0.979 -16.989
  417    HA2  GLY  53           HA2      GLY  53 -47.984  -1.589 -18.572
  418    HA3  GLY  53           HA3      GLY  53 -49.271  -1.305 -17.409
  419    H    TYR  54           H        TYR  54 -47.278   1.471 -17.818
  420    HA   TYR  54           HA       TYR  54 -49.406   2.804 -19.409
  421    HB2  TYR  54           2HB      TYR  54 -47.318   3.868 -17.502
  422    HB3  TYR  54           3HB      TYR  54 -48.239   4.905 -18.579
  423    HD1  TYR  54           HD1      TYR  54 -50.712   5.057 -18.474
  424    HD2  TYR  54           HD2      TYR  54 -48.400   2.987 -15.479
  425    HE1  TYR  54           HE1      TYR  54 -52.642   5.166 -16.911
  426    HE2  TYR  54           HE2      TYR  54 -50.334   3.096 -13.913
  427    HH   TYR  54           HH       TYR  54 -53.438   4.647 -14.836
  428    H    SER  55           H        SER  55 -46.532   4.565 -19.613
  429    HA   SER  55           HA       SER  55 -45.475   3.415 -22.073
  430    HB2  SER  55           2HB      SER  55 -47.485   4.480 -22.976
  431    HB3  SER  55           3HB      SER  55 -47.075   6.003 -22.169
  432    HG   SER  55           HG       SER  55 -46.444   5.858 -24.431
  433    H    ARG  56           H        ARG  56 -43.577   4.458 -22.737
  434    HA   ARG  56           HA       ARG  56 -41.883   5.605 -20.679
  435    HB2  ARG  56           2HB      ARG  56 -41.555   5.487 -23.719
  436    HB3  ARG  56           3HB      ARG  56 -40.300   5.942 -22.573
  437    HG2  ARG  56           2HG      ARG  56 -40.897   3.615 -21.426
  438    HG3  ARG  56           3HG      ARG  56 -41.586   3.223 -23.002
  439    HD2  ARG  56           2HD      ARG  56 -38.734   4.053 -22.379
  440    HD3  ARG  56           3HD      ARG  56 -39.273   2.410 -22.731
  441    HE   ARG  56           HE       ARG  56 -40.022   3.749 -24.995
  442   HH11  ARG  56          1HH1      ARG  56 -36.946   3.603 -23.289
  443   HH12  ARG  56          2HH1      ARG  56 -36.031   3.866 -24.753
  444   HH21  ARG  56          1HH2      ARG  56 -38.760   4.088 -26.821
  445   HH22  ARG  56          2HH2      ARG  56 -37.026   4.116 -26.678
  446    H    ALA  57           H        ALA  57 -43.812   7.125 -23.219
  447    HA   ALA  57           HA       ALA  57 -42.888   9.806 -22.867
  448    HB1  ALA  57           3HB      ALA  57 -45.606   8.742 -23.758
  449    HB2  ALA  57           1HB      ALA  57 -44.988  10.386 -24.027
  450    HB3  ALA  57           2HB      ALA  57 -44.192   9.007 -24.808
  451    H    GLU  58           H        GLU  58 -44.927   7.844 -20.788
  452    HA   GLU  58           HA       GLU  58 -46.075  10.123 -19.331
  453    HB2  GLU  58           2HB      GLU  58 -46.165   7.153 -18.697
  454    HB3  GLU  58           3HB      GLU  58 -47.128   8.408 -17.961
  455    HG2  GLU  58           2HG      GLU  58 -47.286   7.821 -20.951
  456    HG3  GLU  58           3HG      GLU  58 -48.228   6.949 -19.775
  457    H    VAL  59           H        VAL  59 -43.144   8.210 -19.184
  458    HA   VAL  59           HA       VAL  59 -42.590   9.250 -16.434
  459    HB   VAL  59           HB       VAL  59 -40.767   7.561 -16.329
  460   HG11  VAL  59          1HG1      VAL  59 -42.965   7.345 -15.181
  461   HG12  VAL  59          2HG1      VAL  59 -43.587   6.454 -16.588
  462   HG13  VAL  59          3HG1      VAL  59 -42.242   5.795 -15.619
  463   HG21  VAL  59          3HG2      VAL  59 -42.197   6.248 -18.633
  464   HG22  VAL  59          1HG2      VAL  59 -40.623   7.068 -18.748
  465   HG23  VAL  59          2HG2      VAL  59 -40.799   5.631 -17.727
  466    H    MET  60           H        MET  60 -41.670   9.767 -19.705
  467    HA   MET  60           HA       MET  60 -39.071  10.628 -19.603
  468    HB2  MET  60           2HB      MET  60 -41.549  11.564 -21.058
  469    HB3  MET  60           3HB      MET  60 -40.122  12.584 -21.146
  470    HG2  MET  60           2HG      MET  60 -40.113   9.657 -21.905
  471    HG3  MET  60           3HG      MET  60 -40.346  10.991 -23.026
  472    HE1  MET  60           3HE      MET  60 -37.986   8.467 -22.280
  473    HE2  MET  60           1HE      MET  60 -36.431   9.196 -21.829
  474    HE3  MET  60           2HE      MET  60 -37.761   9.144 -20.649
  475    H    GLN  61           H        GLN  61 -38.178  11.616 -17.977
  476    HA   GLN  61           HA       GLN  61 -37.437  13.258 -16.694
  477    HB2  GLN  61           2HB      GLN  61 -39.162  15.149 -18.299
  478    HB3  GLN  61           3HB      GLN  61 -37.682  15.538 -17.434
  479    HG2  GLN  61           2HG      GLN  61 -36.315  14.726 -19.110
  480    HG3  GLN  61           3HG      GLN  61 -37.368  13.383 -19.518
  481   HE21  GLN  61          2HE2      GLN  61 -37.763  13.494 -21.658
  482   HE22  GLN  61          1HE2      GLN  61 -38.417  14.911 -22.446
  483    H    ARG  62           H        ARG  62 -39.990  11.810 -15.908
  484    HA   ARG  62           HA       ARG  62 -41.158  13.653 -13.912
  485    HB2  ARG  62           2HB      ARG  62 -41.562  10.738 -14.728
  486    HB3  ARG  62           3HB      ARG  62 -42.130  11.299 -13.176
  487    HG2  ARG  62           2HG      ARG  62 -43.937  11.335 -14.629
  488    HG3  ARG  62           3HG      ARG  62 -43.530  13.000 -14.223
  489    HD2  ARG  62           2HD      ARG  62 -42.695  11.669 -16.821
  490    HD3  ARG  62           3HD      ARG  62 -44.283  12.388 -16.630
  491    HE   ARG  62           HE       ARG  62 -41.875  13.762 -17.211
  492   HH11  ARG  62          1HH1      ARG  62 -44.904  14.311 -15.532
  493   HH12  ARG  62          2HH1      ARG  62 -44.762  16.042 -15.676
  494   HH21  ARG  62          1HH2      ARG  62 -41.720  15.948 -17.276
  495   HH22  ARG  62          2HH2      ARG  62 -43.007  16.940 -16.656
  496    HA   PRO  63           HA       PRO  63 -38.334  12.629 -10.644
  497    HB2  PRO  63           2HB      PRO  63 -40.666  11.932  -8.873
  498    HB3  PRO  63           3HB      PRO  63 -39.296  13.040  -8.560
  499    HG2  PRO  63           2HG      PRO  63 -41.739  14.026  -9.208
  500    HG3  PRO  63           3HG      PRO  63 -40.261  14.739  -9.935
  501    HD2  PRO  63           2HD      PRO  63 -42.151  12.699 -11.148
  502    HD3  PRO  63           3HD      PRO  63 -41.484  14.194 -11.872
  503    H    CYS  64           H        CYS  64 -37.141  10.845 -10.140
  504    HA   CYS  64           HA       CYS  64 -38.031   8.123 -10.604
  505    HB2  CYS  64           2HB      CYS  64 -35.704   9.056 -10.867
  506    HB3  CYS  64           3HB      CYS  64 -35.596   9.176  -9.103
  507    HG   CYS  64           HG       CYS  64 -36.314   6.570  -8.772
  508    H    THR  65           H        THR  65 -38.221  10.243  -7.851
  509    HA   THR  65           HA       THR  65 -38.347   8.534  -5.682
  510    HB   THR  65           HB       THR  65 -40.044  11.033  -5.896
  511    HG1  THR  65           HG1      THR  65 -38.219  12.209  -5.398
  512   HG21  THR  65          1HG2      THR  65 -38.371   9.745  -3.706
  513   HG22  THR  65          2HG2      THR  65 -39.268  11.276  -3.539
  514   HG23  THR  65          3HG2      THR  65 -40.146   9.758  -3.787
  515    H    CYS  66           H        CYS  66 -39.464   6.755  -5.999
  516    HA   CYS  66           HA       CYS  66 -41.812   6.131  -7.115
  517    HB2  CYS  66           2HB      CYS  66 -40.908   4.964  -4.448
  518    HB3  CYS  66           3HB      CYS  66 -41.941   4.172  -5.655
  519    HG   CYS  66           HG       CYS  66 -40.168   4.203  -7.607
  520    H    ASP  67           H        ASP  67 -41.847   8.173  -4.376
  521    HA   ASP  67           HA       ASP  67 -44.487   7.813  -3.325
  522    HB2  ASP  67           2HB      ASP  67 -42.602   9.302  -2.465
  523    HB3  ASP  67           3HB      ASP  67 -42.917  10.391  -3.804
  524    H    PHE  68           H        PHE  68 -43.259   9.516  -6.209
  525    HA   PHE  68           HA       PHE  68 -45.672  10.646  -7.222
  526    HB2  PHE  68           2HB      PHE  68 -43.299  11.129  -7.902
  527    HB3  PHE  68           3HB      PHE  68 -43.226   9.557  -8.682
  528    HD1  PHE  68           HD1      PHE  68 -44.704  12.958  -8.815
  529    HD2  PHE  68           HD2      PHE  68 -44.289   9.177 -10.850
  530    HE1  PHE  68           HE1      PHE  68 -45.615  13.973 -10.892
  531    HE2  PHE  68           HE2      PHE  68 -45.225  10.187 -12.915
  532    HZ   PHE  68           HZ       PHE  68 -45.890  12.586 -12.940
  533    H    LEU  69           H        LEU  69 -44.688   7.351  -6.998
  534    HA   LEU  69           HA       LEU  69 -46.710   6.395  -8.945
  535    HB2  LEU  69           2HB      LEU  69 -43.974   5.908  -8.868
  536    HB3  LEU  69           3HB      LEU  69 -44.585   4.541  -7.978
  537    HG   LEU  69           HG       LEU  69 -44.217   4.020 -10.307
  538   HD11  LEU  69          1HD1      LEU  69 -46.112   2.889  -9.193
  539   HD12  LEU  69          2HD1      LEU  69 -47.212   4.110  -9.864
  540   HD13  LEU  69          3HD1      LEU  69 -46.321   3.029 -10.951
  541   HD21  LEU  69          3HD2      LEU  69 -45.403   5.022 -12.154
  542   HD22  LEU  69          1HD2      LEU  69 -46.298   6.102 -11.072
  543   HD23  LEU  69          2HD2      LEU  69 -44.540   6.282 -11.258
  544    H    HIS  70           H        HIS  70 -46.965   7.183  -5.905
  545    HA   HIS  70           HA       HIS  70 -47.634   4.873  -4.430
  546    HB2  HIS  70           2HB      HIS  70 -48.687   7.699  -4.426
  547    HB3  HIS  70           3HB      HIS  70 -49.533   6.484  -3.492
  548    HD2  HIS  70           HD2      HIS  70 -47.323   9.046  -2.673
  549    HE1  HIS  70           HE1      HIS  70 -45.787   5.844  -0.320
  550    HE2  HIS  70           HE2      HIS  70 -45.728   8.395  -0.712
  551    H    GLY  71           H        GLY  71 -49.172   3.473  -4.338
  552    HA2  GLY  71           HA2      GLY  71 -51.828   3.936  -5.615
  553    HA3  GLY  71           HA3      GLY  71 -51.010   2.375  -5.753
  554    HA   PRO  72           HA       PRO  72 -53.745   2.765  -1.891
  555    HB2  PRO  72           2HB      PRO  72 -55.040   0.344  -3.146
  556    HB3  PRO  72           3HB      PRO  72 -55.800   1.682  -2.226
  557    HG2  PRO  72           2HG      PRO  72 -55.971   1.640  -4.920
  558    HG3  PRO  72           3HG      PRO  72 -55.567   3.180  -4.089
  559    HD2  PRO  72           2HD      PRO  72 -53.676   1.204  -5.401
  560    HD3  PRO  72           3HD      PRO  72 -53.755   2.979  -5.583
  561    H    ARG  73           H        ARG  73 -51.715   0.322  -3.192
  562    HA   ARG  73           HA       ARG  73 -51.588  -1.202  -0.623
  563    HB2  ARG  73           2HB      ARG  73 -51.999  -2.313  -2.895
  564    HB3  ARG  73           3HB      ARG  73 -50.312  -1.936  -3.281
  565    HG2  ARG  73           2HG      ARG  73 -49.563  -3.338  -1.380
  566    HG3  ARG  73           3HG      ARG  73 -51.254  -3.605  -0.899
  567    HD2  ARG  73           2HD      ARG  73 -51.670  -4.696  -3.103
  568    HD3  ARG  73           3HD      ARG  73 -49.957  -4.466  -3.514
  569    HE   ARG  73           HE       ARG  73 -49.952  -5.812  -1.072
  570   HH11  ARG  73          1HH2      ARG  73 -51.199  -6.606  -4.280
  571   HH12  ARG  73          2HH2      ARG  73 -51.128  -8.315  -3.949
  572   HH21  ARG  73          1HH1      ARG  73 -49.862  -8.004  -0.775
  573   HH22  ARG  73          2HH1      ARG  73 -50.363  -9.078  -2.046
  574    H    THR  74           H        THR  74 -49.934   1.394  -2.120
  575    HA   THR  74           HA       THR  74 -47.248   0.498  -1.447
  576    HB   THR  74           HB       THR  74 -47.987   3.354  -2.040
  577    HG1  THR  74           HG1      THR  74 -47.191   1.711  -4.109
  578   HG21  THR  74          1HG2      THR  74 -45.515   1.640  -2.554
  579   HG22  THR  74          2HG2      THR  74 -45.742   3.291  -3.181
  580   HG23  THR  74          3HG2      THR  74 -45.644   3.016  -1.440
  581    H    GLN  75           H        GLN  75 -45.911   1.006   0.194
  582    HA   GLN  75           HA       GLN  75 -47.174   2.076   2.639
  583    HB2  GLN  75           2HB      GLN  75 -44.419   0.976   2.140
  584    HB3  GLN  75           3HB      GLN  75 -45.030   1.465   3.712
  585    HG2  GLN  75           2HG      GLN  75 -46.672  -0.305   3.734
  586    HG3  GLN  75           3HG      GLN  75 -46.348  -0.728   2.053
  587   HE21  GLN  75          2HE2      GLN  75 -44.403  -1.903   1.516
  588   HE22  GLN  75          1HE2      GLN  75 -43.434  -2.678   2.762
  589    H    ARG  76           H        ARG  76 -46.919   4.003   3.378
  590    HA   ARG  76           HA       ARG  76 -45.716   6.102   1.742
  591    HB2  ARG  76           2HB      ARG  76 -46.772   6.466   4.516
  592    HB3  ARG  76           3HB      ARG  76 -46.665   7.662   3.226
  593    HG2  ARG  76           2HG      ARG  76 -48.625   5.354   3.489
  594    HG3  ARG  76           3HG      ARG  76 -48.978   7.073   3.460
  595    HD2  ARG  76           2HD      ARG  76 -48.431   7.189   1.061
  596    HD3  ARG  76           3HD      ARG  76 -47.930   5.487   1.076
  597    HE   ARG  76           HE       ARG  76 -50.659   5.921   2.013
  598   HH11  ARG  76          1HH1      ARG  76 -48.859   5.325  -0.981
  599   HH12  ARG  76          2HH1      ARG  76 -50.187   4.378  -1.625
  600   HH21  ARG  76          1HH2      ARG  76 -52.284   4.808   1.004
  601   HH22  ARG  76          2HH2      ARG  76 -52.039   4.209  -0.614
  602    H    ARG  77           H        ARG  77 -44.844   4.631   4.824
  603    HA   ARG  77           HA       ARG  77 -42.381   5.996   5.285
  604    HB2  ARG  77           2HB      ARG  77 -41.789   4.148   6.695
  605    HB3  ARG  77           3HB      ARG  77 -43.466   4.657   6.948
  606    HG2  ARG  77           2HG      ARG  77 -44.223   2.708   5.580
  607    HG3  ARG  77           3HG      ARG  77 -42.548   2.145   5.465
  608    HD2  ARG  77           2HD      ARG  77 -43.933   2.687   8.127
  609    HD3  ARG  77           3HD      ARG  77 -44.069   1.151   7.264
  610    HE   ARG  77           HE       ARG  77 -41.304   1.765   7.482
  611   HH11  ARG  77          1HH2      ARG  77 -43.916   0.806   9.611
  612   HH12  ARG  77          2HH2      ARG  77 -42.833   0.050  10.749
  613   HH21  ARG  77          2HH1      ARG  77 -39.978   0.781   8.979
  614   HH22  ARG  77          1HH1      ARG  77 -40.668   0.040  10.391
  615    H    ALA  78           H        ALA  78 -43.057   3.252   3.186
  616    HA   ALA  78           HA       ALA  78 -40.319   2.685   2.461
  617    HB1  ALA  78           3HB      ALA  78 -42.117   1.054   2.052
  618    HB2  ALA  78           1HB      ALA  78 -42.889   2.150   0.864
  619    HB3  ALA  78           2HB      ALA  78 -41.321   1.515   0.554
  620    H    ALA  79           H        ALA  79 -42.909   4.650   0.890
  621    HA   ALA  79           HA       ALA  79 -41.204   5.615  -1.230
  622    HB1  ALA  79           3HB      ALA  79 -43.007   7.216  -1.602
  623    HB2  ALA  79           1HB      ALA  79 -43.660   5.591  -1.319
  624    HB3  ALA  79           2HB      ALA  79 -43.712   6.831  -0.024
  625    H    ALA  80           H        ALA  80 -41.891   6.897   2.025
  626    HA   ALA  80           HA       ALA  80 -40.513   9.357   1.756
  627    HB1  ALA  80           3HB      ALA  80 -41.047   7.641   4.215
  628    HB2  ALA  80           1HB      ALA  80 -40.586   9.358   4.228
  629    HB3  ALA  80           2HB      ALA  80 -42.141   8.862   3.526
  630    H    GLN  81           H        GLN  81 -39.291   6.265   3.245
  631    HA   GLN  81           HA       GLN  81 -36.576   6.956   3.558
  632    HB2  GLN  81           2HB      GLN  81 -37.944   4.354   2.836
  633    HB3  GLN  81           3HB      GLN  81 -36.197   4.466   3.078
  634    HG2  GLN  81           2HG      GLN  81 -36.437   5.194   5.358
  635    HG3  GLN  81           3HG      GLN  81 -38.185   5.382   5.192
  636   HE21  GLN  81          2HE2      GLN  81 -39.454   3.408   4.721
  637   HE22  GLN  81          1HE2      GLN  81 -38.870   1.854   5.348
  638    H    ILE  82           H        ILE  82 -38.207   5.831   0.526
  639    HA   ILE  82           HA       ILE  82 -35.785   5.921  -1.046
  640    HB   ILE  82           HB       ILE  82 -38.735   5.969  -1.675
  641   HG12  ILE  82          2HG1      ILE  82 -36.527   4.008  -2.458
  642   HG13  ILE  82          3HG1      ILE  82 -37.366   3.919  -0.906
  643   HG21  ILE  82          1HG2      ILE  82 -38.109   5.826  -4.111
  644   HG22  ILE  82          2HG2      ILE  82 -37.806   7.405  -3.377
  645   HG23  ILE  82          3HG2      ILE  82 -36.449   6.293  -3.657
  646   HD11  ILE  82          3HD1      ILE  82 -38.658   3.648  -3.628
  647   HD12  ILE  82          1HD1      ILE  82 -38.438   2.411  -2.374
  648   HD13  ILE  82          2HD1      ILE  82 -39.538   3.783  -2.081
  649    H    ALA  83           H        ALA  83 -38.372   8.402  -0.584
  650    HA   ALA  83           HA       ALA  83 -37.174  10.469  -2.055
  651    HB1  ALA  83           3HB      ALA  83 -39.449  10.494  -1.012
  652    HB2  ALA  83           1HB      ALA  83 -38.682  10.774   0.566
  653    HB3  ALA  83           2HB      ALA  83 -38.501  11.975  -0.717
  654    H    GLN  84           H        GLN  84 -36.339   9.363   1.222
  655    HA   GLN  84           HA       GLN  84 -34.439  11.507   1.723
  656    HB2  GLN  84           2HB      GLN  84 -34.317   8.772   3.014
  657    HB3  GLN  84           3HB      GLN  84 -33.637  10.286   3.571
  658    HG2  GLN  84           2HG      GLN  84 -36.466   9.342   3.690
  659    HG3  GLN  84           3HG      GLN  84 -35.462   9.898   4.972
  660   HE21  GLN  84          1HE2      GLN  84 -37.868  10.791   2.706
  661   HE22  GLN  84          2HE2      GLN  84 -37.880  12.523   3.068
  662    H    ALA  85           H        ALA  85 -34.212   8.243   0.251
  663    HA   ALA  85           HA       ALA  85 -31.320   8.248   0.100
  664    HB1  ALA  85           3HB      ALA  85 -31.658   6.233  -1.260
  665    HB2  ALA  85           1HB      ALA  85 -32.671   6.175   0.194
  666    HB3  ALA  85           2HB      ALA  85 -33.394   6.573  -1.382
  667    H    LEU  86           H        LEU  86 -33.886   9.539  -1.931
  668    HA   LEU  86           HA       LEU  86 -32.039   9.980  -4.189
  669    HB2  LEU  86           2HB      LEU  86 -34.911  10.898  -3.928
  670    HB3  LEU  86           3HB      LEU  86 -33.904  10.882  -5.362
  671    HG   LEU  86           HG       LEU  86 -35.385   8.655  -4.025
  672   HD11  LEU  86          1HD1      LEU  86 -35.916   8.078  -6.325
  673   HD12  LEU  86          2HD1      LEU  86 -36.103   9.831  -6.116
  674   HD13  LEU  86          3HD1      LEU  86 -34.674   9.194  -6.940
  675   HD21  LEU  86          3HD2      LEU  86 -33.155   7.594  -4.016
  676   HD22  LEU  86          1HD2      LEU  86 -34.093   6.927  -5.340
  677   HD23  LEU  86          2HD2      LEU  86 -32.847   8.150  -5.675
  678    H    LEU  87           H        LEU  87 -33.624  11.887  -1.626
  679    HA   LEU  87           HA       LEU  87 -32.590  14.453  -2.168
  680    HB2  LEU  87           2HB      LEU  87 -34.300  14.180  -0.531
  681    HB3  LEU  87           3HB      LEU  87 -33.498  12.798   0.148
  682    HG   LEU  87           HG       LEU  87 -31.668  14.556   0.998
  683   HD11  LEU  87          1HD1      LEU  87 -32.923  16.573   1.682
  684   HD12  LEU  87          2HD1      LEU  87 -33.027  16.358  -0.088
  685   HD13  LEU  87          3HD1      LEU  87 -34.404  15.903   0.931
  686   HD21  LEU  87          3HD2      LEU  87 -34.313  13.897   2.336
  687   HD22  LEU  87          1HD2      LEU  87 -32.801  12.961   2.441
  688   HD23  LEU  87          2HD2      LEU  87 -32.881  14.584   3.135
  689    H    GLY  88           H        GLY  88 -31.135  11.622  -0.542
  690    HA2  GLY  88           HA2      GLY  88 -28.829  11.099  -1.027
  691    HA3  GLY  88           HA3      GLY  88 -28.413  12.809  -0.991
  692    H    ALA  89           H        ALA  89 -30.474  11.349   1.525
  693    HA   ALA  89           HA       ALA  89 -28.707  12.088   3.680
  694    HB1  ALA  89           3HB      ALA  89 -30.278  10.751   5.049
  695    HB2  ALA  89           1HB      ALA  89 -31.138  11.851   3.956
  696    HB3  ALA  89           2HB      ALA  89 -31.035  10.115   3.575
  697    H    GLU  90           H        GLU  90 -29.441   8.937   2.170
  698    HA   GLU  90           HA       GLU  90 -26.696   8.086   2.164
  699    HB2  GLU  90           2HB      GLU  90 -27.045   5.957   3.371
  700    HB3  GLU  90           3HB      GLU  90 -27.121   7.354   4.434
  701    HG2  GLU  90           2HG      GLU  90 -29.596   7.215   4.485
  702    HG3  GLU  90           3HG      GLU  90 -29.552   5.847   3.370
  703    H    GLU  91           H        GLU  91 -26.405   6.332   0.618
  704    HA   GLU  91           HA       GLU  91 -28.756   5.877  -1.156
  705    HB2  GLU  91           2HB      GLU  91 -25.824   5.097  -1.376
  706    HB3  GLU  91           3HB      GLU  91 -27.093   4.413  -2.394
  707    HG2  GLU  91           2HG      GLU  91 -26.387   6.194  -3.685
  708    HG3  GLU  91           3HG      GLU  91 -27.850   6.799  -2.906
  709    H    ARG  92           H        ARG  92 -30.124   4.409  -0.772
  710    HA   ARG  92           HA       ARG  92 -29.426   1.888   0.660
  711    HB2  ARG  92           2HB      ARG  92 -30.011   3.649   2.337
  712    HB3  ARG  92           3HB      ARG  92 -31.566   3.872   1.550
  713    HG2  ARG  92           2HG      ARG  92 -31.873   2.526   3.524
  714    HG3  ARG  92           3HG      ARG  92 -32.190   1.533   2.109
  715    HD2  ARG  92           2HD      ARG  92 -30.971   0.253   3.760
  716    HD3  ARG  92           3HD      ARG  92 -29.951   0.481   2.336
  717    HE   ARG  92           HE       ARG  92 -29.409   2.582   4.227
  718   HH11  ARG  92          1HH1      ARG  92 -28.780  -0.871   3.952
  719   HH12  ARG  92          2HH1      ARG  92 -27.373  -0.750   4.974
  720   HH21  ARG  92          1HH2      ARG  92 -27.758   2.659   5.440
  721   HH22  ARG  92          2HH2      ARG  92 -26.772   1.244   5.832
  722    H    LYS  93           H        LYS  93 -30.553   0.183   0.107
  723    HA   LYS  93           HA       LYS  93 -32.619   0.275  -2.003
  724    HB2  LYS  93           2HB      LYS  93 -30.757  -1.310  -2.107
  725    HB3  LYS  93           3HB      LYS  93 -31.322  -2.055  -0.591
  726    HG2  LYS  93           2HG      LYS  93 -33.557  -2.395  -1.964
  727    HG3  LYS  93           3HG      LYS  93 -32.519  -2.080  -3.357
  728    HD2  LYS  93           2HD      LYS  93 -32.049  -4.224  -1.252
  729    HD3  LYS  93           3HD      LYS  93 -32.730  -4.501  -2.858
  730    HE2  LYS  93           2HE      LYS  93 -30.625  -3.534  -3.858
  731    HE3  LYS  93           3HE      LYS  93 -29.932  -3.442  -2.231
  732    HZ1  LYS  93           HZ1      LYS  93 -30.242  -5.897  -2.091
  733    HZ2  LYS  93           HZ2      LYS  93 -30.788  -5.901  -3.649
  734    HZ3  LYS  93           HZ3      LYS  93 -29.246  -5.480  -3.325
  735    H    VAL  94           H        VAL  94 -34.715   0.050  -1.668
  736    HA   VAL  94           HA       VAL  94 -35.820  -0.789   0.978
  737    HB   VAL  94           HB       VAL  94 -36.969   1.587  -0.508
  738   HG11  VAL  94          1HG1      VAL  94 -38.357   0.558   1.276
  739   HG12  VAL  94          2HG1      VAL  94 -37.037   0.795   2.441
  740   HG13  VAL  94          3HG1      VAL  94 -37.866   2.186   1.710
  741   HG21  VAL  94          3HG2      VAL  94 -35.834   3.148   1.053
  742   HG22  VAL  94          1HG2      VAL  94 -34.838   1.807   1.661
  743   HG23  VAL  94          2HG2      VAL  94 -34.695   2.362  -0.027
  744    H    GLU  95           H        GLU  95 -37.961  -1.558   0.877
  745    HA   GLU  95           HA       GLU  95 -38.752  -2.733  -1.717
  746    HB2  GLU  95           2HB      GLU  95 -40.407  -3.904  -0.420
  747    HB3  GLU  95           3HB      GLU  95 -38.823  -4.040   0.381
  748    HG2  GLU  95           2HG      GLU  95 -39.499  -2.289   2.010
  749    HG3  GLU  95           3HG      GLU  95 -41.061  -2.124   1.206
  750    H    ILE  96           H        ILE  96 -40.986  -2.328  -2.540
  751    HA   ILE  96           HA       ILE  96 -42.610  -0.293  -1.463
  752    HB   ILE  96           HB       ILE  96 -42.431   1.003  -3.894
  753   HG12  ILE  96          2HG1      ILE  96 -40.158   1.756  -4.313
  754   HG13  ILE  96          3HG1      ILE  96 -39.521   0.626  -3.113
  755   HG21  ILE  96          1HG2      ILE  96 -41.723   2.927  -2.802
  756   HG22  ILE  96          2HG2      ILE  96 -42.715   2.015  -1.659
  757   HG23  ILE  96          3HG2      ILE  96 -40.937   2.014  -1.511
  758   HD11  ILE  96          3HD1      ILE  96 -39.223  -0.218  -5.409
  759   HD12  ILE  96          1HD1      ILE  96 -40.284  -1.263  -4.473
  760   HD13  ILE  96          2HD1      ILE  96 -40.992  -0.141  -5.648
  761    H    ALA  97           H        ALA  97 -44.610  -0.110  -2.492
  762    HA   ALA  97           HA       ALA  97 -45.177  -2.390  -4.286
  763    HB1  ALA  97           3HB      ALA  97 -46.666  -1.794  -2.259
  764    HB2  ALA  97           1HB      ALA  97 -47.298  -0.501  -3.313
  765    HB3  ALA  97           2HB      ALA  97 -47.448  -2.177  -3.800
  766    H    PHE  98           H        PHE  98 -46.068  -2.249  -6.306
  767    HA   PHE  98           HA       PHE  98 -46.209   0.422  -7.659
  768    HB2  PHE  98           2HB      PHE  98 -45.239  -2.253  -8.676
  769    HB3  PHE  98           3HB      PHE  98 -45.893  -1.055  -9.778
  770    HD1  PHE  98           HD1      PHE  98 -44.784   1.101 -10.159
  771    HD2  PHE  98           HD2      PHE  98 -43.017  -1.935  -7.660
  772    HE1  PHE  98           HE1      PHE  98 -42.611   2.301 -10.242
  773    HE2  PHE  98           HE2      PHE  98 -40.834  -0.754  -7.793
  774    HZ   PHE  98           HZ       PHE  98 -40.652   1.400  -9.018
  775    H    TYR  99           H        TYR  99 -47.835   0.583  -9.314
  776    HA   TYR  99           HA       TYR  99 -49.997  -1.425  -9.164
  777    HB2  TYR  99           2HB      TYR  99 -51.730   0.122  -9.160
  778    HB3  TYR  99           3HB      TYR  99 -50.671   0.560  -7.833
  779    HD1  TYR  99           HD2      TYR  99 -49.314   2.663  -7.944
  780    HD2  TYR  99           HD1      TYR  99 -52.104   1.575 -11.057
  781    HE1  TYR  99           HE2      TYR  99 -49.297   5.004  -8.793
  782    HE2  TYR  99           HE1      TYR  99 -52.072   3.912 -11.902
  783    HH   TYR  99           HH       TYR  99 -51.224   6.024 -11.636
  784    H    ARG 100           H        ARG 100 -50.892  -2.016 -10.979
  785    HA   ARG 100           HA       ARG 100 -49.615  -1.312 -13.531
  786    HB2  ARG 100           2HB      ARG 100 -50.143  -3.683 -12.676
  787    HB3  ARG 100           3HB      ARG 100 -51.832  -3.301 -12.923
  788    HG2  ARG 100           2HG      ARG 100 -51.127  -4.575 -14.784
  789    HG3  ARG 100           3HG      ARG 100 -51.373  -2.943 -15.377
  790    HD2  ARG 100           2HD      ARG 100 -49.330  -4.028 -16.318
  791    HD3  ARG 100           3HD      ARG 100 -48.986  -2.541 -15.452
  792    HE   ARG 100           HE       ARG 100 -47.644  -3.668 -14.007
  793   HH11  ARG 100          2HH1      ARG 100 -49.557  -6.156 -15.582
  794   HH12  ARG 100          1HH1      ARG 100 -48.668  -7.434 -14.801
  795   HH21  ARG 100          2HH2      ARG 100 -46.639  -5.305 -13.016
  796   HH22  ARG 100          1HH2      ARG 100 -47.044  -6.959 -13.382
  797    H    LYS 101           H        LYS 101 -50.699  -0.418 -15.296
  798    HA   LYS 101           HA       LYS 101 -52.678   1.527 -15.027
  799    HB2  LYS 101           2HB      LYS 101 -51.108   1.430 -16.818
  800    HB3  LYS 101           3HB      LYS 101 -51.681  -0.132 -17.370
  801    HG2  LYS 101           2HG      LYS 101 -53.621   2.188 -17.385
  802    HG3  LYS 101           3HG      LYS 101 -52.323   2.151 -18.586
  803    HD2  LYS 101           2HD      LYS 101 -52.972  -0.050 -19.364
  804    HD3  LYS 101           3HD      LYS 101 -54.239  -0.175 -18.141
  805    HE2  LYS 101           2HE      LYS 101 -55.401   1.786 -19.098
  806    HE3  LYS 101           3HE      LYS 101 -54.126   1.964 -20.313
  807    HZ1  LYS 101           HZ1      LYS 101 -55.927  -0.390 -20.065
  808    HZ2  LYS 101           HZ2      LYS 101 -56.039   0.767 -21.209
  809    HZ3  LYS 101           HZ3      LYS 101 -54.747  -0.228 -21.187
  810    H    ASP 102           H        ASP 102 -53.206  -1.914 -15.515
  811    HA   ASP 102           HA       ASP 102 -56.048  -1.714 -16.031
  812    HB2  ASP 102           2HB      ASP 102 -54.494  -3.559 -16.764
  813    HB3  ASP 102           3HB      ASP 102 -54.415  -4.097 -15.086
  814    H    GLY 103           H        GLY 103 -54.315  -1.235 -13.156
  815    HA2  GLY 103           HA2      GLY 103 -55.388  -0.451 -11.206
  816    HA3  GLY 103           HA3      GLY 103 -56.750  -1.534 -11.473
  817    H    SER 104           H        SER 104 -53.973  -3.384 -11.946
  818    HA   SER 104           HA       SER 104 -54.363  -4.779  -9.409
  819    HB2  SER 104           2HB      SER 104 -52.315  -5.277 -11.600
  820    HB3  SER 104           3HB      SER 104 -52.703  -6.361 -10.251
  821    HG   SER 104           HG       SER 104 -53.837  -6.937 -12.164
  822    H    CYS 105           H        CYS 105 -53.245  -4.511  -7.536
  823    HA   CYS 105           HA       CYS 105 -50.758  -2.837  -7.571
  824    HB2  CYS 105           2HB      CYS 105 -52.859  -3.124  -5.391
  825    HB3  CYS 105           3HB      CYS 105 -51.411  -2.098  -5.342
  826    HG   CYS 105           HG       CYS 105 -53.907  -1.967  -7.537
  827    H    PHE 106           H        PHE 106 -48.910  -3.593  -6.650
  828    HA   PHE 106           HA       PHE 106 -48.931  -6.114  -5.062
  829    HB2  PHE 106           2HB      PHE 106 -47.362  -7.146  -6.671
  830    HB3  PHE 106           3HB      PHE 106 -48.967  -6.896  -7.323
  831    HD1  PHE 106           HD1      PHE 106 -49.397  -5.129  -9.050
  832    HD2  PHE 106           HD2      PHE 106 -45.417  -5.998  -7.628
  833    HE1  PHE 106           HE1      PHE 106 -48.440  -3.851 -10.947
  834    HE2  PHE 106           HE2      PHE 106 -44.467  -4.740  -9.544
  835    HZ   PHE 106           HZ       PHE 106 -45.971  -3.643 -11.187
  836    H    LEU 107           H        LEU 107 -47.249  -6.389  -3.703
  837    HA   LEU 107           HA       LEU 107 -44.996  -4.437  -3.691
  838    HB2  LEU 107           2HB      LEU 107 -46.633  -4.207  -1.834
  839    HB3  LEU 107           3HB      LEU 107 -46.401  -5.886  -1.410
  840    HG   LEU 107           HG       LEU 107 -45.357  -4.384   0.148
  841   HD11  LEU 107          1HD1      LEU 107 -43.306  -5.410   0.507
  842   HD12  LEU 107          2HD1      LEU 107 -44.155  -6.634  -0.471
  843   HD13  LEU 107          3HD1      LEU 107 -42.935  -5.555  -1.195
  844   HD21  LEU 107          3HD2      LEU 107 -44.797  -2.502  -1.189
  845   HD22  LEU 107          1HD2      LEU 107 -43.359  -3.077  -0.335
  846   HD23  LEU 107          2HD2      LEU 107 -43.549  -3.461  -2.053
  847    H    CYS 108           H        CYS 108 -43.008  -5.207  -3.697
  848    HA   CYS 108           HA       CYS 108 -42.365  -7.948  -2.839
  849    HB2  CYS 108           2HB      CYS 108 -41.995  -6.869  -5.632
  850    HB3  CYS 108           3HB      CYS 108 -40.697  -7.853  -4.940
  851    HG   CYS 108           HG       CYS 108 -43.892  -8.666  -4.794
  852    H    LEU 109           H        LEU 109 -39.882  -8.129  -2.662
  853    HA   LEU 109           HA       LEU 109 -38.861  -5.715  -1.316
  854    HB2  LEU 109           2HB      LEU 109 -38.690  -8.221  -0.545
  855    HB3  LEU 109           3HB      LEU 109 -37.307  -8.288  -1.625
  856    HG   LEU 109           HG       LEU 109 -37.735  -6.422   0.758
  857   HD11  LEU 109          1HD1      LEU 109 -35.757  -8.698   0.320
  858   HD12  LEU 109          2HD1      LEU 109 -35.892  -7.687   1.777
  859   HD13  LEU 109          3HD1      LEU 109 -37.220  -8.768   1.328
  860   HD21  LEU 109          3HD2      LEU 109 -35.377  -5.717   0.496
  861   HD22  LEU 109          1HD2      LEU 109 -35.288  -6.597  -1.044
  862   HD23  LEU 109          2HD2      LEU 109 -36.369  -5.195  -0.866
  863    H    VAL 110           H        VAL 110 -39.255  -4.784  -3.555
  864    HA   VAL 110           HA       VAL 110 -37.814  -5.325  -5.855
  865    HB   VAL 110           HB       VAL 110 -38.705  -2.629  -4.831
  866   HG11  VAL 110          1HG1      VAL 110 -38.206  -3.474  -7.708
  867   HG12  VAL 110          2HG1      VAL 110 -38.897  -1.930  -7.191
  868   HG13  VAL 110          3HG1      VAL 110 -37.230  -2.305  -6.789
  869   HG21  VAL 110          3HG2      VAL 110 -40.736  -3.030  -6.264
  870   HG22  VAL 110          1HG2      VAL 110 -40.134  -4.661  -6.617
  871   HG23  VAL 110          2HG2      VAL 110 -40.610  -4.204  -4.968
  872    H    ASP 111           H        ASP 111 -35.877  -4.346  -6.853
  873    HA   ASP 111           HA       ASP 111 -33.842  -4.015  -4.686
  874    HB2  ASP 111           2HB      ASP 111 -33.887  -5.901  -6.479
  875    HB3  ASP 111           3HB      ASP 111 -33.140  -4.693  -7.525
  876    H    VAL 112           H        VAL 112 -34.711  -1.793  -4.495
  877    HA   VAL 112           HA       VAL 112 -34.193   0.119  -6.594
  878    HB   VAL 112           HB       VAL 112 -35.027   0.618  -3.704
  879   HG11  VAL 112          1HG1      VAL 112 -34.477   2.684  -5.039
  880   HG12  VAL 112          2HG1      VAL 112 -35.656   2.154  -6.262
  881   HG13  VAL 112          3HG1      VAL 112 -36.189   2.574  -4.627
  882   HG21  VAL 112          3HG2      VAL 112 -37.336   0.506  -4.555
  883   HG22  VAL 112          1HG2      VAL 112 -36.726  -0.084  -6.129
  884   HG23  VAL 112          2HG2      VAL 112 -36.538  -1.059  -4.664
  885    H    VAL 113           H        VAL 113 -31.855  -0.516  -6.678
  886    HA   VAL 113           HA       VAL 113 -30.246   1.091  -4.733
  887    HB   VAL 113           HB       VAL 113 -29.914  -1.317  -4.580
  888   HG11  VAL 113          1HG1      VAL 113 -28.659  -2.579  -6.202
  889   HG12  VAL 113          2HG1      VAL 113 -30.108  -1.941  -6.990
  890   HG13  VAL 113          3HG1      VAL 113 -28.527  -1.182  -7.284
  891   HG21  VAL 113          3HG2      VAL 113 -27.444   0.214  -5.474
  892   HG22  VAL 113          1HG2      VAL 113 -28.178   0.251  -3.850
  893   HG23  VAL 113          2HG2      VAL 113 -27.479  -1.250  -4.472
  894    HA   PRO 114           HA       PRO 114 -29.347   3.475  -8.435
  895    HB2  PRO 114           2HB      PRO 114 -27.905   5.482  -7.465
  896    HB3  PRO 114           3HB      PRO 114 -29.582   5.229  -6.960
  897    HG2  PRO 114           2HG      PRO 114 -27.064   4.362  -5.492
  898    HG3  PRO 114           3HG      PRO 114 -28.482   5.248  -4.836
  899    HD2  PRO 114           2HD      PRO 114 -28.194   2.520  -4.629
  900    HD3  PRO 114           3HD      PRO 114 -29.788   3.317  -4.775
  901    H    VAL 115           H        VAL 115 -26.956   4.767  -9.229
  902    HA   VAL 115           HA       VAL 115 -24.812   2.701  -9.061
  903    HB   VAL 115           HB       VAL 115 -24.197   3.153 -11.403
  904   HG11  VAL 115          1HG1      VAL 115 -25.814   1.580 -12.342
  905   HG12  VAL 115          2HG1      VAL 115 -25.314   1.086 -10.715
  906   HG13  VAL 115          3HG1      VAL 115 -26.902   1.841 -10.963
  907   HG21  VAL 115          3HG2      VAL 115 -26.990   4.295 -11.671
  908   HG22  VAL 115          1HG2      VAL 115 -25.471   5.213 -11.761
  909   HG23  VAL 115          2HG2      VAL 115 -25.822   3.983 -12.981
  910    H    LYS 116           H        LYS 116 -22.921   3.263  -8.645
  911    HA   LYS 116           HA       LYS 116 -22.157   6.116  -8.345
  912    HB2  LYS 116           2HB      LYS 116 -21.257   3.701  -6.731
  913    HB3  LYS 116           3HB      LYS 116 -20.672   5.324  -6.488
  914    HG2  LYS 116           2HG      LYS 116 -22.537   6.011  -5.391
  915    HG3  LYS 116           3HG      LYS 116 -23.633   5.013  -6.325
  916    HD2  LYS 116           2HD      LYS 116 -23.101   3.053  -5.043
  917    HD3  LYS 116           3HD      LYS 116 -21.712   3.826  -4.263
  918    HE2  LYS 116           2HE      LYS 116 -24.515   4.956  -3.983
  919    HE3  LYS 116           3HE      LYS 116 -23.982   3.629  -2.947
  920    HZ1  LYS 116           HZ1      LYS 116 -22.197   5.943  -3.114
  921    HZ2  LYS 116           HZ2      LYS 116 -23.592   6.163  -2.280
  922    HZ3  LYS 116           HZ3      LYS 116 -22.523   4.987  -1.842
  923    H    ASN 117           H        ASN 117 -19.948   6.560  -8.328
  924    HA   ASN 117           HA       ASN 117 -18.412   5.137 -10.475
  925    HB2  ASN 117           2HB      ASN 117 -17.240   7.081 -10.908
  926    HB3  ASN 117           3HB      ASN 117 -18.863   7.658 -10.620
  927   HD21  ASN 117          2HD2      ASN 117 -19.257   8.629  -8.321
  928   HD22  ASN 117          1HD2      ASN 117 -17.846   9.411  -7.622
  929    H    GLU 118           H        GLU 118 -15.860   5.422 -10.011
  930    HA   GLU 118           HA       GLU 118 -15.258   3.516  -7.998
  931    HB2  GLU 118           2HB      GLU 118 -12.946   3.850  -8.618
  932    HB3  GLU 118           3HB      GLU 118 -13.972   3.786 -10.048
  933    HG2  GLU 118           2HG      GLU 118 -13.890   6.282 -10.206
  934    HG3  GLU 118           3HG      GLU 118 -12.839   6.326  -8.789
  935    H    ASP 119           H        ASP 119 -15.401   7.012  -7.663
  936    HA   ASP 119           HA       ASP 119 -13.979   7.154  -5.145
  937    HB2  ASP 119           2HB      ASP 119 -14.519   9.045  -6.802
  938    HB3  ASP 119           3HB      ASP 119 -16.146   9.039  -6.120
  939    H    GLY 120           H        GLY 120 -17.094   5.934  -5.973
  940    HA2  GLY 120           HA2      GLY 120 -18.517   4.748  -4.531
  941    HA3  GLY 120           HA3      GLY 120 -17.909   5.639  -3.135
  942    H    ALA 121           H        ALA 121 -18.521   7.933  -5.497
  943    HA   ALA 121           HA       ALA 121 -21.056   8.674  -4.211
  944    HB1  ALA 121           3HB      ALA 121 -20.681  10.867  -5.232
  945    HB2  ALA 121           1HB      ALA 121 -19.190  10.322  -4.433
  946    HB3  ALA 121           2HB      ALA 121 -19.346  10.223  -6.203
  947    H    VAL 122           H        VAL 122 -22.983   8.971  -5.094
  948    HA   VAL 122           HA       VAL 122 -23.635   7.296  -7.354
  949    HB   VAL 122           HB       VAL 122 -24.948   7.244  -5.388
  950   HG11  VAL 122          1HG1      VAL 122 -24.862   9.600  -4.617
  951   HG12  VAL 122          2HG1      VAL 122 -25.975  10.051  -5.931
  952   HG13  VAL 122          3HG1      VAL 122 -26.499   8.939  -4.667
  953   HG21  VAL 122          3HG2      VAL 122 -27.157   7.250  -6.345
  954   HG22  VAL 122          1HG2      VAL 122 -26.628   8.296  -7.676
  955   HG23  VAL 122          2HG2      VAL 122 -25.986   6.652  -7.525
  956    H    ILE 123           H        ILE 123 -22.979   7.993  -9.244
  957    HA   ILE 123           HA       ILE 123 -23.443  10.785 -10.051
  958    HB   ILE 123           HB       ILE 123 -22.027  10.576 -11.765
  959   HG12  ILE 123          2HG1      ILE 123 -22.775   8.715 -13.022
  960   HG13  ILE 123          3HG1      ILE 123 -21.054   8.603 -12.760
  961   HG21  ILE 123          1HG2      ILE 123 -19.964   9.779 -10.858
  962   HG22  ILE 123          2HG2      ILE 123 -20.946  10.418  -9.527
  963   HG23  ILE 123          3HG2      ILE 123 -20.808   8.666  -9.760
  964   HD11  ILE 123          3HD1      ILE 123 -23.205   6.892 -11.488
  965   HD12  ILE 123          1HD1      ILE 123 -21.951   6.403 -12.614
  966   HD13  ILE 123          2HD1      ILE 123 -21.504   6.866 -10.963
  967    H    MET 124           H        MET 124 -24.882   7.620 -10.606
  968    HA   MET 124           HA       MET 124 -27.047   9.053 -12.027
  969    HB2  MET 124           2HB      MET 124 -25.498   6.787 -13.244
  970    HB3  MET 124           3HB      MET 124 -27.251   6.772 -13.406
  971    HG2  MET 124           2HG      MET 124 -26.941   8.005 -15.212
  972    HG3  MET 124           3HG      MET 124 -26.749   9.355 -14.110
  973    HE1  MET 124           3HE      MET 124 -24.782  10.881 -14.201
  974    HE2  MET 124           1HE      MET 124 -23.710  10.800 -15.612
  975    HE3  MET 124           2HE      MET 124 -25.480  10.789 -15.832
  976    H    PHE 125           H        PHE 125 -28.989   8.222 -11.943
  977    HA   PHE 125           HA       PHE 125 -29.561   6.453  -9.591
  978    HB2  PHE 125           2HB      PHE 125 -30.853   8.924 -10.737
  979    HB3  PHE 125           3HB      PHE 125 -31.859   7.736  -9.953
  980    HD1  PHE 125           HD2      PHE 125 -28.948   7.586  -7.981
  981    HD2  PHE 125           HD1      PHE 125 -32.302  10.125  -8.940
  982    HE1  PHE 125           HE2      PHE 125 -28.692   8.761  -5.819
  983    HE2  PHE 125           HE1      PHE 125 -31.987  11.321  -6.783
  984    HZ   PHE 125           HZ       PHE 125 -30.156  10.657  -5.248
  985    H    ILE 126           H        ILE 126 -29.072   4.623 -10.957
  986    HA   ILE 126           HA       ILE 126 -31.339   3.952 -12.799
  987    HB   ILE 126           HB       ILE 126 -28.749   2.459 -12.457
  988   HG12  ILE 126          2HG1      ILE 126 -29.714   4.465 -14.554
  989   HG13  ILE 126          3HG1      ILE 126 -28.372   4.690 -13.445
  990   HG21  ILE 126          1HG2      ILE 126 -29.476   1.040 -14.188
  991   HG22  ILE 126          2HG2      ILE 126 -30.999   1.271 -13.305
  992   HG23  ILE 126          3HG2      ILE 126 -30.708   2.175 -14.762
  993   HD11  ILE 126          3HD1      ILE 126 -27.222   2.744 -14.473
  994   HD12  ILE 126          1HD1      ILE 126 -28.507   2.700 -15.705
  995   HD13  ILE 126          2HD1      ILE 126 -27.482   4.147 -15.563
  996    H    LEU 127           H        LEU 127 -32.635   4.071 -10.874
  997    HA   LEU 127           HA       LEU 127 -32.412   1.916  -8.919
  998    HB2  LEU 127           2HB      LEU 127 -34.593   3.990  -9.287
  999    HB3  LEU 127           3HB      LEU 127 -34.457   2.839  -7.979
 1000    HG   LEU 127           HG       LEU 127 -33.606   4.954  -7.191
 1001   HD11  LEU 127          1HD1      LEU 127 -32.467   3.020  -6.378
 1002   HD12  LEU 127          2HD1      LEU 127 -31.270   3.317  -7.667
 1003   HD13  LEU 127          3HD1      LEU 127 -31.536   4.532  -6.380
 1004   HD21  LEU 127          3HD2      LEU 127 -32.066   6.326  -8.021
 1005   HD22  LEU 127          1HD2      LEU 127 -31.373   5.088  -9.074
 1006   HD23  LEU 127          2HD2      LEU 127 -32.945   5.837  -9.486
 1007    H    ASN 128           H        ASN 128 -32.275   0.311 -10.184
 1008    HA   ASN 128           HA       ASN 128 -34.040  -0.769 -12.138
 1009    HB2  ASN 128           2HB      ASN 128 -32.174  -2.084 -10.118
 1010    HB3  ASN 128           3HB      ASN 128 -33.113  -3.033 -11.253
 1011   HD21  ASN 128          2HD2      ASN 128 -30.626  -0.359 -11.273
 1012   HD22  ASN 128          1HD2      ASN 128 -29.922  -0.984 -12.749
 1013    H    PHE 129           H        PHE 129 -36.305  -0.814 -11.745
 1014    HA   PHE 129           HA       PHE 129 -37.212  -1.711  -9.125
 1015    HB2  PHE 129           2HB      PHE 129 -38.854  -0.906 -11.511
 1016    HB3  PHE 129           3HB      PHE 129 -39.380  -1.135  -9.828
 1017    HD1  PHE 129           HD2      PHE 129 -37.558   0.394  -8.197
 1018    HD2  PHE 129           HD1      PHE 129 -39.124   1.324 -12.106
 1019    HE1  PHE 129           HE2      PHE 129 -37.291   2.821  -7.737
 1020    HE2  PHE 129           HE1      PHE 129 -38.869   3.745 -11.629
 1021    HZ   PHE 129           HZ       PHE 129 -37.936   4.496  -9.448
 1022    H    GLU 130           H        GLU 130 -35.970  -3.769  -9.718
 1023    HA   GLU 130           HA       GLU 130 -37.586  -5.712 -11.252
 1024    HB2  GLU 130           2HB      GLU 130 -35.937  -7.372 -10.426
 1025    HB3  GLU 130           3HB      GLU 130 -35.298  -6.065 -11.457
 1026    HG2  GLU 130           2HG      GLU 130 -34.352  -4.907  -9.608
 1027    HG3  GLU 130           3HG      GLU 130 -35.146  -5.934  -8.429
 1028    H    VAL 131           H        VAL 131 -39.077  -6.926 -10.507
 1029    HA   VAL 131           HA       VAL 131 -40.044  -6.724  -7.729
 1030    HB   VAL 131           HB       VAL 131 -41.034  -8.050 -10.253
 1031   HG11  VAL 131          1HG1      VAL 131 -42.573  -7.808  -7.655
 1032   HG12  VAL 131          2HG1      VAL 131 -43.164  -8.484  -9.181
 1033   HG13  VAL 131          3HG1      VAL 131 -41.892  -9.329  -8.293
 1034   HG21  VAL 131          3HG2      VAL 131 -42.087  -5.639  -8.711
 1035   HG22  VAL 131          1HG2      VAL 131 -41.168  -5.569 -10.226
 1036   HG23  VAL 131          2HG2      VAL 131 -42.771  -6.310 -10.210
 1037    H    VAL 132           H        VAL 132 -39.208  -8.056  -6.168
 1038    HA   VAL 132           HA       VAL 132 -38.674 -10.870  -6.881
 1039    HB   VAL 132           HB       VAL 132 -36.578  -9.841  -7.379
 1040   HG11  VAL 132          1HG1      VAL 132 -36.644  -7.849  -5.924
 1041   HG12  VAL 132          2HG1      VAL 132 -36.415  -8.896  -4.502
 1042   HG13  VAL 132          3HG1      VAL 132 -35.147  -8.769  -5.736
 1043   HG21  VAL 132          3HG2      VAL 132 -35.108 -11.224  -6.053
 1044   HG22  VAL 132          1HG2      VAL 132 -36.331 -11.410  -4.785
 1045   HG23  VAL 132          2HG2      VAL 132 -36.599 -12.114  -6.399
 1046    H    MET 133           H        MET 133 -39.066 -12.301  -5.355
 1047    HA   MET 133           HA       MET 133 -39.234 -11.515  -2.518
 1048    HB2  MET 133           2HB      MET 133 -41.324 -12.715  -2.167
 1049    HB3  MET 133           3HB      MET 133 -41.547 -11.360  -3.273
 1050    HG2  MET 133           2HG      MET 133 -41.638 -12.857  -5.189
 1051    HG3  MET 133           3HG      MET 133 -41.152 -14.231  -4.199
 1052    HE1  MET 133           3HE      MET 133 -44.061 -11.810  -5.203
 1053    HE2  MET 133           1HE      MET 133 -45.353 -12.265  -4.074
 1054    HE3  MET 133           2HE      MET 133 -43.922 -11.405  -3.474
 1055    H    GLU 134           H        GLU 134 -39.116 -13.329  -1.059
 1056    HA   GLU 134           HA       GLU 134 -37.179 -15.327  -1.891
 1057    HB2  GLU 134           2HB      GLU 134 -38.700 -15.015   0.727
 1058    HB3  GLU 134           3HB      GLU 134 -37.350 -16.119   0.437
 1059    HG2  GLU 134           2HG      GLU 134 -35.910 -14.139  -0.141
 1060    HG3  GLU 134           3HG      GLU 134 -37.236 -13.074   0.331
 1061    H    LYS 135           H        LYS 135 -37.363 -17.592  -1.802
 1062    HA   LYS 135           HA       LYS 135 -39.877 -18.679  -2.813
 1063    HB2  LYS 135           2HB      LYS 135 -38.630 -20.696  -3.225
 1064    HB3  LYS 135           3HB      LYS 135 -37.756 -19.297  -3.841
 1065    HG2  LYS 135           2HG      LYS 135 -36.260 -19.365  -1.832
 1066    HG3  LYS 135           3HG      LYS 135 -37.139 -20.794  -1.249
 1067    HD2  LYS 135           2HD      LYS 135 -36.493 -22.031  -3.298
 1068    HD3  LYS 135           3HD      LYS 135 -35.609 -20.603  -3.881
 1069    HE2  LYS 135           2HE      LYS 135 -34.155 -20.686  -1.867
 1070    HE3  LYS 135           3HE      LYS 135 -35.035 -22.105  -1.286
 1071    HZ1  LYS 135           HZ1      LYS 135 -32.996 -22.741  -2.439
 1072    HZ2  LYS 135           HZ2      LYS 135 -34.280 -23.304  -3.271
 1073    HZ3  LYS 135           HZ3      LYS 135 -33.467 -21.992  -3.809
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1  -3.798 -17.002 -44.461
    2    H2   MET   1           2H       MET   1  -2.858 -16.473 -45.691
    3    H3   MET   1           3H       MET   1  -4.077 -17.529 -45.984
    4    HA   MET   1           HA       MET   1  -4.409 -14.765 -45.036
    5    HB2  MET   1           2HB      MET   1  -3.648 -14.968 -47.421
    6    HB3  MET   1           3HB      MET   1  -5.106 -15.900 -47.780
    7    HG2  MET   1           2HG      MET   1  -6.490 -13.947 -47.096
    8    HG3  MET   1           3HG      MET   1  -5.017 -13.040 -46.730
    9    HE1  MET   1           3HE      MET   1  -6.484 -11.242 -49.895
   10    HE2  MET   1           1HE      MET   1  -7.403 -12.009 -48.581
   11    HE3  MET   1           2HE      MET   1  -5.950 -11.053 -48.210
   12    HA   PRO   2           HA       PRO   2  -8.327 -16.448 -43.640
   13    HB2  PRO   2           2HB      PRO   2  -9.589 -14.166 -42.839
   14    HB3  PRO   2           3HB      PRO   2  -8.196 -14.862 -41.957
   15    HG2  PRO   2           2HG      PRO   2  -8.158 -12.638 -44.028
   16    HG3  PRO   2           3HG      PRO   2  -7.416 -12.638 -42.396
   17    HD2  PRO   2           2HD      PRO   2  -5.974 -13.241 -44.612
   18    HD3  PRO   2           3HD      PRO   2  -5.698 -14.108 -43.071
   19    H    VAL   3           H        VAL   3 -10.559 -16.479 -44.222
   20    HA   VAL   3           HA       VAL   3 -11.073 -15.688 -47.034
   21    HB   VAL   3           HB       VAL   3 -12.860 -17.355 -47.006
   22   HG11  VAL   3          1HG1      VAL   3 -10.564 -17.976 -47.660
   23   HG12  VAL   3          2HG1      VAL   3 -10.218 -18.471 -45.989
   24   HG13  VAL   3          3HG1      VAL   3 -11.452 -19.327 -46.936
   25   HG21  VAL   3          3HG2      VAL   3 -13.475 -17.274 -44.586
   26   HG22  VAL   3          1HG2      VAL   3 -13.142 -18.914 -45.155
   27   HG23  VAL   3          2HG2      VAL   3 -11.933 -18.061 -44.181
   28    H    ARG   4           H        ARG   4 -11.347 -13.799 -44.716
   29    HA   ARG   4           HA       ARG   4 -14.181 -13.190 -44.411
   30    HB2  ARG   4           2HB      ARG   4 -11.671 -11.599 -43.727
   31    HB3  ARG   4           3HB      ARG   4 -13.317 -11.105 -43.311
   32    HG2  ARG   4           2HG      ARG   4 -13.628 -13.144 -41.956
   33    HG3  ARG   4           3HG      ARG   4 -11.991 -13.688 -42.367
   34    HD2  ARG   4           2HD      ARG   4 -11.046 -11.657 -41.312
   35    HD3  ARG   4           3HD      ARG   4 -12.685 -11.126 -40.876
   36    HE   ARG   4           HE       ARG   4 -12.337 -13.744 -39.851
   37   HH11  ARG   4          1HH1      ARG   4 -11.012 -10.563 -39.212
   38   HH12  ARG   4          2HH1      ARG   4 -10.662 -10.943 -37.547
   39   HH21  ARG   4          1HH2      ARG   4 -11.862 -14.162 -37.721
   40   HH22  ARG   4          2HH2      ARG   4 -11.135 -12.930 -36.732
   41    H    ARG   5           H        ARG   5 -15.377 -11.558 -45.256
   42    HA   ARG   5           HA       ARG   5 -14.371  -9.769 -47.363
   43    HB2  ARG   5           2HB      ARG   5 -15.931 -10.535 -49.075
   44    HB3  ARG   5           3HB      ARG   5 -14.814 -11.817 -48.629
   45    HG2  ARG   5           2HG      ARG   5 -16.578 -12.854 -47.192
   46    HG3  ARG   5           3HG      ARG   5 -17.719 -11.598 -47.693
   47    HD2  ARG   5           2HD      ARG   5 -16.309 -13.543 -49.568
   48    HD3  ARG   5           3HD      ARG   5 -17.946 -13.761 -48.928
   49    HE   ARG   5           HE       ARG   5 -17.970 -11.238 -50.129
   50   HH11  ARG   5          1HH2      ARG   5 -17.477 -14.513 -51.271
   51   HH12  ARG   5          2HH2      ARG   5 -18.068 -14.144 -52.868
   52   HH21  ARG   5          1HH1      ARG   5 -18.702 -10.831 -52.189
   53   HH22  ARG   5          2HH1      ARG   5 -18.747 -12.111 -53.364
   54    H    GLY   6           H        GLY   6 -15.924  -8.203 -48.079
   55    HA2  GLY   6           HA2      GLY   6 -17.677  -6.708 -47.853
   56    HA3  GLY   6           HA3      GLY   6 -18.482  -7.821 -46.756
   57    H    HIS   7           H        HIS   7 -18.900  -5.401 -46.091
   58    HA   HIS   7           HA       HIS   7 -16.898  -4.253 -44.259
   59    HB2  HIS   7           2HB      HIS   7 -18.480  -2.398 -44.105
   60    HB3  HIS   7           3HB      HIS   7 -18.129  -2.794 -45.782
   61    HD2  HIS   7           HD2      HIS   7 -21.003  -2.513 -43.323
   62    HE1  HIS   7           HE1      HIS   7 -22.728  -4.068 -46.902
   63    HE2  HIS   7           HE2      HIS   7 -23.232  -3.091 -44.606
   64    H    VAL   8           H        VAL   8 -17.501  -3.563 -42.091
   65    HA   VAL   8           HA       VAL   8 -18.950  -5.627 -40.555
   66    HB   VAL   8           HB       VAL   8 -17.578  -3.123 -39.501
   67   HG11  VAL   8          1HG1      VAL   8 -18.362  -5.754 -38.154
   68   HG12  VAL   8          2HG1      VAL   8 -17.468  -4.423 -37.390
   69   HG13  VAL   8          3HG1      VAL   8 -19.137  -4.178 -37.887
   70   HG21  VAL   8          3HG2      VAL   8 -15.883  -4.476 -40.662
   71   HG22  VAL   8          1HG2      VAL   8 -15.682  -4.633 -38.918
   72   HG23  VAL   8          2HG2      VAL   8 -16.457  -5.942 -39.837
   73    H    ALA   9           H        ALA   9 -20.931  -5.334 -39.607
   74    HA   ALA   9           HA       ALA   9 -22.767  -3.320 -40.478
   75    HB1  ALA   9           3HB      ALA   9 -23.419  -5.567 -39.695
   76    HB2  ALA   9           1HB      ALA   9 -22.836  -5.178 -38.059
   77    HB3  ALA   9           2HB      ALA   9 -24.226  -4.313 -38.741
   78    HA   PRO  10           HA       PRO  10 -22.149   0.164 -37.746
   79    HB2  PRO  10           2HB      PRO  10 -25.060  -0.081 -37.025
   80    HB3  PRO  10           3HB      PRO  10 -24.134   1.375 -37.485
   81    HG2  PRO  10           2HG      PRO  10 -25.736   0.135 -39.297
   82    HG3  PRO  10           3HG      PRO  10 -24.120   0.742 -39.780
   83    HD2  PRO  10           2HD      PRO  10 -24.940  -2.102 -39.163
   84    HD3  PRO  10           3HD      PRO  10 -23.855  -1.467 -40.428
   85    H    GLN  11           H        GLN  11 -20.963  -0.247 -36.037
   86    HA   GLN  11           HA       GLN  11 -21.304  -2.502 -34.408
   87    HB2  GLN  11           2HB      GLN  11 -19.306  -1.917 -33.335
   88    HB3  GLN  11           3HB      GLN  11 -19.149  -1.452 -35.018
   89    HG2  GLN  11           2HG      GLN  11 -19.638   0.396 -32.639
   90    HG3  GLN  11           3HG      GLN  11 -18.137   0.194 -33.534
   91   HE21  GLN  11          2HE2      GLN  11 -20.205   2.547 -33.073
   92   HE22  GLN  11          1HE2      GLN  11 -20.297   3.205 -34.707
   93    H    ASN  12           H        ASN  12 -22.509   0.731 -33.811
   94    HA   ASN  12           HA       ASN  12 -22.822   0.487 -30.946
   95    HB2  ASN  12           2HB      ASN  12 -23.990   2.330 -33.087
   96    HB3  ASN  12           3HB      ASN  12 -24.521   2.395 -31.410
   97   HD21  ASN  12          2HD2      ASN  12 -23.673   4.693 -31.859
   98   HD22  ASN  12          1HD2      ASN  12 -21.995   4.946 -31.404
   99    H    THR  13           H        THR  13 -25.132   0.053 -33.666
  100    HA   THR  13           HA       THR  13 -27.262  -0.905 -31.929
  101    HB   THR  13           HB       THR  13 -27.414   0.316 -34.182
  102    HG1  THR  13           HG1      THR  13 -29.424  -0.645 -34.517
  103   HG21  THR  13          1HG2      THR  13 -26.066  -1.373 -35.438
  104   HG22  THR  13          2HG2      THR  13 -27.398  -2.520 -35.269
  105   HG23  THR  13          3HG2      THR  13 -27.637  -1.000 -36.174
  106    H    PHE  14           H        PHE  14 -24.802  -2.455 -33.994
  107    HA   PHE  14           HA       PHE  14 -25.665  -5.153 -33.751
  108    HB2  PHE  14           2HB      PHE  14 -23.905  -4.253 -35.258
  109    HB3  PHE  14           3HB      PHE  14 -22.861  -3.986 -33.874
  110    HD1  PHE  14           HD1      PHE  14 -24.454  -6.572 -36.013
  111    HD2  PHE  14           HD2      PHE  14 -21.667  -5.830 -32.804
  112    HE1  PHE  14           HE1      PHE  14 -23.597  -8.897 -36.216
  113    HE2  PHE  14           HE2      PHE  14 -20.816  -8.156 -33.008
  114    HZ   PHE  14           HZ       PHE  14 -21.779  -9.691 -34.713
  115    H    LEU  15           H        LEU  15 -23.651  -3.112 -31.626
  116    HA   LEU  15           HA       LEU  15 -23.364  -5.163 -29.581
  117    HB2  LEU  15           2HB      LEU  15 -21.704  -3.429 -29.717
  118    HB3  LEU  15           3HB      LEU  15 -22.921  -2.165 -29.501
  119    HG   LEU  15           HG       LEU  15 -23.374  -2.894 -27.228
  120   HD11  LEU  15          1HD1      LEU  15 -21.193  -4.997 -27.621
  121   HD12  LEU  15          2HD1      LEU  15 -22.000  -4.591 -26.079
  122   HD13  LEU  15          3HD1      LEU  15 -22.914  -5.326 -27.382
  123   HD21  LEU  15          3HD2      LEU  15 -20.390  -2.585 -27.733
  124   HD22  LEU  15          1HD2      LEU  15 -21.575  -1.264 -27.622
  125   HD23  LEU  15          2HD2      LEU  15 -21.236  -2.267 -26.200
  126    H    ASP  16           H        ASP  16 -25.582  -2.314 -29.816
  127    HA   ASP  16           HA       ASP  16 -27.123  -2.610 -27.544
  128    HB2  ASP  16           2HB      ASP  16 -27.370  -0.891 -29.327
  129    HB3  ASP  16           3HB      ASP  16 -28.200  -2.077 -30.325
  130    H    THR  17           H        THR  17 -27.360  -4.576 -30.462
  131    HA   THR  17           HA       THR  17 -29.631  -6.196 -29.640
  132    HB   THR  17           HB       THR  17 -27.347  -6.939 -31.513
  133    HG1  THR  17           HG1      THR  17 -28.468  -5.133 -32.224
  134   HG21  THR  17          1HG2      THR  17 -28.585  -8.944 -30.853
  135   HG22  THR  17          2HG2      THR  17 -30.134  -8.126 -31.174
  136   HG23  THR  17          3HG2      THR  17 -29.016  -8.492 -32.509
  137    H    ILE  18           H        ILE  18 -26.129  -6.562 -29.094
  138    HA   ILE  18           HA       ILE  18 -26.366  -9.091 -27.665
  139    HB   ILE  18           HB       ILE  18 -24.139  -7.046 -27.570
  140   HG12  ILE  18          2HG1      ILE  18 -24.431  -7.701 -29.887
  141   HG13  ILE  18          3HG1      ILE  18 -22.912  -8.240 -29.222
  142   HG21  ILE  18          1HG2      ILE  18 -23.880  -8.567 -25.750
  143   HG22  ILE  18          2HG2      ILE  18 -24.194  -9.976 -26.779
  144   HG23  ILE  18          3HG2      ILE  18 -22.702  -9.026 -26.972
  145   HD11  ILE  18          3HD1      ILE  18 -24.000  -9.939 -30.696
  146   HD12  ILE  18          1HD1      ILE  18 -23.835 -10.563 -29.047
  147   HD13  ILE  18          2HD1      ILE  18 -25.414  -9.978 -29.626
  148    H    ILE  19           H        ILE  19 -26.314  -5.617 -26.754
  149    HA   ILE  19           HA       ILE  19 -26.328  -5.978 -23.970
  150    HB   ILE  19           HB       ILE  19 -27.916  -3.882 -25.511
  151   HG12  ILE  19          2HG1      ILE  19 -25.648  -3.494 -26.129
  152   HG13  ILE  19          3HG1      ILE  19 -26.042  -2.315 -24.905
  153   HG21  ILE  19          1HG2      ILE  19 -27.756  -2.580 -23.379
  154   HG22  ILE  19          2HG2      ILE  19 -28.749  -4.030 -23.262
  155   HG23  ILE  19          3HG2      ILE  19 -27.107  -4.039 -22.592
  156   HD11  ILE  19          3HD1      ILE  19 -24.895  -3.838 -23.214
  157   HD12  ILE  19          1HD1      ILE  19 -24.377  -4.833 -24.601
  158   HD13  ILE  19          2HD1      ILE  19 -23.840  -3.150 -24.493
  159    H    ARG  20           H        ARG  20 -29.153  -5.815 -26.208
  160    HA   ARG  20           HA       ARG  20 -31.130  -6.572 -24.249
  161    HB2  ARG  20           2HB      ARG  20 -31.000  -6.698 -27.267
  162    HB3  ARG  20           3HB      ARG  20 -32.388  -7.344 -26.378
  163    HG2  ARG  20           2HG      ARG  20 -32.847  -5.234 -25.316
  164    HG3  ARG  20           3HG      ARG  20 -31.369  -4.497 -25.964
  165    HD2  ARG  20           2HD      ARG  20 -33.607  -5.614 -27.688
  166    HD3  ARG  20           3HD      ARG  20 -33.499  -3.921 -27.175
  167    HE   ARG  20           HE       ARG  20 -31.135  -4.006 -28.239
  168   HH11  ARG  20          1HH2      ARG  20 -33.680  -5.953 -29.686
  169   HH12  ARG  20          2HH2      ARG  20 -33.074  -5.650 -31.293
  170   HH21  ARG  20          1HH1      ARG  20 -30.703  -3.406 -30.208
  171   HH22  ARG  20          2HH1      ARG  20 -31.265  -4.350 -31.588
  172    H    LYS  21           H        LYS  21 -28.932  -8.501 -26.141
  173    HA   LYS  21           HA       LYS  21 -30.100 -11.082 -25.552
  174    HB2  LYS  21           2HB      LYS  21 -28.099 -10.425 -27.185
  175    HB3  LYS  21           3HB      LYS  21 -27.112 -10.770 -25.751
  176    HG2  LYS  21           2HG      LYS  21 -27.117 -12.755 -26.979
  177    HG3  LYS  21           3HG      LYS  21 -28.249 -13.051 -25.656
  178    HD2  LYS  21           2HD      LYS  21 -30.154 -12.576 -27.223
  179    HD3  LYS  21           3HD      LYS  21 -28.978 -12.278 -28.523
  180    HE2  LYS  21           2HE      LYS  21 -28.121 -14.598 -28.270
  181    HE3  LYS  21           3HE      LYS  21 -29.286 -14.893 -26.973
  182    HZ1  LYS  21           HZ1      LYS  21 -29.998 -14.251 -29.789
  183    HZ2  LYS  21           HZ2      LYS  21 -30.101 -15.726 -29.103
  184    HZ3  LYS  21           HZ3      LYS  21 -31.076 -14.523 -28.590
  185    H    PHE  22           H        PHE  22 -27.646  -9.202 -23.714
  186    HA   PHE  22           HA       PHE  22 -28.000 -11.141 -21.482
  187    HB2  PHE  22           2HB      PHE  22 -25.935 -10.526 -20.593
  188    HB3  PHE  22           3HB      PHE  22 -25.733 -10.850 -22.295
  189    HD1  PHE  22           HD1      PHE  22 -25.939  -8.084 -19.755
  190    HD2  PHE  22           HD2      PHE  22 -24.670  -9.260 -23.698
  191    HE1  PHE  22           HE1      PHE  22 -24.678  -5.966 -19.976
  192    HE2  PHE  22           HE2      PHE  22 -23.382  -7.140 -23.909
  193    HZ   PHE  22           HZ       PHE  22 -23.389  -5.492 -22.049
  194    H    GLU  23           H        GLU  23 -29.395  -8.271 -22.233
  195    HA   GLU  23           HA       GLU  23 -29.108  -6.509 -20.244
  196    HB2  GLU  23           2HB      GLU  23 -30.445  -6.131 -22.284
  197    HB3  GLU  23           3HB      GLU  23 -31.703  -7.206 -21.693
  198    HG2  GLU  23           2HG      GLU  23 -32.234  -5.632 -19.879
  199    HG3  GLU  23           3HG      GLU  23 -30.886  -4.592 -20.361
  200    H    GLY  24           H        GLY  24 -30.994  -9.475 -19.901
  201    HA2  GLY  24           HA2      GLY  24 -32.104 -10.421 -18.059
  202    HA3  GLY  24           HA3      GLY  24 -31.658  -9.024 -17.065
  203    H    GLN  25           H        GLN  25 -33.559  -9.603 -20.034
  204    HA   GLN  25           HA       GLN  25 -35.085  -7.280 -20.005
  205    HB2  GLN  25           2HB      GLN  25 -35.847  -9.993 -21.165
  206    HB3  GLN  25           3HB      GLN  25 -36.584  -8.443 -21.585
  207    HG2  GLN  25           2HG      GLN  25 -34.377  -7.638 -22.446
  208    HG3  GLN  25           3HG      GLN  25 -33.678  -9.220 -22.088
  209   HE21  GLN  25          2HE2      GLN  25 -33.153  -9.319 -24.432
  210   HE22  GLN  25          1HE2      GLN  25 -34.438  -9.791 -25.549
  211    H    SER  26           H        SER  26 -35.847 -10.250 -18.222
  212    HA   SER  26           HA       SER  26 -38.586  -9.660 -17.613
  213    HB2  SER  26           2HB      SER  26 -36.571 -11.252 -15.981
  214    HB3  SER  26           3HB      SER  26 -38.338 -11.336 -15.857
  215    HG   SER  26           HG       SER  26 -37.483 -13.025 -17.161
  216    H    ARG  27           H        ARG  27 -35.674  -8.224 -16.415
  217    HA   ARG  27           HA       ARG  27 -36.889  -7.216 -13.898
  218    HB2  ARG  27           2HB      ARG  27 -34.073  -6.848 -14.997
  219    HB3  ARG  27           3HB      ARG  27 -34.614  -6.464 -13.377
  220    HG2  ARG  27           2HG      ARG  27 -34.454  -9.283 -14.556
  221    HG3  ARG  27           3HG      ARG  27 -33.270  -8.535 -13.494
  222    HD2  ARG  27           2HD      ARG  27 -35.020  -8.394 -11.711
  223    HD3  ARG  27           3HD      ARG  27 -36.169  -9.173 -12.798
  224    HE   ARG  27           HE       ARG  27 -35.148 -11.219 -12.429
  225   HH11  ARG  27          1HH2      ARG  27 -33.033  -8.765 -10.989
  226   HH12  ARG  27          2HH2      ARG  27 -32.000  -9.988 -10.308
  227   HH21  ARG  27          1HH1      ARG  27 -33.779 -12.674 -11.482
  228   HH22  ARG  27          2HH1      ARG  27 -32.406 -12.117 -10.573
  229    H    LYS  28           H        LYS  28 -37.004  -5.018 -13.429
  230    HA   LYS  28           HA       LYS  28 -37.450  -3.266 -15.793
  231    HB2  LYS  28           2HB      LYS  28 -38.825  -2.412 -13.398
  232    HB3  LYS  28           3HB      LYS  28 -39.483  -2.717 -14.968
  233    HG2  LYS  28           2HG      LYS  28 -38.944  -4.881 -12.905
  234    HG3  LYS  28           3HG      LYS  28 -40.417  -3.991 -12.989
  235    HD2  LYS  28           2HD      LYS  28 -40.816  -4.794 -15.316
  236    HD3  LYS  28           3HD      LYS  28 -39.369  -5.793 -15.184
  237    HE2  LYS  28           2HE      LYS  28 -40.472  -6.738 -13.022
  238    HE3  LYS  28           3HE      LYS  28 -41.964  -5.992 -13.603
  239    HZ1  LYS  28           HZ1      LYS  28 -41.793  -8.299 -14.348
  240    HZ2  LYS  28           HZ2      LYS  28 -41.696  -7.330 -15.665
  241    HZ3  LYS  28           HZ3      LYS  28 -40.343  -8.027 -15.051
  242    H    PHE  29           H        PHE  29 -36.934  -1.063 -15.760
  243    HA   PHE  29           HA       PHE  29 -35.766   0.205 -13.474
  244    HB2  PHE  29           2HB      PHE  29 -33.442   0.394 -14.209
  245    HB3  PHE  29           3HB      PHE  29 -33.868  -1.252 -13.875
  246    HD1  PHE  29           HD1      PHE  29 -34.034  -2.951 -15.679
  247    HD2  PHE  29           HD2      PHE  29 -32.758   1.097 -16.432
  248    HE1  PHE  29           HE1      PHE  29 -32.991  -3.679 -17.811
  249    HE2  PHE  29           HE2      PHE  29 -31.698   0.362 -18.562
  250    HZ   PHE  29           HZ       PHE  29 -31.816  -2.024 -19.251
  251    H    ILE  30           H        ILE  30 -34.971   2.183 -13.715
  252    HA   ILE  30           HA       ILE  30 -35.613   3.773 -16.138
  253    HB   ILE  30           HB       ILE  30 -36.021   5.665 -14.456
  254   HG12  ILE  30          2HG1      ILE  30 -36.966   5.157 -12.304
  255   HG13  ILE  30          3HG1      ILE  30 -36.688   3.429 -12.497
  256   HG21  ILE  30          1HG2      ILE  30 -38.382   5.088 -14.319
  257   HG22  ILE  30          2HG2      ILE  30 -37.672   4.631 -15.880
  258   HG23  ILE  30          3HG2      ILE  30 -37.998   3.379 -14.664
  259   HD11  ILE  30          3HD1      ILE  30 -34.299   3.703 -12.225
  260   HD12  ILE  30          1HD1      ILE  30 -34.433   5.478 -12.363
  261   HD13  ILE  30          2HD1      ILE  30 -35.092   4.631 -10.951
  262    H    ILE  31           H        ILE  31 -34.413   5.813 -16.205
  263    HA   ILE  31           HA       ILE  31 -31.705   5.641 -14.982
  264    HB   ILE  31           HB       ILE  31 -32.255   6.768 -17.730
  265   HG12  ILE  31          2HG1      ILE  31 -32.948   4.362 -17.805
  266   HG13  ILE  31          3HG1      ILE  31 -31.574   4.762 -18.847
  267   HG21  ILE  31          1HG2      ILE  31 -30.236   7.508 -16.608
  268   HG22  ILE  31          2HG2      ILE  31 -29.739   5.849 -16.291
  269   HG23  ILE  31          3HG2      ILE  31 -29.801   6.454 -17.964
  270   HD11  ILE  31          3HD1      ILE  31 -31.173   3.642 -16.079
  271   HD12  ILE  31          1HD1      ILE  31 -31.336   2.616 -17.536
  272   HD13  ILE  31          2HD1      ILE  31 -29.995   3.767 -17.398
  273    H    ALA  32           H        ALA  32 -31.559   7.196 -13.644
  274    HA   ALA  32           HA       ALA  32 -32.682   9.878 -14.370
  275    HB1  ALA  32           3HB      ALA  32 -33.165  10.244 -11.950
  276    HB2  ALA  32           1HB      ALA  32 -34.171   8.992 -12.717
  277    HB3  ALA  32           2HB      ALA  32 -32.824   8.535 -11.667
  278    H    ASN  33           H        ASN  33 -31.698  11.752 -13.469
  279    HA   ASN  33           HA       ASN  33 -28.771  11.421 -13.307
  280    HB2  ASN  33           2HB      ASN  33 -29.862  12.930 -14.859
  281    HB3  ASN  33           3HB      ASN  33 -30.710  13.755 -13.571
  282   HD21  ASN  33          2HD2      ASN  33 -29.362  15.143 -15.332
  283   HD22  ASN  33          1HD2      ASN  33 -27.851  15.765 -14.691
  284    H    ALA  34           H        ALA  34 -27.778  11.231 -11.370
  285    HA   ALA  34           HA       ALA  34 -29.284  11.576  -8.880
  286    HB1  ALA  34           3HB      ALA  34 -27.308  10.608  -7.836
  287    HB2  ALA  34           1HB      ALA  34 -27.773   9.649  -9.251
  288    HB3  ALA  34           2HB      ALA  34 -26.389  10.768  -9.340
  289    H    ARG  35           H        ARG  35 -27.553  13.696 -10.811
  290    HA   ARG  35           HA       ARG  35 -26.420  15.290  -8.556
  291    HB2  ARG  35           2HB      ARG  35 -25.904  15.728 -11.503
  292    HB3  ARG  35           3HB      ARG  35 -24.970  16.300 -10.132
  293    HG2  ARG  35           2HG      ARG  35 -25.104  13.508 -11.298
  294    HG3  ARG  35           3HG      ARG  35 -23.718  14.569 -11.156
  295    HD2  ARG  35           2HD      ARG  35 -25.080  12.985  -8.951
  296    HD3  ARG  35           3HD      ARG  35 -23.455  12.778  -9.602
  297    HE   ARG  35           HE       ARG  35 -23.475  15.368  -8.594
  298   HH11  ARG  35          1HH1      ARG  35 -23.890  12.142  -7.204
  299   HH12  ARG  35          2HH1      ARG  35 -23.389  12.692  -5.630
  300   HH21  ARG  35          2HH2      ARG  35 -22.831  15.949  -6.549
  301   HH22  ARG  35          1HH2      ARG  35 -22.777  14.764  -5.280
  302    H    VAL  36           H        VAL  36 -29.304  15.224  -9.845
  303    HA   VAL  36           HA       VAL  36 -29.726  18.181  -9.996
  304    HB   VAL  36           HB       VAL  36 -31.835  17.542 -11.314
  305   HG11  VAL  36          1HG1      VAL  36 -29.839  18.539 -12.363
  306   HG12  VAL  36          2HG1      VAL  36 -29.121  16.921 -12.531
  307   HG13  VAL  36          3HG1      VAL  36 -30.604  17.341 -13.422
  308   HG21  VAL  36          3HG2      VAL  36 -30.428  14.942 -11.680
  309   HG22  VAL  36          1HG2      VAL  36 -31.907  15.198 -10.737
  310   HG23  VAL  36          2HG2      VAL  36 -31.918  15.499 -12.484
  311    H    GLU  37           H        GLU  37 -31.238  19.118  -8.817
  312    HA   GLU  37           HA       GLU  37 -31.934  17.893  -6.323
  313    HB2  GLU  37           2HB      GLU  37 -32.998  19.995  -5.787
  314    HB3  GLU  37           3HB      GLU  37 -31.435  20.267  -6.560
  315    HG2  GLU  37           2HG      GLU  37 -32.610  20.764  -8.714
  316    HG3  GLU  37           3HG      GLU  37 -34.161  20.532  -7.905
  317    H    ASN  38           H        ASN  38 -33.679  18.119  -9.292
  318    HA   ASN  38           HA       ASN  38 -36.219  17.179  -8.119
  319    HB2  ASN  38           2HB      ASN  38 -36.079  18.983  -9.876
  320    HB3  ASN  38           3HB      ASN  38 -35.487  17.775 -11.018
  321   HD21  ASN  38          2HD2      ASN  38 -38.253  18.369  -8.756
  322   HD22  ASN  38          1HD2      ASN  38 -39.441  17.673  -9.847
  323    H    CYS  39           H        CYS  39 -33.398  15.578  -8.830
  324    HA   CYS  39           HA       CYS  39 -32.816  13.509  -9.613
  325    HB2  CYS  39           2HB      CYS  39 -33.837  11.695  -8.335
  326    HB3  CYS  39           3HB      CYS  39 -33.407  13.062  -7.319
  327    HG   CYS  39           HG       CYS  39 -36.376  12.524  -8.628
  328    H    ALA  40           H        ALA  40 -33.971  14.594 -11.790
  329    HA   ALA  40           HA       ALA  40 -36.329  13.160 -12.542
  330    HB1  ALA  40           3HB      ALA  40 -36.321  14.516 -14.531
  331    HB2  ALA  40           1HB      ALA  40 -35.963  15.502 -13.116
  332    HB3  ALA  40           2HB      ALA  40 -34.637  15.029 -14.219
  333    H    VAL  41           H        VAL  41 -36.779  11.819 -14.207
  334    HA   VAL  41           HA       VAL  41 -34.900   9.754 -14.902
  335    HB   VAL  41           HB       VAL  41 -37.837  10.197 -15.515
  336   HG11  VAL  41          1HG1      VAL  41 -36.157   7.691 -15.941
  337   HG12  VAL  41          2HG1      VAL  41 -37.921   7.797 -16.114
  338   HG13  VAL  41          3HG1      VAL  41 -36.879   8.673 -17.234
  339   HG21  VAL  41          3HG2      VAL  41 -38.232   8.489 -13.830
  340   HG22  VAL  41          1HG2      VAL  41 -36.483   8.244 -13.596
  341   HG23  VAL  41          2HG2      VAL  41 -37.253   9.758 -13.102
  342    H    ILE  42           H        ILE  42 -33.411  10.588 -16.202
  343    HA   ILE  42           HA       ILE  42 -33.874  12.138 -18.609
  344    HB   ILE  42           HB       ILE  42 -31.451  11.754 -18.974
  345   HG12  ILE  42          2HG1      ILE  42 -31.549  10.132 -16.389
  346   HG13  ILE  42          3HG1      ILE  42 -31.332   9.440 -18.004
  347   HG21  ILE  42          1HG2      ILE  42 -32.344  13.597 -17.493
  348   HG22  ILE  42          2HG2      ILE  42 -32.026  12.560 -16.087
  349   HG23  ILE  42          3HG2      ILE  42 -30.690  13.116 -17.113
  350   HD11  ILE  42          3HD1      ILE  42 -29.233  10.791 -18.211
  351   HD12  ILE  42          1HD1      ILE  42 -29.441  11.248 -16.489
  352   HD13  ILE  42          2HD1      ILE  42 -29.224   9.551 -16.937
  353    H    TYR  43           H        TYR  43 -33.868   8.739 -17.889
  354    HA   TYR  43           HA       TYR  43 -34.906   8.098 -20.532
  355    HB2  TYR  43           2HB      TYR  43 -32.329   8.036 -20.844
  356    HB3  TYR  43           3HB      TYR  43 -32.372   6.594 -19.879
  357    HD1  TYR  43           HD2      TYR  43 -34.052   8.135 -22.868
  358    HD2  TYR  43           HD1      TYR  43 -32.712   4.503 -20.955
  359    HE1  TYR  43           HE2      TYR  43 -34.721   6.818 -24.880
  360    HE2  TYR  43           HE1      TYR  43 -33.366   3.201 -22.966
  361    HH   TYR  43           HH       TYR  43 -34.225   3.276 -25.089
  362    H    CYS  44           H        CYS  44 -35.658   5.777 -20.747
  363    HA   CYS  44           HA       CYS  44 -35.629   4.301 -18.247
  364    HB2  CYS  44           2HB      CYS  44 -38.102   4.083 -18.049
  365    HB3  CYS  44           3HB      CYS  44 -37.556   5.772 -17.852
  366    HG   CYS  44           HG       CYS  44 -38.009   6.572 -20.214
  367    H    ASN  45           H        ASN  45 -36.380   2.084 -18.383
  368    HA   ASN  45           HA       ASN  45 -35.997   1.082 -21.151
  369    HB2  ASN  45           2HB      ASN  45 -34.470   0.416 -19.252
  370    HB3  ASN  45           3HB      ASN  45 -35.805  -0.531 -18.592
  371   HD21  ASN  45          2HD2      ASN  45 -35.269  -2.682 -19.091
  372   HD22  ASN  45          1HD2      ASN  45 -34.718  -3.207 -20.676
  373    H    ASP  46           H        ASP  46 -37.126  -0.785 -21.925
  374    HA   ASP  46           HA       ASP  46 -39.968  -0.518 -21.862
  375    HB2  ASP  46           2HB      ASP  46 -38.603  -1.445 -23.730
  376    HB3  ASP  46           3HB      ASP  46 -38.243  -2.866 -22.749
  377    H    GLY  47           H        GLY  47 -37.768  -2.530 -19.965
  378    HA2  GLY  47           HA2      GLY  47 -39.488  -4.275 -18.610
  379    HA3  GLY  47           HA3      GLY  47 -38.068  -3.477 -17.914
  380    H    PHE  48           H        PHE  48 -38.871  -0.768 -17.772
  381    HA   PHE  48           HA       PHE  48 -40.643  -0.802 -15.483
  382    HB2  PHE  48           2HB      PHE  48 -39.602   1.176 -15.203
  383    HB3  PHE  48           3HB      PHE  48 -38.947   1.145 -16.830
  384    HD1  PHE  48           HD2      PHE  48 -41.873   2.257 -14.779
  385    HD2  PHE  48           HD1      PHE  48 -39.936   2.459 -18.631
  386    HE1  PHE  48           HE2      PHE  48 -43.651   3.765 -15.606
  387    HE2  PHE  48           HE1      PHE  48 -41.708   3.970 -19.444
  388    HZ   PHE  48           HZ       PHE  48 -43.595   4.597 -17.950
  389    H    CYS  49           H        CYS  49 -41.090  -0.282 -18.981
  390    HA   CYS  49           HA       CYS  49 -43.759   0.771 -18.879
  391    HB2  CYS  49           2HB      CYS  49 -42.106   0.807 -20.845
  392    HB3  CYS  49           3HB      CYS  49 -42.614  -0.867 -21.167
  393    HG   CYS  49           HG       CYS  49 -45.210  -0.317 -21.239
  394    H    GLU  50           H        GLU  50 -42.452  -2.565 -18.918
  395    HA   GLU  50           HA       GLU  50 -45.125  -3.800 -18.894
  396    HB2  GLU  50           2HB      GLU  50 -42.436  -5.024 -18.185
  397    HB3  GLU  50           3HB      GLU  50 -43.948  -5.883 -18.500
  398    HG2  GLU  50           2HG      GLU  50 -43.959  -4.867 -20.823
  399    HG3  GLU  50           3HG      GLU  50 -42.331  -4.270 -20.506
  400    H    LEU  51           H        LEU  51 -42.858  -2.655 -16.448
  401    HA   LEU  51           HA       LEU  51 -43.993  -3.952 -14.182
  402    HB2  LEU  51           2HB      LEU  51 -41.826  -2.810 -14.263
  403    HB3  LEU  51           3HB      LEU  51 -42.597  -1.268 -14.455
  404    HG   LEU  51           HG       LEU  51 -43.645  -1.285 -12.327
  405   HD11  LEU  51          1HD1      LEU  51 -42.214  -3.906 -11.755
  406   HD12  LEU  51          2HD1      LEU  51 -43.067  -2.897 -10.574
  407   HD13  LEU  51          3HD1      LEU  51 -43.969  -3.660 -11.885
  408   HD21  LEU  51          3HD2      LEU  51 -40.675  -1.838 -12.146
  409   HD22  LEU  51          1HD2      LEU  51 -41.438  -0.288 -12.570
  410   HD23  LEU  51          2HD2      LEU  51 -41.659  -0.975 -10.954
  411    H    CYS  52           H        CYS  52 -44.567  -0.608 -15.379
  412    HA   CYS  52           HA       CYS  52 -46.918  -0.345 -13.599
  413    HB2  CYS  52           2HB      CYS  52 -45.546   1.651 -15.450
  414    HB3  CYS  52           3HB      CYS  52 -46.797   2.010 -14.246
  415    HG   CYS  52           HG       CYS  52 -44.493   2.837 -13.344
  416    H    GLY  53           H        GLY  53 -46.351  -1.024 -16.976
  417    HA2  GLY  53           HA2      GLY  53 -47.837  -1.293 -18.749
  418    HA3  GLY  53           HA3      GLY  53 -49.201  -1.052 -17.654
  419    H    TYR  54           H        TYR  54 -46.641   1.363 -17.818
  420    HA   TYR  54           HA       TYR  54 -48.573   3.393 -18.800
  421    HB2  TYR  54           2HB      TYR  54 -45.853   3.653 -17.485
  422    HB3  TYR  54           3HB      TYR  54 -46.894   4.994 -17.944
  423    HD1  TYR  54           HD1      TYR  54 -49.313   2.865 -16.678
  424    HD2  TYR  54           HD2      TYR  54 -45.893   5.186 -15.423
  425    HE1  TYR  54           HE1      TYR  54 -50.246   3.004 -14.391
  426    HE2  TYR  54           HE2      TYR  54 -46.859   5.349 -13.134
  427    HH   TYR  54           HH       TYR  54 -49.966   3.808 -12.260
  428    H    SER  55           H        SER  55 -45.800   4.826 -19.431
  429    HA   SER  55           HA       SER  55 -44.872   3.705 -21.940
  430    HB2  SER  55           2HB      SER  55 -46.930   4.786 -22.745
  431    HB3  SER  55           3HB      SER  55 -46.492   6.292 -21.914
  432    HG   SER  55           HG       SER  55 -45.955   6.167 -24.220
  433    H    ARG  56           H        ARG  56 -42.913   4.779 -22.582
  434    HA   ARG  56           HA       ARG  56 -41.288   6.113 -20.632
  435    HB2  ARG  56           2HB      ARG  56 -40.305   4.984 -22.489
  436    HB3  ARG  56           3HB      ARG  56 -41.207   5.921 -23.674
  437    HG2  ARG  56           2HG      ARG  56 -39.808   7.755 -23.550
  438    HG3  ARG  56           3HG      ARG  56 -39.367   7.457 -21.871
  439    HD2  ARG  56           2HD      ARG  56 -37.448   7.077 -23.328
  440    HD3  ARG  56           3HD      ARG  56 -37.914   5.601 -22.497
  441    HE   ARG  56           HE       ARG  56 -38.684   6.183 -25.338
  442   HH11  ARG  56          1HH2      ARG  56 -37.271   3.868 -23.041
  443   HH12  ARG  56          2HH2      ARG  56 -37.233   2.627 -24.255
  444   HH21  ARG  56          1HH1      ARG  56 -38.546   4.524 -26.780
  445   HH22  ARG  56          2HH1      ARG  56 -37.906   2.985 -26.291
  446    H    ALA  57           H        ALA  57 -43.483   7.475 -23.063
  447    HA   ALA  57           HA       ALA  57 -42.847  10.226 -22.663
  448    HB1  ALA  57           3HB      ALA  57 -44.997  10.600 -23.810
  449    HB2  ALA  57           1HB      ALA  57 -44.070   9.315 -24.607
  450    HB3  ALA  57           2HB      ALA  57 -45.444   8.899 -23.555
  451    H    GLU  58           H        GLU  58 -44.662   8.049 -20.599
  452    HA   GLU  58           HA       GLU  58 -45.939  10.223 -19.069
  453    HB2  GLU  58           2HB      GLU  58 -46.045   7.199 -18.772
  454    HB3  GLU  58           3HB      GLU  58 -46.863   8.356 -17.729
  455    HG2  GLU  58           2HG      GLU  58 -48.085   9.282 -19.687
  456    HG3  GLU  58           3HG      GLU  58 -47.319   8.088 -20.730
  457    H    VAL  59           H        VAL  59 -42.930   8.433 -18.974
  458    HA   VAL  59           HA       VAL  59 -42.476   9.375 -16.160
  459    HB   VAL  59           HB       VAL  59 -40.551   7.812 -16.110
  460   HG11  VAL  59          1HG1      VAL  59 -42.725   7.371 -15.008
  461   HG12  VAL  59          2HG1      VAL  59 -43.296   6.555 -16.477
  462   HG13  VAL  59          3HG1      VAL  59 -41.922   5.896 -15.549
  463   HG21  VAL  59          3HG2      VAL  59 -40.311   7.445 -18.540
  464   HG22  VAL  59          1HG2      VAL  59 -40.452   5.949 -17.598
  465   HG23  VAL  59          2HG2      VAL  59 -41.845   6.540 -18.524
  466    H    MET  60           H        MET  60 -41.499   9.972 -19.417
  467    HA   MET  60           HA       MET  60 -38.940  10.828 -19.271
  468    HB2  MET  60           2HB      MET  60 -41.348  11.618 -20.872
  469    HB3  MET  60           3HB      MET  60 -40.038  12.789 -20.880
  470    HG2  MET  60           2HG      MET  60 -39.708   9.876 -21.633
  471    HG3  MET  60           3HG      MET  60 -39.906  11.219 -22.752
  472    HE1  MET  60           3HE      MET  60 -37.596   9.454 -20.113
  473    HE2  MET  60           1HE      MET  60 -37.317   8.853 -21.761
  474    HE3  MET  60           2HE      MET  60 -36.050   9.768 -20.920
  475    H    GLN  61           H        GLN  61 -37.976  11.897 -17.771
  476    HA   GLN  61           HA       GLN  61 -37.175  13.611 -16.634
  477    HB2  GLN  61           2HB      GLN  61 -39.023  15.404 -18.213
  478    HB3  GLN  61           3HB      GLN  61 -37.528  15.870 -17.417
  479    HG2  GLN  61           2HG      GLN  61 -36.178  14.970 -19.076
  480    HG3  GLN  61           3HG      GLN  61 -37.273  13.649 -19.450
  481   HE21  GLN  61          2HE2      GLN  61 -37.691  13.758 -21.584
  482   HE22  GLN  61          1HE2      GLN  61 -38.316  15.189 -22.378
  483    H    ARG  62           H        ARG  62 -39.777  12.218 -15.695
  484    HA   ARG  62           HA       ARG  62 -40.623  14.111 -13.568
  485    HB2  ARG  62           2HB      ARG  62 -41.301  11.223 -14.360
  486    HB3  ARG  62           3HB      ARG  62 -41.612  11.759 -12.736
  487    HG2  ARG  62           2HG      ARG  62 -43.623  12.203 -13.531
  488    HG3  ARG  62           3HG      ARG  62 -42.890  13.762 -13.897
  489    HD2  ARG  62           2HD      ARG  62 -42.951  11.502 -15.922
  490    HD3  ARG  62           3HD      ARG  62 -44.373  12.502 -15.675
  491    HE   ARG  62           HE       ARG  62 -41.936  13.234 -17.077
  492   HH11  ARG  62          1HH2      ARG  62 -44.657  14.709 -15.411
  493   HH12  ARG  62          2HH2      ARG  62 -44.454  16.206 -16.279
  494   HH21  ARG  62          1HH1      ARG  62 -41.758  15.054 -18.107
  495   HH22  ARG  62          2HH1      ARG  62 -42.822  16.414 -17.790
  496    HA   PRO  63           HA       PRO  63 -37.584  12.704 -10.572
  497    HB2  PRO  63           2HB      PRO  63 -39.074  12.244  -8.296
  498    HB3  PRO  63           3HB      PRO  63 -38.624  13.873  -8.875
  499    HG2  PRO  63           2HG      PRO  63 -41.222  12.386  -9.370
  500    HG3  PRO  63           3HG      PRO  63 -40.999  14.071  -8.795
  501    HD2  PRO  63           2HD      PRO  63 -41.487  13.575 -11.390
  502    HD3  PRO  63           3HD      PRO  63 -40.265  14.797 -10.941
  503    H    CYS  64           H        CYS  64 -36.660  10.662 -10.169
  504    HA   CYS  64           HA       CYS  64 -38.090   8.237 -10.794
  505    HB2  CYS  64           2HB      CYS  64 -36.051   7.187  -9.540
  506    HB3  CYS  64           3HB      CYS  64 -35.853   7.937 -11.133
  507    HG   CYS  64           HG       CYS  64 -33.776   8.384  -9.598
  508    H    THR  65           H        THR  65 -38.331  10.143  -7.995
  509    HA   THR  65           HA       THR  65 -38.718   8.250  -5.976
  510    HB   THR  65           HB       THR  65 -40.216  10.883  -6.070
  511    HG1  THR  65           HG1      THR  65 -38.347  11.839  -5.320
  512   HG21  THR  65          1HG2      THR  65 -40.548   9.360  -4.115
  513   HG22  THR  65          2HG2      THR  65 -38.782   9.294  -3.898
  514   HG23  THR  65          3HG2      THR  65 -39.668  10.826  -3.656
  515    H    CYS  66           H        CYS  66 -39.854   6.579  -6.685
  516    HA   CYS  66           HA       CYS  66 -42.219   6.360  -8.009
  517    HB2  CYS  66           2HB      CYS  66 -42.407   4.104  -7.010
  518    HB3  CYS  66           3HB      CYS  66 -40.746   4.482  -7.496
  519    HG   CYS  66           HG       CYS  66 -40.725   3.124  -5.256
  520    H    ASP  67           H        ASP  67 -42.108   7.650  -4.841
  521    HA   ASP  67           HA       ASP  67 -44.694   7.226  -3.805
  522    HB2  ASP  67           2HB      ASP  67 -42.862   8.603  -2.757
  523    HB3  ASP  67           3HB      ASP  67 -43.158   9.853  -3.957
  524    H    PHE  68           H        PHE  68 -43.660   9.378  -6.523
  525    HA   PHE  68           HA       PHE  68 -46.166  10.693  -6.817
  526    HB2  PHE  68           2HB      PHE  68 -45.235  11.815  -8.500
  527    HB3  PHE  68           3HB      PHE  68 -43.752  11.172  -7.849
  528    HD1  PHE  68           HD2      PHE  68 -46.237  10.972 -10.596
  529    HD2  PHE  68           HD1      PHE  68 -42.405   9.582  -9.197
  530    HE1  PHE  68           HE2      PHE  68 -45.728  10.085 -12.856
  531    HE2  PHE  68           HE1      PHE  68 -41.901   8.697 -11.450
  532    HZ   PHE  68           HZ       PHE  68 -43.559   8.948 -13.290
  533    H    LEU  69           H        LEU  69 -45.343   7.477  -7.648
  534    HA   LEU  69           HA       LEU  69 -47.935   7.102  -9.035
  535    HB2  LEU  69           2HB      LEU  69 -46.901   5.403 -10.497
  536    HB3  LEU  69           3HB      LEU  69 -46.375   7.052 -10.765
  537    HG   LEU  69           HG       LEU  69 -44.236   6.550  -9.521
  538   HD11  LEU  69          1HD1      LEU  69 -45.148   3.653  -9.801
  539   HD12  LEU  69          2HD1      LEU  69 -43.535   4.216  -9.296
  540   HD13  LEU  69          3HD1      LEU  69 -44.931   4.505  -8.267
  541   HD21  LEU  69          3HD2      LEU  69 -44.411   6.533 -11.991
  542   HD22  LEU  69          1HD2      LEU  69 -43.220   5.370 -11.397
  543   HD23  LEU  69          2HD2      LEU  69 -44.812   4.804 -11.946
  544    H    HIS  70           H        HIS  70 -47.069   6.792  -6.119
  545    HA   HIS  70           HA       HIS  70 -47.036   4.028  -5.535
  546    HB2  HIS  70           2HB      HIS  70 -47.319   4.561  -3.329
  547    HB3  HIS  70           3HB      HIS  70 -46.553   5.993  -3.969
  548    HD2  HIS  70           HD2      HIS  70 -48.793   7.901  -4.794
  549    HE1  HIS  70           HE1      HIS  70 -50.896   6.944  -1.213
  550    HE2  HIS  70           HE2      HIS  70 -50.696   8.617  -3.123
  551    H    GLY  71           H        GLY  71 -48.521   2.480  -5.061
  552    HA2  GLY  71           HA2      GLY  71 -51.322   2.874  -6.022
  553    HA3  GLY  71           HA3      GLY  71 -50.493   1.334  -5.806
  554    HA   PRO  72           HA       PRO  72 -53.205   2.556  -2.085
  555    HB2  PRO  72           2HB      PRO  72 -55.194   0.669  -2.273
  556    HB3  PRO  72           3HB      PRO  72 -55.223   2.227  -3.151
  557    HG2  PRO  72           2HG      PRO  72 -54.279  -0.468  -4.190
  558    HG3  PRO  72           3HG      PRO  72 -55.446   0.662  -4.954
  559    HD2  PRO  72           2HD      PRO  72 -52.838   0.644  -5.681
  560    HD3  PRO  72           3HD      PRO  72 -53.724   2.191  -5.528
  561    H    ARG  73           H        ARG  73 -51.526  -0.234  -3.131
  562    HA   ARG  73           HA       ARG  73 -51.570  -1.623  -0.514
  563    HB2  ARG  73           2HB      ARG  73 -51.771  -2.738  -2.768
  564    HB3  ARG  73           3HB      ARG  73 -50.085  -2.317  -3.083
  565    HG2  ARG  73           2HG      ARG  73 -49.361  -3.756  -1.222
  566    HG3  ARG  73           3HG      ARG  73 -51.054  -4.033  -0.747
  567    HD2  ARG  73           2HD      ARG  73 -51.484  -5.076  -2.960
  568    HD3  ARG  73           3HD      ARG  73 -49.783  -4.820  -3.397
  569    HE   ARG  73           HE       ARG  73 -49.718  -6.255  -1.007
  570   HH11  ARG  73          1HH1      ARG  73 -51.064  -6.928  -4.206
  571   HH12  ARG  73          2HH1      ARG  73 -50.992  -8.647  -3.938
  572   HH21  ARG  73          1HH2      ARG  73 -49.630  -8.459  -0.795
  573   HH22  ARG  73          2HH2      ARG  73 -50.176  -9.482  -2.089
  574    H    THR  74           H        THR  74 -49.799   0.949  -1.821
  575    HA   THR  74           HA       THR  74 -47.149   0.156  -0.925
  576    HB   THR  74           HB       THR  74 -47.882   3.031  -1.502
  577    HG1  THR  74           HG1      THR  74 -48.809   2.058  -3.150
  578   HG21  THR  74          1HG2      THR  74 -45.651   2.962  -2.644
  579   HG22  THR  74          2HG2      THR  74 -45.543   2.595  -0.915
  580   HG23  THR  74          3HG2      THR  74 -45.460   1.281  -2.105
  581    H    GLN  75           H        GLN  75 -45.994   0.711   0.866
  582    HA   GLN  75           HA       GLN  75 -47.417   2.122   3.047
  583    HB2  GLN  75           2HB      GLN  75 -44.647   0.908   3.060
  584    HB3  GLN  75           3HB      GLN  75 -45.515   1.612   4.429
  585    HG2  GLN  75           2HG      GLN  75 -47.286  -0.105   4.216
  586    HG3  GLN  75           3HG      GLN  75 -46.382  -0.874   2.904
  587   HE21  GLN  75          2HE2      GLN  75 -46.838  -2.656   4.731
  588   HE22  GLN  75          1HE2      GLN  75 -45.487  -2.858   5.838
  589    H    ARG  76           H        ARG  76 -47.089   4.128   3.597
  590    HA   ARG  76           HA       ARG  76 -45.660   5.916   1.803
  591    HB2  ARG  76           2HB      ARG  76 -46.835   6.641   4.472
  592    HB3  ARG  76           3HB      ARG  76 -46.411   7.738   3.157
  593    HG2  ARG  76           2HG      ARG  76 -48.686   5.719   3.238
  594    HG3  ARG  76           3HG      ARG  76 -48.804   7.469   3.130
  595    HD2  ARG  76           2HD      ARG  76 -47.744   5.578   0.976
  596    HD3  ARG  76           3HD      ARG  76 -49.316   6.353   0.972
  597    HE   ARG  76           HE       ARG  76 -46.795   7.503   0.114
  598   HH11  ARG  76          1HH1      ARG  76 -49.916   8.491   1.381
  599   HH12  ARG  76          2HH1      ARG  76 -49.814  10.046   0.602
  600   HH21  ARG  76          1HH2      ARG  76 -46.746   9.429  -0.853
  601   HH22  ARG  76          2HH2      ARG  76 -48.050  10.574  -0.622
  602    H    ARG  77           H        ARG  77 -44.931   4.643   5.029
  603    HA   ARG  77           HA       ARG  77 -42.432   5.887   5.452
  604    HB2  ARG  77           2HB      ARG  77 -41.822   4.000   6.773
  605    HB3  ARG  77           3HB      ARG  77 -43.486   4.489   7.088
  606    HG2  ARG  77           2HG      ARG  77 -44.302   2.502   6.602
  607    HG3  ARG  77           3HG      ARG  77 -43.470   2.361   5.071
  608    HD2  ARG  77           2HD      ARG  77 -42.074   1.855   7.724
  609    HD3  ARG  77           3HD      ARG  77 -42.973   0.621   6.852
  610    HE   ARG  77           HE       ARG  77 -40.495   1.994   5.856
  611   HH11  ARG  77          1HH1      ARG  77 -42.657  -0.778   5.440
  612   HH12  ARG  77          2HH1      ARG  77 -41.377  -1.698   4.651
  613   HH21  ARG  77          1HH2      ARG  77 -39.126   0.887   4.682
  614   HH22  ARG  77          2HH2      ARG  77 -39.498  -0.758   4.156
  615    H    ALA  78           H        ALA  78 -43.125   3.141   3.306
  616    HA   ALA  78           HA       ALA  78 -40.383   2.605   2.563
  617    HB1  ALA  78           3HB      ALA  78 -42.968   1.945   1.019
  618    HB2  ALA  78           1HB      ALA  78 -41.411   1.243   0.794
  619    HB3  ALA  78           2HB      ALA  78 -42.251   0.945   2.310
  620    H    ALA  79           H        ALA  79 -43.067   4.409   1.003
  621    HA   ALA  79           HA       ALA  79 -41.488   5.332  -1.225
  622    HB1  ALA  79           3HB      ALA  79 -43.408   6.766  -1.637
  623    HB2  ALA  79           1HB      ALA  79 -44.000   5.188  -1.098
  624    HB3  ALA  79           2HB      ALA  79 -43.978   6.572   0.030
  625    H    ALA  80           H        ALA  80 -42.044   6.721   1.989
  626    HA   ALA  80           HA       ALA  80 -40.808   9.241   1.537
  627    HB1  ALA  80           3HB      ALA  80 -40.879   9.397   4.009
  628    HB2  ALA  80           1HB      ALA  80 -42.418   8.830   3.329
  629    HB3  ALA  80           2HB      ALA  80 -41.307   7.674   4.098
  630    H    GLN  81           H        GLN  81 -39.480   6.290   3.206
  631    HA   GLN  81           HA       GLN  81 -36.804   7.066   3.544
  632    HB2  GLN  81           2HB      GLN  81 -38.055   4.398   2.788
  633    HB3  GLN  81           3HB      GLN  81 -36.331   4.586   3.115
  634    HG2  GLN  81           2HG      GLN  81 -36.756   5.301   5.394
  635    HG3  GLN  81           3HG      GLN  81 -38.494   5.292   5.143
  636   HE21  GLN  81          2HE2      GLN  81 -35.639   3.258   5.654
  637   HE22  GLN  81          1HE2      GLN  81 -36.543   1.770   5.880
  638    H    ILE  82           H        ILE  82 -38.370   5.729   0.566
  639    HA   ILE  82           HA       ILE  82 -35.980   5.893  -1.033
  640    HB   ILE  82           HB       ILE  82 -38.925   5.783  -1.668
  641   HG12  ILE  82          2HG1      ILE  82 -36.611   3.867  -2.249
  642   HG13  ILE  82          3HG1      ILE  82 -37.528   3.840  -0.739
  643   HG21  ILE  82          1HG2      ILE  82 -36.607   6.065  -3.622
  644   HG22  ILE  82          2HG2      ILE  82 -38.242   5.514  -4.084
  645   HG23  ILE  82          3HG2      ILE  82 -38.007   7.144  -3.440
  646   HD11  ILE  82          3HD1      ILE  82 -38.624   3.305  -3.497
  647   HD12  ILE  82          1HD1      ILE  82 -38.490   2.217  -2.095
  648   HD13  ILE  82          2HD1      ILE  82 -39.630   3.579  -2.046
  649    H    ALA  83           H        ALA  83 -38.703   8.233  -0.667
  650    HA   ALA  83           HA       ALA  83 -37.689  10.252  -2.305
  651    HB1  ALA  83           3HB      ALA  83 -39.151  10.659   0.326
  652    HB2  ALA  83           1HB      ALA  83 -39.101  11.756  -1.058
  653    HB3  ALA  83           2HB      ALA  83 -39.933  10.185  -1.200
  654    H    GLN  84           H        GLN  84 -36.690   9.492   1.017
  655    HA   GLN  84           HA       GLN  84 -34.949  11.827   1.311
  656    HB2  GLN  84           2HB      GLN  84 -34.573   9.207   2.789
  657    HB3  GLN  84           3HB      GLN  84 -34.057  10.822   3.237
  658    HG2  GLN  84           2HG      GLN  84 -36.775   9.595   3.405
  659    HG3  GLN  84           3HG      GLN  84 -35.852  10.289   4.664
  660   HE21  GLN  84          1HE2      GLN  84 -38.357  10.846   2.452
  661   HE22  GLN  84          2HE2      GLN  84 -38.509  12.593   2.697
  662    H    ALA  85           H        ALA  85 -34.516   8.424   0.157
  663    HA   ALA  85           HA       ALA  85 -31.648   8.590  -0.046
  664    HB1  ALA  85           3HB      ALA  85 -33.621   6.751  -1.471
  665    HB2  ALA  85           1HB      ALA  85 -31.871   6.510  -1.332
  666    HB3  ALA  85           2HB      ALA  85 -32.886   6.458   0.120
  667    H    LEU  86           H        LEU  86 -34.288   9.365  -2.310
  668    HA   LEU  86           HA       LEU  86 -32.395  10.032  -4.442
  669    HB2  LEU  86           2HB      LEU  86 -35.321  10.697  -4.548
  670    HB3  LEU  86           3HB      LEU  86 -34.185  10.386  -5.852
  671    HG   LEU  86           HG       LEU  86 -35.672   8.458  -4.100
  672   HD11  LEU  86          1HD1      LEU  86 -36.388   9.261  -6.387
  673   HD12  LEU  86          2HD1      LEU  86 -35.105   8.213  -7.009
  674   HD13  LEU  86          3HD1      LEU  86 -36.420   7.509  -6.065
  675   HD21  LEU  86          3HD2      LEU  86 -34.339   6.556  -5.165
  676   HD22  LEU  86          1HD2      LEU  86 -33.122   7.763  -5.643
  677   HD23  LEU  86          2HD2      LEU  86 -33.445   7.423  -3.933
  678    H    LEU  87           H        LEU  87 -34.081  11.827  -1.904
  679    HA   LEU  87           HA       LEU  87 -33.411  14.488  -2.683
  680    HB2  LEU  87           2HB      LEU  87 -35.073  14.242  -1.107
  681    HB3  LEU  87           3HB      LEU  87 -34.272  12.917  -0.292
  682    HG   LEU  87           HG       LEU  87 -33.167  15.576   0.063
  683   HD11  LEU  87          1HD1      LEU  87 -35.502  14.381   1.584
  684   HD12  LEU  87          2HD1      LEU  87 -34.654  15.879   2.039
  685   HD13  LEU  87          3HD1      LEU  87 -35.568  15.807   0.526
  686   HD21  LEU  87          3HD2      LEU  87 -33.265  13.193   1.916
  687   HD22  LEU  87          1HD2      LEU  87 -31.839  13.821   1.056
  688   HD23  LEU  87          2HD2      LEU  87 -32.587  14.779   2.319
  689    H    GLY  88           H        GLY  88 -31.637  11.871  -1.090
  690    HA2  GLY  88           HA2      GLY  88 -29.306  11.641  -1.690
  691    HA3  GLY  88           HA3      GLY  88 -29.088  13.384  -1.565
  692    H    ALA  89           H        ALA  89 -30.947  11.817   0.999
  693    HA   ALA  89           HA       ALA  89 -29.096  12.693   3.003
  694    HB1  ALA  89           3HB      ALA  89 -31.458  10.766   3.131
  695    HB2  ALA  89           1HB      ALA  89 -30.600  11.430   4.536
  696    HB3  ALA  89           2HB      ALA  89 -31.482  12.516   3.453
  697    H    GLU  90           H        GLU  90 -29.899   9.441   1.733
  698    HA   GLU  90           HA       GLU  90 -27.198   8.396   2.305
  699    HB2  GLU  90           2HB      GLU  90 -29.708   7.047   3.409
  700    HB3  GLU  90           3HB      GLU  90 -28.054   6.441   3.500
  701    HG2  GLU  90           2HG      GLU  90 -27.459   8.433   4.917
  702    HG3  GLU  90           3HG      GLU  90 -29.168   8.902   4.903
  703    H    GLU  91           H        GLU  91 -26.629   6.745   0.871
  704    HA   GLU  91           HA       GLU  91 -28.495   5.893  -1.287
  705    HB2  GLU  91           2HB      GLU  91 -26.169   6.199  -1.825
  706    HB3  GLU  91           3HB      GLU  91 -25.634   5.128  -0.532
  707    HG2  GLU  91           2HG      GLU  91 -27.531   4.095  -2.650
  708    HG3  GLU  91           3HG      GLU  91 -25.830   4.313  -3.056
  709    H    ARG  92           H        ARG  92 -30.075   4.497  -0.719
  710    HA   ARG  92           HA       ARG  92 -29.425   2.085   0.843
  711    HB2  ARG  92           2HB      ARG  92 -30.118   3.731   2.562
  712    HB3  ARG  92           3HB      ARG  92 -31.581   4.094   1.649
  713    HG2  ARG  92           2HG      ARG  92 -32.195   2.667   3.477
  714    HG3  ARG  92           3HG      ARG  92 -32.358   1.755   1.987
  715    HD2  ARG  92           2HD      ARG  92 -29.872   0.943   2.607
  716    HD3  ARG  92           3HD      ARG  92 -30.372   1.449   4.226
  717    HE   ARG  92           HE       ARG  92 -32.218  -0.316   2.702
  718   HH11  ARG  92          1HH1      ARG  92 -29.708  -0.311   5.159
  719   HH12  ARG  92          2HH1      ARG  92 -30.148  -1.901   5.721
  720   HH21  ARG  92          1HH2      ARG  92 -32.718  -2.288   3.459
  721   HH22  ARG  92          2HH2      ARG  92 -31.823  -2.996   4.775
  722    H    LYS  93           H        LYS  93 -30.480   0.361   0.229
  723    HA   LYS  93           HA       LYS  93 -32.548   0.414  -1.884
  724    HB2  LYS  93           2HB      LYS  93 -30.652  -1.119  -2.028
  725    HB3  LYS  93           3HB      LYS  93 -31.181  -1.903  -0.517
  726    HG2  LYS  93           2HG      LYS  93 -33.408  -2.319  -1.824
  727    HG3  LYS  93           3HG      LYS  93 -32.463  -1.879  -3.252
  728    HD2  LYS  93           2HD      LYS  93 -31.755  -4.084  -1.282
  729    HD3  LYS  93           3HD      LYS  93 -32.552  -4.330  -2.839
  730    HE2  LYS  93           2HE      LYS  93 -30.573  -3.285  -3.979
  731    HE3  LYS  93           3HE      LYS  93 -29.755  -3.170  -2.409
  732    HZ1  LYS  93           HZ1      LYS  93 -29.939  -5.632  -2.271
  733    HZ2  LYS  93           HZ2      LYS  93 -30.635  -5.655  -3.765
  734    HZ3  LYS  93           HZ3      LYS  93 -29.084  -5.173  -3.592
  735    H    VAL  94           H        VAL  94 -34.636   0.174  -1.537
  736    HA   VAL  94           HA       VAL  94 -35.698  -0.699   1.114
  737    HB   VAL  94           HB       VAL  94 -36.929   1.609  -0.395
  738   HG11  VAL  94          1HG1      VAL  94 -36.967   0.845   2.561
  739   HG12  VAL  94          2HG1      VAL  94 -37.835   2.210   1.825
  740   HG13  VAL  94          3HG1      VAL  94 -38.287   0.572   1.400
  741   HG21  VAL  94          3HG2      VAL  94 -34.675   2.464   0.080
  742   HG22  VAL  94          1HG2      VAL  94 -35.848   3.233   1.137
  743   HG23  VAL  94          2HG2      VAL  94 -34.817   1.936   1.777
  744    H    GLU  95           H        GLU  95 -37.863  -1.482   1.013
  745    HA   GLU  95           HA       GLU  95 -38.636  -2.771  -1.528
  746    HB2  GLU  95           2HB      GLU  95 -40.243  -3.931  -0.176
  747    HB3  GLU  95           3HB      GLU  95 -38.693  -3.941   0.702
  748    HG2  GLU  95           2HG      GLU  95 -39.546  -1.900   1.995
  749    HG3  GLU  95           3HG      GLU  95 -41.123  -2.166   1.253
  750    H    ILE  96           H        ILE  96 -40.914  -2.435  -2.320
  751    HA   ILE  96           HA       ILE  96 -42.597  -0.444  -1.288
  752    HB   ILE  96           HB       ILE  96 -42.491   0.849  -3.712
  753   HG12  ILE  96          2HG1      ILE  96 -40.265   1.665  -4.186
  754   HG13  ILE  96          3HG1      ILE  96 -39.565   0.593  -2.971
  755   HG21  ILE  96          1HG2      ILE  96 -41.060   1.916  -1.310
  756   HG22  ILE  96          2HG2      ILE  96 -41.847   2.801  -2.620
  757   HG23  ILE  96          3HG2      ILE  96 -42.827   1.853  -1.503
  758   HD11  ILE  96          3HD1      ILE  96 -41.021  -0.333  -5.451
  759   HD12  ILE  96          1HD1      ILE  96 -39.242  -0.270  -5.238
  760   HD13  ILE  96          2HD1      ILE  96 -40.207  -1.356  -4.259
  761    H    ALA  97           H        ALA  97 -44.579  -0.280  -2.386
  762    HA   ALA  97           HA       ALA  97 -45.129  -2.545  -4.201
  763    HB1  ALA  97           3HB      ALA  97 -47.451  -2.239  -3.748
  764    HB2  ALA  97           1HB      ALA  97 -46.598  -2.178  -2.198
  765    HB3  ALA  97           2HB      ALA  97 -47.162  -0.682  -2.981
  766    H    PHE  98           H        PHE  98 -46.069  -2.409  -6.172
  767    HA   PHE  98           HA       PHE  98 -46.376   0.250  -7.502
  768    HB2  PHE  98           2HB      PHE  98 -45.199  -2.303  -8.593
  769    HB3  PHE  98           3HB      PHE  98 -45.991  -1.164  -9.663
  770    HD1  PHE  98           HD2      PHE  98 -43.059  -1.618  -7.388
  771    HD2  PHE  98           HD1      PHE  98 -45.027   0.914 -10.276
  772    HE1  PHE  98           HE2      PHE  98 -41.003  -0.229  -7.608
  773    HE2  PHE  98           HE1      PHE  98 -42.973   2.280 -10.487
  774    HZ   PHE  98           HZ       PHE  98 -40.984   1.752  -9.105
  775    H    TYR  99           H        TYR  99 -47.995   0.291  -9.211
  776    HA   TYR  99           HA       TYR  99 -49.894  -1.929  -9.217
  777    HB2  TYR  99           2HB      TYR  99 -51.853  -0.765  -8.888
  778    HB3  TYR  99           3HB      TYR  99 -50.812  -0.188  -7.606
  779    HD1  TYR  99           HD2      TYR  99 -49.533   2.132  -8.115
  780    HD2  TYR  99           HD1      TYR  99 -53.033   0.723 -10.217
  781    HE1  TYR  99           HE2      TYR  99 -50.096   4.467  -8.773
  782    HE2  TYR  99           HE1      TYR  99 -53.573   3.053 -10.884
  783    HH   TYR  99           HH       TYR  99 -52.970   5.261 -10.756
  784    H    ARG 100           H        ARG 100 -50.814  -2.336 -11.127
  785    HA   ARG 100           HA       ARG 100 -49.673  -0.963 -13.474
  786    HB2  ARG 100           2HB      ARG 100 -51.168  -3.563 -13.038
  787    HB3  ARG 100           3HB      ARG 100 -50.979  -2.894 -14.670
  788    HG2  ARG 100           2HG      ARG 100 -48.599  -2.855 -14.516
  789    HG3  ARG 100           3HG      ARG 100 -48.623  -3.272 -12.795
  790    HD2  ARG 100           2HD      ARG 100 -49.487  -5.489 -13.285
  791    HD3  ARG 100           3HD      ARG 100 -49.630  -5.090 -15.012
  792    HE   ARG 100           HE       ARG 100 -46.980  -4.552 -14.431
  793   HH11  ARG 100          1HH1      ARG 100 -48.844  -7.467 -13.842
  794   HH12  ARG 100          2HH1      ARG 100 -47.515  -8.509 -14.263
  795   HH21  ARG 100          2HH2      ARG 100 -45.509  -5.925 -15.302
  796   HH22  ARG 100          1HH2      ARG 100 -45.613  -7.646 -14.990
  797    H    LYS 101           H        LYS 101 -50.765  -0.120 -15.155
  798    HA   LYS 101           HA       LYS 101 -53.130   1.421 -14.840
  799    HB2  LYS 101           2HB      LYS 101 -51.453   1.891 -16.468
  800    HB3  LYS 101           3HB      LYS 101 -51.633   0.330 -17.256
  801    HG2  LYS 101           2HG      LYS 101 -53.997   2.216 -17.118
  802    HG3  LYS 101           3HG      LYS 101 -52.700   2.539 -18.267
  803    HD2  LYS 101           2HD      LYS 101 -52.944   0.477 -19.386
  804    HD3  LYS 101           3HD      LYS 101 -53.994  -0.216 -18.180
  805    HE2  LYS 101           2HE      LYS 101 -54.721   2.147 -19.963
  806    HE3  LYS 101           3HE      LYS 101 -55.200   0.468 -20.237
  807    HZ1  LYS 101           HZ1      LYS 101 -56.383   0.531 -18.091
  808    HZ2  LYS 101           HZ2      LYS 101 -55.998   2.102 -17.888
  809    HZ3  LYS 101           HZ3      LYS 101 -56.970   1.657 -19.120
  810    H    ASP 102           H        ASP 102 -52.823  -1.975 -15.593
  811    HA   ASP 102           HA       ASP 102 -55.511  -2.436 -16.502
  812    HB2  ASP 102           2HB      ASP 102 -53.505  -3.878 -16.910
  813    HB3  ASP 102           3HB      ASP 102 -53.512  -4.331 -15.206
  814    H    GLY 103           H        GLY 103 -54.395  -1.631 -13.354
  815    HA2  GLY 103           HA2      GLY 103 -55.766  -1.160 -11.542
  816    HA3  GLY 103           HA3      GLY 103 -57.058  -2.153 -12.206
  817    H    SER 104           H        SER 104 -53.653  -3.041 -11.444
  818    HA   SER 104           HA       SER 104 -54.559  -4.711  -9.145
  819    HB2  SER 104           2HB      SER 104 -54.468  -6.181 -11.151
  820    HB3  SER 104           3HB      SER 104 -52.752  -5.763 -11.350
  821    HG   SER 104           HG       SER 104 -53.119  -7.727 -10.146
  822    H    CYS 105           H        CYS 105 -53.070  -4.903  -7.486
  823    HA   CYS 105           HA       CYS 105 -50.570  -3.302  -7.701
  824    HB2  CYS 105           2HB      CYS 105 -51.134  -2.309  -5.494
  825    HB3  CYS 105           3HB      CYS 105 -52.272  -1.866  -6.775
  826    HG   CYS 105           HG       CYS 105 -52.700  -4.448  -4.745
  827    H    PHE 106           H        PHE 106 -48.807  -3.901  -6.582
  828    HA   PHE 106           HA       PHE 106 -48.839  -6.353  -4.896
  829    HB2  PHE 106           2HB      PHE 106 -47.059  -7.276  -6.507
  830    HB3  PHE 106           3HB      PHE 106 -48.747  -7.378  -6.965
  831    HD1  PHE 106           HD1      PHE 106 -45.550  -5.592  -7.672
  832    HD2  PHE 106           HD2      PHE 106 -49.655  -6.183  -8.862
  833    HE1  PHE 106           HE1      PHE 106 -45.131  -4.358  -9.788
  834    HE2  PHE 106           HE2      PHE 106 -49.230  -4.934 -10.957
  835    HZ   PHE 106           HZ       PHE 106 -46.950  -4.028 -11.428
  836    H    LEU 107           H        LEU 107 -47.221  -6.566  -3.500
  837    HA   LEU 107           HA       LEU 107 -44.905  -4.685  -3.496
  838    HB2  LEU 107           2HB      LEU 107 -46.522  -4.580  -1.565
  839    HB3  LEU 107           3HB      LEU 107 -46.188  -6.262  -1.225
  840    HG   LEU 107           HG       LEU 107 -45.111  -4.834   0.349
  841   HD11  LEU 107          1HD1      LEU 107 -43.773  -6.902  -0.490
  842   HD12  LEU 107          2HD1      LEU 107 -42.751  -5.706  -1.321
  843   HD13  LEU 107          3HD1      LEU 107 -42.906  -5.640   0.420
  844   HD21  LEU 107          3HD2      LEU 107 -43.550  -3.599  -1.892
  845   HD22  LEU 107          1HD2      LEU 107 -44.844  -2.806  -0.943
  846   HD23  LEU 107          2HD2      LEU 107 -43.329  -3.273  -0.163
  847    H    CYS 108           H        CYS 108 -42.919  -5.596  -3.695
  848    HA   CYS 108           HA       CYS 108 -42.440  -8.457  -3.123
  849    HB2  CYS 108           2HB      CYS 108 -42.244  -7.129  -5.820
  850    HB3  CYS 108           3HB      CYS 108 -41.006  -8.311  -5.388
  851    HG   CYS 108           HG       CYS 108 -44.230  -8.834  -4.934
  852    H    LEU 109           H        LEU 109 -39.903  -8.824  -3.516
  853    HA   LEU 109           HA       LEU 109 -38.560  -6.949  -1.699
  854    HB2  LEU 109           2HB      LEU 109 -37.702  -9.554  -3.026
  855    HB3  LEU 109           3HB      LEU 109 -36.664  -8.579  -2.001
  856    HG   LEU 109           HG       LEU 109 -38.172  -8.889  -0.080
  857   HD11  LEU 109          1HD1      LEU 109 -40.345  -9.375  -1.045
  858   HD12  LEU 109          2HD1      LEU 109 -39.692 -10.781  -1.927
  859   HD13  LEU 109          3HD1      LEU 109 -39.819 -10.791  -0.152
  860   HD21  LEU 109          3HD2      LEU 109 -37.265 -11.469  -1.427
  861   HD22  LEU 109          1HD2      LEU 109 -36.232 -10.368  -0.488
  862   HD23  LEU 109          2HD2      LEU 109 -37.548 -11.235   0.314
  863    H    VAL 110           H        VAL 110 -39.118  -5.301  -3.506
  864    HA   VAL 110           HA       VAL 110 -37.747  -5.291  -5.965
  865    HB   VAL 110           HB       VAL 110 -38.717  -2.841  -4.509
  866   HG11  VAL 110          1HG1      VAL 110 -37.431  -2.265  -6.513
  867   HG12  VAL 110          2HG1      VAL 110 -38.314  -3.492  -7.455
  868   HG13  VAL 110          3HG1      VAL 110 -39.142  -2.040  -6.878
  869   HG21  VAL 110          3HG2      VAL 110 -40.608  -4.392  -4.626
  870   HG22  VAL 110          1HG2      VAL 110 -40.837  -3.187  -5.873
  871   HG23  VAL 110          2HG2      VAL 110 -40.228  -4.791  -6.318
  872    H    ASP 111           H        ASP 111 -35.917  -4.085  -6.775
  873    HA   ASP 111           HA       ASP 111 -33.829  -3.928  -4.629
  874    HB2  ASP 111           2HB      ASP 111 -33.930  -5.744  -6.483
  875    HB3  ASP 111           3HB      ASP 111 -33.255  -4.501  -7.531
  876    H    VAL 112           H        VAL 112 -34.670  -1.677  -4.324
  877    HA   VAL 112           HA       VAL 112 -34.217   0.255  -6.440
  878    HB   VAL 112           HB       VAL 112 -35.043   0.723  -3.547
  879   HG11  VAL 112          1HG1      VAL 112 -36.179   2.702  -4.396
  880   HG12  VAL 112          2HG1      VAL 112 -34.482   2.813  -4.861
  881   HG13  VAL 112          3HG1      VAL 112 -35.707   2.324  -6.057
  882   HG21  VAL 112          3HG2      VAL 112 -37.362   0.646  -4.459
  883   HG22  VAL 112          1HG2      VAL 112 -36.700   0.032  -6.003
  884   HG23  VAL 112          2HG2      VAL 112 -36.565  -0.925  -4.519
  885    H    VAL 113           H        VAL 113 -31.890  -0.364  -6.560
  886    HA   VAL 113           HA       VAL 113 -30.219   1.222  -4.644
  887    HB   VAL 113           HB       VAL 113 -30.031  -1.220  -4.466
  888   HG11  VAL 113          1HG1      VAL 113 -30.225  -1.841  -6.874
  889   HG12  VAL 113          2HG1      VAL 113 -28.603  -1.166  -7.153
  890   HG13  VAL 113          3HG1      VAL 113 -28.819  -2.553  -6.072
  891   HG21  VAL 113          3HG2      VAL 113 -27.451   0.133  -5.321
  892   HG22  VAL 113          1HG2      VAL 113 -28.207   0.224  -3.709
  893   HG23  VAL 113          2HG2      VAL 113 -27.607  -1.322  -4.320
  894    HA   PRO 114           HA       PRO 114 -29.152   3.513  -8.309
  895    HB2  PRO 114           2HB      PRO 114 -27.519   5.384  -7.336
  896    HB3  PRO 114           3HB      PRO 114 -29.146   5.214  -6.662
  897    HG2  PRO 114           2HG      PRO 114 -26.614   4.017  -5.527
  898    HG3  PRO 114           3HG      PRO 114 -27.825   5.070  -4.710
  899    HD2  PRO 114           2HD      PRO 114 -27.959   2.346  -4.567
  900    HD3  PRO 114           3HD      PRO 114 -29.437   3.348  -4.668
  901    H    VAL 115           H        VAL 115 -26.824   4.698  -9.187
  902    HA   VAL 115           HA       VAL 115 -24.701   2.609  -9.212
  903    HB   VAL 115           HB       VAL 115 -24.228   3.145 -11.577
  904   HG11  VAL 115          1HG1      VAL 115 -25.918   1.629 -12.477
  905   HG12  VAL 115          2HG1      VAL 115 -25.333   1.067 -10.902
  906   HG13  VAL 115          3HG1      VAL 115 -26.921   1.849 -11.027
  907   HG21  VAL 115          3HG2      VAL 115 -27.024   4.318 -11.643
  908   HG22  VAL 115          1HG2      VAL 115 -25.506   5.234 -11.774
  909   HG23  VAL 115          2HG2      VAL 115 -25.927   4.056 -13.022
  910    H    LYS 116           H        LYS 116 -22.749   3.157  -8.987
  911    HA   LYS 116           HA       LYS 116 -22.007   6.004  -8.553
  912    HB2  LYS 116           2HB      LYS 116 -20.878   3.491  -7.265
  913    HB3  LYS 116           3HB      LYS 116 -20.325   5.109  -6.925
  914    HG2  LYS 116           2HG      LYS 116 -22.186   5.665  -5.659
  915    HG3  LYS 116           3HG      LYS 116 -23.227   4.510  -6.483
  916    HD2  LYS 116           2HD      LYS 116 -22.020   2.629  -5.392
  917    HD3  LYS 116           3HD      LYS 116 -20.943   3.785  -4.587
  918    HE2  LYS 116           2HE      LYS 116 -22.923   4.782  -3.428
  919    HE3  LYS 116           3HE      LYS 116 -23.963   3.591  -4.227
  920    HZ1  LYS 116           HZ1      LYS 116 -22.602   1.845  -3.108
  921    HZ2  LYS 116           HZ2      LYS 116 -21.813   3.006  -2.263
  922    HZ3  LYS 116           HZ3      LYS 116 -23.429   2.775  -2.059
  923    H    ASN 117           H        ASN 117 -19.754   6.409  -8.635
  924    HA   ASN 117           HA       ASN 117 -18.381   5.150 -11.000
  925    HB2  ASN 117           2HB      ASN 117 -17.247   7.121 -11.420
  926    HB3  ASN 117           3HB      ASN 117 -18.853   7.669 -11.009
  927   HD21  ASN 117          2HD2      ASN 117 -19.108   8.517  -8.636
  928   HD22  ASN 117          1HD2      ASN 117 -17.664   9.287  -7.993
  929    H    GLU 118           H        GLU 118 -15.811   5.437 -10.699
  930    HA   GLU 118           HA       GLU 118 -15.060   3.450  -8.820
  931    HB2  GLU 118           2HB      GLU 118 -12.800   3.824  -9.592
  932    HB3  GLU 118           3HB      GLU 118 -13.927   3.815 -10.946
  933    HG2  GLU 118           2HG      GLU 118 -13.864   6.316 -11.002
  934    HG3  GLU 118           3HG      GLU 118 -12.714   6.307  -9.664
  935    H    ASP 119           H        ASP 119 -15.199   6.925  -8.322
  936    HA   ASP 119           HA       ASP 119 -13.590   6.987  -5.921
  937    HB2  ASP 119           2HB      ASP 119 -14.311   8.933  -7.440
  938    HB3  ASP 119           3HB      ASP 119 -15.874   8.855  -6.625
  939    H    GLY 120           H        GLY 120 -16.731   5.720  -6.552
  940    HA2  GLY 120           HA2      GLY 120 -18.039   4.468  -5.071
  941    HA3  GLY 120           HA3      GLY 120 -17.305   5.268  -3.681
  942    H    ALA 121           H        ALA 121 -18.225   7.590  -6.001
  943    HA   ALA 121           HA       ALA 121 -20.621   8.282  -4.411
  944    HB1  ALA 121           3HB      ALA 121 -18.761   9.955  -4.672
  945    HB2  ALA 121           1HB      ALA 121 -19.093   9.984  -6.424
  946    HB3  ALA 121           2HB      ALA 121 -20.325  10.537  -5.281
  947    H    VAL 122           H        VAL 122 -22.591   8.698  -5.156
  948    HA   VAL 122           HA       VAL 122 -23.453   7.154  -7.433
  949    HB   VAL 122           HB       VAL 122 -24.686   7.043  -5.437
  950   HG11  VAL 122          1HG1      VAL 122 -26.050   8.785  -4.481
  951   HG12  VAL 122          2HG1      VAL 122 -24.364   9.311  -4.477
  952   HG13  VAL 122          3HG1      VAL 122 -25.499   9.962  -5.681
  953   HG21  VAL 122          3HG2      VAL 122 -26.392   8.460  -7.504
  954   HG22  VAL 122          1HG2      VAL 122 -25.861   6.776  -7.591
  955   HG23  VAL 122          2HG2      VAL 122 -26.929   7.307  -6.274
  956    H    ILE 123           H        ILE 123 -22.877   7.900  -9.332
  957    HA   ILE 123           HA       ILE 123 -23.376  10.720 -10.027
  958    HB   ILE 123           HB       ILE 123 -22.063  10.592 -11.819
  959   HG12  ILE 123          2HG1      ILE 123 -22.886   8.772 -13.097
  960   HG13  ILE 123          3HG1      ILE 123 -21.149   8.667 -12.956
  961   HG21  ILE 123          1HG2      ILE 123 -20.853  10.355  -9.652
  962   HG22  ILE 123          2HG2      ILE 123 -20.720   8.615  -9.962
  963   HG23  ILE 123          3HG2      ILE 123 -19.945   9.778 -11.062
  964   HD11  ILE 123          3HD1      ILE 123 -23.189   6.904 -11.564
  965   HD12  ILE 123          1HD1      ILE 123 -22.065   6.457 -12.840
  966   HD13  ILE 123          2HD1      ILE 123 -21.440   6.858 -11.232
  967    H    MET 124           H        MET 124 -24.827   7.556 -10.625
  968    HA   MET 124           HA       MET 124 -27.071   9.063 -11.839
  969    HB2  MET 124           2HB      MET 124 -25.630   6.836 -13.235
  970    HB3  MET 124           3HB      MET 124 -27.389   6.850 -13.297
  971    HG2  MET 124           2HG      MET 124 -27.183   8.176 -15.050
  972    HG3  MET 124           3HG      MET 124 -26.870   9.465 -13.904
  973    HE1  MET 124           3HE      MET 124 -25.697  10.940 -15.663
  974    HE2  MET 124           1HE      MET 124 -24.863  10.957 -14.092
  975    HE3  MET 124           2HE      MET 124 -23.917  10.897 -15.592
  976    H    PHE 125           H        PHE 125 -28.993   8.267 -11.717
  977    HA   PHE 125           HA       PHE 125 -29.550   6.474  -9.383
  978    HB2  PHE 125           2HB      PHE 125 -30.799   8.994 -10.519
  979    HB3  PHE 125           3HB      PHE 125 -31.825   7.844  -9.714
  980    HD1  PHE 125           HD2      PHE 125 -29.079   7.453  -7.644
  981    HD2  PHE 125           HD1      PHE 125 -31.946  10.448  -8.847
  982    HE1  PHE 125           HE2      PHE 125 -28.767   8.621  -5.497
  983    HE2  PHE 125           HE1      PHE 125 -31.586  11.634  -6.701
  984    HZ   PHE 125           HZ       PHE 125 -29.998  10.721  -5.020
  985    H    ILE 126           H        ILE 126 -29.144   4.707 -10.812
  986    HA   ILE 126           HA       ILE 126 -31.488   4.065 -12.557
  987    HB   ILE 126           HB       ILE 126 -28.870   2.560 -12.298
  988   HG12  ILE 126          2HG1      ILE 126 -29.916   4.507 -14.399
  989   HG13  ILE 126          3HG1      ILE 126 -28.541   4.765 -13.340
  990   HG21  ILE 126          1HG2      ILE 126 -29.668   1.204 -14.152
  991   HG22  ILE 126          2HG2      ILE 126 -30.952   1.186 -12.956
  992   HG23  ILE 126          3HG2      ILE 126 -31.105   2.222 -14.356
  993   HD11  ILE 126          3HD1      ILE 126 -27.690   4.180 -15.462
  994   HD12  ILE 126          1HD1      ILE 126 -27.423   2.783 -14.370
  995   HD13  ILE 126          2HD1      ILE 126 -28.734   2.744 -15.572
  996    H    LEU 127           H        LEU 127 -32.675   4.211 -10.490
  997    HA   LEU 127           HA       LEU 127 -32.213   2.059  -8.571
  998    HB2  LEU 127           2HB      LEU 127 -34.656   3.826  -8.665
  999    HB3  LEU 127           3HB      LEU 127 -34.007   2.873  -7.355
 1000    HG   LEU 127           HG       LEU 127 -33.208   4.769  -6.592
 1001   HD11  LEU 127          1HD1      LEU 127 -31.162   3.791  -7.025
 1002   HD12  LEU 127          2HD1      LEU 127 -31.015   4.751  -8.536
 1003   HD13  LEU 127          3HD1      LEU 127 -31.169   5.552  -6.952
 1004   HD21  LEU 127          3HD2      LEU 127 -32.924   6.852  -7.862
 1005   HD22  LEU 127          1HD2      LEU 127 -33.205   5.957  -9.381
 1006   HD23  LEU 127          2HD2      LEU 127 -34.501   6.117  -8.174
 1007    H    ASN 128           H        ASN 128 -32.252   0.335  -9.894
 1008    HA   ASN 128           HA       ASN 128 -34.168  -0.536 -11.694
 1009    HB2  ASN 128           2HB      ASN 128 -32.605  -2.358  -9.808
 1010    HB3  ASN 128           3HB      ASN 128 -33.296  -2.809 -11.359
 1011   HD21  ASN 128          2HD2      ASN 128 -30.562  -1.357  -9.754
 1012   HD22  ASN 128          1HD2      ASN 128 -29.667  -1.014 -11.219
 1013    H    PHE 129           H        PHE 129 -36.428  -0.512 -11.293
 1014    HA   PHE 129           HA       PHE 129 -37.383  -1.465  -8.712
 1015    HB2  PHE 129           2HB      PHE 129 -38.878  -0.350 -11.091
 1016    HB3  PHE 129           3HB      PHE 129 -39.573  -0.851  -9.546
 1017    HD1  PHE 129           HD1      PHE 129 -38.542   0.249  -7.388
 1018    HD2  PHE 129           HD2      PHE 129 -38.353   1.967 -11.332
 1019    HE1  PHE 129           HE1      PHE 129 -38.233   2.500  -6.386
 1020    HE2  PHE 129           HE2      PHE 129 -38.043   4.220 -10.326
 1021    HZ   PHE 129           HZ       PHE 129 -37.969   4.487  -7.859
 1022    H    GLU 130           H        GLU 130 -36.136  -3.526  -9.529
 1023    HA   GLU 130           HA       GLU 130 -37.885  -5.304 -11.085
 1024    HB2  GLU 130           2HB      GLU 130 -36.231  -7.039 -10.561
 1025    HB3  GLU 130           3HB      GLU 130 -35.673  -5.633 -11.509
 1026    HG2  GLU 130           2HG      GLU 130 -34.466  -4.724  -9.745
 1027    HG3  GLU 130           3HG      GLU 130 -35.297  -5.678  -8.531
 1028    H    VAL 131           H        VAL 131 -39.582  -5.791 -10.284
 1029    HA   VAL 131           HA       VAL 131 -40.363  -6.628  -7.625
 1030    HB   VAL 131           HB       VAL 131 -41.493  -7.005 -10.402
 1031   HG11  VAL 131          1HG1      VAL 131 -43.606  -7.762  -9.489
 1032   HG12  VAL 131          2HG1      VAL 131 -42.339  -8.914  -9.058
 1033   HG13  VAL 131          3HG1      VAL 131 -42.946  -7.756  -7.849
 1034   HG21  VAL 131          3HG2      VAL 131 -42.440  -5.335  -8.029
 1035   HG22  VAL 131          1HG2      VAL 131 -41.540  -4.710  -9.426
 1036   HG23  VAL 131          2HG2      VAL 131 -43.159  -5.380  -9.652
 1037    H    VAL 132           H        VAL 132 -39.480  -8.336  -6.603
 1038    HA   VAL 132           HA       VAL 132 -39.411 -10.908  -8.031
 1039    HB   VAL 132           HB       VAL 132 -37.189 -10.082  -8.455
 1040   HG11  VAL 132          1HG1      VAL 132 -35.532  -9.693  -6.702
 1041   HG12  VAL 132          2HG1      VAL 132 -36.860  -8.536  -6.577
 1042   HG13  VAL 132          3HG1      VAL 132 -36.770  -9.906  -5.448
 1043   HG21  VAL 132          3HG2      VAL 132 -37.058 -12.279  -6.362
 1044   HG22  VAL 132          1HG2      VAL 132 -37.519 -12.506  -8.067
 1045   HG23  VAL 132          2HG2      VAL 132 -35.891 -11.949  -7.653
 1046    H    MET 133           H        MET 133 -39.910 -12.644  -6.769
 1047    HA   MET 133           HA       MET 133 -40.962 -12.072  -4.097
 1048    HB2  MET 133           2HB      MET 133 -41.123 -14.517  -5.898
 1049    HB3  MET 133           3HB      MET 133 -41.884 -14.385  -4.308
 1050    HG2  MET 133           2HG      MET 133 -43.168 -12.416  -5.071
 1051    HG3  MET 133           3HG      MET 133 -42.481 -12.579  -6.685
 1052    HE1  MET 133           3HE      MET 133 -44.141 -15.810  -8.083
 1053    HE2  MET 133           1HE      MET 133 -43.092 -14.415  -8.415
 1054    HE3  MET 133           2HE      MET 133 -42.542 -15.707  -7.321
 1055    H    GLU 134           H        GLU 134 -40.611 -13.497  -2.391
 1056    HA   GLU 134           HA       GLU 134 -37.812 -14.063  -1.811
 1057    HB2  GLU 134           2HB      GLU 134 -38.560 -14.699   0.394
 1058    HB3  GLU 134           3HB      GLU 134 -39.280 -13.169  -0.090
 1059    HG2  GLU 134           2HG      GLU 134 -41.411 -14.350  -0.645
 1060    HG3  GLU 134           3HG      GLU 134 -40.686 -15.876  -0.131
 1061    H    LYS 135           H        LYS 135 -36.949 -16.074  -1.048
 1062    HA   LYS 135           HA       LYS 135 -38.217 -18.600  -1.915
 1063    HB2  LYS 135           2HB      LYS 135 -36.939 -17.724  -3.876
 1064    HB3  LYS 135           3HB      LYS 135 -35.468 -17.713  -2.893
 1065    HG2  LYS 135           2HG      LYS 135 -35.635 -20.170  -2.604
 1066    HG3  LYS 135           3HG      LYS 135 -37.157 -20.178  -3.519
 1067    HD2  LYS 135           2HD      LYS 135 -35.951 -19.342  -5.530
 1068    HD3  LYS 135           3HD      LYS 135 -34.454 -19.258  -4.597
 1069    HE2  LYS 135           2HE      LYS 135 -34.352 -21.251  -5.904
 1070    HE3  LYS 135           3HE      LYS 135 -34.557 -21.724  -4.216
 1071    HZ1  LYS 135           HZ1      LYS 135 -36.921 -22.110  -4.686
 1072    HZ2  LYS 135           HZ2      LYS 135 -36.737 -21.633  -6.240
 1073    HZ3  LYS 135           HZ3      LYS 135 -36.008 -22.991  -5.707
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1 -40.606  -8.528  10.167
    2    H2   MET   1           2H       MET   1 -41.076 -10.067  10.491
    3    H3   MET   1           3H       MET   1 -41.848  -9.199   9.344
    4    HA   MET   1           HA       MET   1 -39.899  -9.150   7.949
    5    HB2  MET   1           2HB      MET   1 -38.684 -10.840  10.180
    6    HB3  MET   1           3HB      MET   1 -37.999 -10.703   8.560
    7    HG2  MET   1           2HG      MET   1 -37.845  -8.231   8.848
    8    HG3  MET   1           3HG      MET   1 -38.369  -8.410  10.524
    9    HE1  MET   1           3HE      MET   1 -35.352 -10.190  12.239
   10    HE2  MET   1           1HE      MET   1 -36.939  -9.423  12.457
   11    HE3  MET   1           2HE      MET   1 -36.810 -10.987  11.615
   12    HA   PRO   2           HA       PRO   2 -41.804 -12.755   6.201
   13    HB2  PRO   2           2HB      PRO   2 -40.208 -13.273   4.041
   14    HB3  PRO   2           3HB      PRO   2 -41.294 -11.853   4.138
   15    HG2  PRO   2           2HG      PRO   2 -38.329 -11.965   4.789
   16    HG3  PRO   2           3HG      PRO   2 -39.181 -10.796   3.728
   17    HD2  PRO   2           2HD      PRO   2 -38.601 -10.211   6.307
   18    HD3  PRO   2           3HD      PRO   2 -40.155  -9.698   5.584
   19    H    VAL   3           H        VAL   3 -41.574 -15.020   5.952
   20    HA   VAL   3           HA       VAL   3 -39.708 -16.263   7.804
   21    HB   VAL   3           HB       VAL   3 -40.830 -18.369   7.237
   22   HG11  VAL   3          1HG1      VAL   3 -42.794 -16.107   7.790
   23   HG12  VAL   3          2HG1      VAL   3 -43.002 -17.824   8.187
   24   HG13  VAL   3          3HG1      VAL   3 -41.735 -16.882   8.989
   25   HG21  VAL   3          3HG2      VAL   3 -42.800 -18.438   5.795
   26   HG22  VAL   3          1HG2      VAL   3 -42.576 -16.741   5.335
   27   HG23  VAL   3          2HG2      VAL   3 -41.383 -17.966   4.849
   28    H    ARG   4           H        ARG   4 -38.316 -18.050   7.365
   29    HA   ARG   4           HA       ARG   4 -37.340 -18.396   4.567
   30    HB2  ARG   4           2HB      ARG   4 -35.613 -17.790   7.012
   31    HB3  ARG   4           3HB      ARG   4 -35.008 -18.704   5.638
   32    HG2  ARG   4           2HG      ARG   4 -34.288 -16.607   5.106
   33    HG3  ARG   4           3HG      ARG   4 -35.760 -16.743   4.154
   34    HD2  ARG   4           2HD      ARG   4 -36.936 -15.422   6.028
   35    HD3  ARG   4           3HD      ARG   4 -35.357 -15.230   6.773
   36    HE   ARG   4           HE       ARG   4 -34.772 -13.670   5.150
   37   HH11  ARG   4          1HH2      ARG   4 -37.792 -15.181   4.067
   38   HH12  ARG   4          2HH2      ARG   4 -37.931 -14.041   2.740
   39   HH21  ARG   4          1HH1      ARG   4 -35.030 -12.383   3.328
   40   HH22  ARG   4          2HH1      ARG   4 -36.356 -12.731   2.231
   41    H    ARG   5           H        ARG   5 -36.571 -20.411   4.066
   42    HA   ARG   5           HA       ARG   5 -36.478 -22.555   6.044
   43    HB2  ARG   5           2HB      ARG   5 -38.085 -24.024   5.002
   44    HB3  ARG   5           3HB      ARG   5 -38.862 -22.587   5.620
   45    HG2  ARG   5           2HG      ARG   5 -38.224 -23.019   2.660
   46    HG3  ARG   5           3HG      ARG   5 -39.724 -23.491   3.440
   47    HD2  ARG   5           2HD      ARG   5 -40.050 -21.060   4.137
   48    HD3  ARG   5           3HD      ARG   5 -38.672 -20.661   3.110
   49    HE   ARG   5           HE       ARG   5 -39.970 -20.840   1.235
   50   HH11  ARG   5          1HH1      ARG   5 -41.857 -22.249   3.851
   51   HH12  ARG   5          2HH1      ARG   5 -43.272 -22.388   2.845
   52   HH21  ARG   5          1HH2      ARG   5 -41.700 -21.215   0.004
   53   HH22  ARG   5          2HH2      ARG   5 -43.206 -21.759   0.723
   54    H    GLY   6           H        GLY   6 -35.172 -24.168   5.543
   55    HA2  GLY   6           HA2      GLY   6 -33.702 -24.212   2.967
   56    HA3  GLY   6           HA3      GLY   6 -33.363 -25.163   4.414
   57    H    HIS   7           H        HIS   7 -36.401 -25.842   4.444
   58    HA   HIS   7           HA       HIS   7 -36.262 -28.335   2.967
   59    HB2  HIS   7           2HB      HIS   7 -37.409 -28.127   5.132
   60    HB3  HIS   7           3HB      HIS   7 -38.559 -26.983   4.434
   61    HD2  HIS   7           HD2      HIS   7 -40.620 -27.972   3.112
   62    HE1  HIS   7           HE1      HIS   7 -39.569 -32.105   3.262
   63    HE2  HIS   7           HE2      HIS   7 -41.386 -30.442   2.609
   64    H    VAL   8           H        VAL   8 -37.591 -29.030   1.254
   65    HA   VAL   8           HA       VAL   8 -37.916 -26.995  -0.820
   66    HB   VAL   8           HB       VAL   8 -38.365 -29.984  -0.906
   67   HG11  VAL   8          1HG1      VAL   8 -38.251 -27.928  -3.148
   68   HG12  VAL   8          2HG1      VAL   8 -38.089 -29.681  -3.396
   69   HG13  VAL   8          3HG1      VAL   8 -39.587 -29.032  -2.743
   70   HG21  VAL   8          3HG2      VAL   8 -36.001 -29.404  -0.451
   71   HG22  VAL   8          1HG2      VAL   8 -36.179 -30.024  -2.092
   72   HG23  VAL   8          2HG2      VAL   8 -36.006 -28.276  -1.823
   73    H    ALA   9           H        ALA   9 -39.587 -25.792  -0.847
   74    HA   ALA   9           HA       ALA   9 -42.351 -26.495  -0.123
   75    HB1  ALA   9           3HB      ALA   9 -41.416 -24.132  -1.775
   76    HB2  ALA   9           1HB      ALA   9 -42.794 -24.229  -0.674
   77    HB3  ALA   9           2HB      ALA   9 -41.167 -24.182  -0.012
   78    HA   PRO  10           HA       PRO  10 -44.110 -28.107  -3.978
   79    HB2  PRO  10           2HB      PRO  10 -45.100 -25.295  -4.450
   80    HB3  PRO  10           3HB      PRO  10 -45.925 -26.841  -4.832
   81    HG2  PRO  10           2HG      PRO  10 -46.517 -25.548  -2.522
   82    HG3  PRO  10           3HG      PRO  10 -46.281 -27.323  -2.518
   83    HD2  PRO  10           2HD      PRO  10 -44.428 -25.187  -1.534
   84    HD3  PRO  10           3HD      PRO  10 -44.659 -26.849  -0.937
   85    H    GLN  11           H        GLN  11 -42.695 -28.659  -5.387
   86    HA   GLN  11           HA       GLN  11 -40.368 -27.249  -5.855
   87    HB2  GLN  11           2HB      GLN  11 -39.604 -29.037  -7.140
   88    HB3  GLN  11           3HB      GLN  11 -40.637 -29.707  -5.891
   89    HG2  GLN  11           2HG      GLN  11 -41.343 -29.322  -8.837
   90    HG3  GLN  11           3HG      GLN  11 -40.934 -30.835  -8.047
   91   HE21  GLN  11          2HE2      GLN  11 -43.510 -29.630  -9.435
   92   HE22  GLN  11          1HE2      GLN  11 -44.754 -30.151  -8.299
   93    H    ASN  12           H        ASN  12 -43.235 -27.039  -7.874
   94    HA   ASN  12           HA       ASN  12 -41.890 -26.163 -10.283
   95    HB2  ASN  12           2HB      ASN  12 -44.756 -26.005  -9.241
   96    HB3  ASN  12           3HB      ASN  12 -44.263 -25.232 -10.743
   97   HD21  ASN  12          2HD2      ASN  12 -46.074 -26.800 -11.441
   98   HD22  ASN  12          1HD2      ASN  12 -45.502 -28.369 -11.985
   99    H    THR  13           H        THR  13 -43.528 -24.383  -7.639
  100    HA   THR  13           HA       THR  13 -42.748 -21.769  -8.690
  101    HB   THR  13           HB       THR  13 -44.878 -22.378  -7.490
  102    HG1  THR  13           HG1      THR  13 -44.997 -20.327  -6.600
  103   HG21  THR  13          1HG2      THR  13 -44.964 -22.200  -5.072
  104   HG22  THR  13          2HG2      THR  13 -43.896 -23.527  -5.552
  105   HG23  THR  13          3HG2      THR  13 -43.195 -22.004  -4.987
  106    H    PHE  14           H        PHE  14 -41.667 -23.906  -6.071
  107    HA   PHE  14           HA       PHE  14 -39.700 -22.271  -4.851
  108    HB2  PHE  14           2HB      PHE  14 -40.610 -24.478  -4.106
  109    HB3  PHE  14           3HB      PHE  14 -39.716 -25.259  -5.386
  110    HD1  PHE  14           HD2      PHE  14 -39.376 -23.381  -2.182
  111    HD2  PHE  14           HD1      PHE  14 -37.373 -25.796  -5.139
  112    HE1  PHE  14           HE2      PHE  14 -37.537 -23.813  -0.577
  113    HE2  PHE  14           HE1      PHE  14 -35.501 -26.175  -3.554
  114    HZ   PHE  14           HZ       PHE  14 -35.589 -25.215  -1.264
  115    H    LEU  15           H        LEU  15 -39.579 -24.333  -7.772
  116    HA   LEU  15           HA       LEU  15 -36.829 -23.533  -8.414
  117    HB2  LEU  15           2HB      LEU  15 -37.582 -25.691  -9.176
  118    HB3  LEU  15           3HB      LEU  15 -38.945 -24.968 -10.042
  119    HG   LEU  15           HG       LEU  15 -37.465 -23.864 -11.608
  120   HD11  LEU  15          1HD1      LEU  15 -35.131 -25.221 -10.182
  121   HD12  LEU  15          2HD1      LEU  15 -35.049 -24.265 -11.689
  122   HD13  LEU  15          3HD1      LEU  15 -35.460 -23.483 -10.176
  123   HD21  LEU  15          3HD2      LEU  15 -36.601 -25.842 -12.773
  124   HD22  LEU  15          1HD2      LEU  15 -36.757 -26.804 -11.285
  125   HD23  LEU  15          2HD2      LEU  15 -38.205 -26.157 -12.089
  126    H    ASP  16           H        ASP  16 -40.059 -22.558  -9.719
  127    HA   ASP  16           HA       ASP  16 -39.349 -20.745 -11.644
  128    HB2  ASP  16           2HB      ASP  16 -41.680 -21.352 -10.870
  129    HB3  ASP  16           3HB      ASP  16 -41.506 -20.134  -9.608
  130    H    THR  17           H        THR  17 -39.260 -20.123  -8.155
  131    HA   THR  17           HA       THR  17 -38.551 -17.322  -8.322
  132    HB   THR  17           HB       THR  17 -37.753 -19.344  -6.173
  133    HG1  THR  17           HG1      THR  17 -39.991 -19.187  -6.426
  134   HG21  THR  17          1HG2      THR  17 -36.439 -17.289  -5.939
  135   HG22  THR  17          2HG2      THR  17 -37.903 -16.299  -6.131
  136   HG23  THR  17          3HG2      THR  17 -37.687 -17.326  -4.698
  137    H    ILE  18           H        ILE  18 -36.570 -20.264  -8.419
  138    HA   ILE  18           HA       ILE  18 -34.000 -18.865  -8.455
  139    HB   ILE  18           HB       ILE  18 -34.676 -21.674  -9.367
  140   HG12  ILE  18          2HG1      ILE  18 -35.407 -21.497  -7.063
  141   HG13  ILE  18          3HG1      ILE  18 -34.036 -22.561  -7.237
  142   HG21  ILE  18          1HG2      ILE  18 -32.273 -22.148  -8.801
  143   HG22  ILE  18          2HG2      ILE  18 -32.505 -21.053 -10.158
  144   HG23  ILE  18          3HG2      ILE  18 -32.034 -20.398  -8.580
  145   HD11  ILE  18          3HD1      ILE  18 -33.882 -21.140  -5.208
  146   HD12  ILE  18          1HD1      ILE  18 -32.547 -20.768  -6.310
  147   HD13  ILE  18          2HD1      ILE  18 -33.951 -19.675  -6.203
  148    H    ILE  19           H        ILE  19 -36.399 -19.994 -10.865
  149    HA   ILE  19           HA       ILE  19 -34.755 -19.576 -13.149
  150    HB   ILE  19           HB       ILE  19 -37.774 -19.207 -12.950
  151   HG12  ILE  19          2HG1      ILE  19 -37.381 -21.481 -12.325
  152   HG13  ILE  19          3HG1      ILE  19 -37.945 -21.478 -13.978
  153   HG21  ILE  19          1HG2      ILE  19 -35.937 -19.563 -15.342
  154   HG22  ILE  19          2HG2      ILE  19 -37.714 -19.638 -15.406
  155   HG23  ILE  19          3HG2      ILE  19 -36.911 -18.146 -14.924
  156   HD11  ILE  19          3HD1      ILE  19 -35.521 -21.719 -14.710
  157   HD12  ILE  19          1HD1      ILE  19 -35.106 -21.899 -12.985
  158   HD13  ILE  19          2HD1      ILE  19 -36.180 -23.082 -13.751
  159    H    ARG  20           H        ARG  20 -37.093 -17.438 -11.459
  160    HA   ARG  20           HA       ARG  20 -36.560 -15.041 -12.953
  161    HB2  ARG  20           2HB      ARG  20 -37.368 -15.301 -10.031
  162    HB3  ARG  20           3HB      ARG  20 -37.516 -13.846 -10.994
  163    HG2  ARG  20           2HG      ARG  20 -39.029 -16.415 -11.682
  164    HG3  ARG  20           3HG      ARG  20 -39.607 -15.216 -10.540
  165    HD2  ARG  20           2HD      ARG  20 -40.686 -14.566 -12.413
  166    HD3  ARG  20           3HD      ARG  20 -39.272 -13.504 -12.486
  167    HE   ARG  20           HE       ARG  20 -38.631 -15.871 -13.924
  168   HH11  ARG  20          2HH1      ARG  20 -41.122 -13.409 -14.176
  169   HH12  ARG  20          1HH1      ARG  20 -41.330 -13.643 -15.889
  170   HH21  ARG  20          1HH2      ARG  20 -38.836 -15.965 -16.242
  171   HH22  ARG  20          2HH2      ARG  20 -40.135 -15.075 -16.973
  172    H    LYS  21           H        LYS  21 -34.805 -16.507 -10.258
  173    HA   LYS  21           HA       LYS  21 -33.061 -14.306  -9.658
  174    HB2  LYS  21           2HB      LYS  21 -33.588 -16.514  -8.400
  175    HB3  LYS  21           3HB      LYS  21 -32.243 -17.166  -9.372
  176    HG2  LYS  21           2HG      LYS  21 -30.713 -15.524  -8.456
  177    HG3  LYS  21           3HG      LYS  21 -32.043 -14.668  -7.624
  178    HD2  LYS  21           2HD      LYS  21 -32.542 -16.618  -6.275
  179    HD3  LYS  21           3HD      LYS  21 -31.385 -17.587  -7.200
  180    HE2  LYS  21           2HE      LYS  21 -29.522 -16.126  -6.388
  181    HE3  LYS  21           3HE      LYS  21 -30.683 -15.159  -5.470
  182    HZ1  LYS  21           HZ1      LYS  21 -30.112 -18.039  -4.996
  183    HZ2  LYS  21           HZ2      LYS  21 -29.594 -16.808  -4.062
  184    HZ3  LYS  21           HZ3      LYS  21 -31.188 -17.145  -4.146
  185    H    PHE  22           H        PHE  22 -32.646 -17.085 -11.927
  186    HA   PHE  22           HA       PHE  22 -30.227 -15.709 -12.981
  187    HB2  PHE  22           2HB      PHE  22 -29.465 -17.725 -13.878
  188    HB3  PHE  22           3HB      PHE  22 -29.924 -17.986 -12.217
  189    HD1  PHE  22           HD2      PHE  22 -31.135 -18.504 -15.764
  190    HD2  PHE  22           HD1      PHE  22 -31.257 -19.844 -11.671
  191    HE1  PHE  22           HE2      PHE  22 -32.385 -20.515 -16.466
  192    HE2  PHE  22           HE1      PHE  22 -32.489 -21.885 -12.387
  193    HZ   PHE  22           HZ       PHE  22 -33.053 -22.221 -14.783
  194    H    GLU  23           H        GLU  23 -33.423 -15.723 -13.843
  195    HA   GLU  23           HA       GLU  23 -33.689 -16.459 -16.390
  196    HB2  GLU  23           2HB      GLU  23 -35.513 -15.635 -14.917
  197    HB3  GLU  23           3HB      GLU  23 -34.918 -14.001 -15.090
  198    HG2  GLU  23           2HG      GLU  23 -36.852 -14.241 -16.430
  199    HG3  GLU  23           3HG      GLU  23 -35.512 -14.072 -17.534
  200    H    GLY  24           H        GLY  24 -32.189 -13.424 -15.377
  201    HA2  GLY  24           HA2      GLY  24 -31.025 -11.746 -16.404
  202    HA3  GLY  24           HA3      GLY  24 -30.839 -12.818 -17.790
  203    H    GLN  25           H        GLN  25 -34.108 -12.482 -17.574
  204    HA   GLN  25           HA       GLN  25 -34.241 -10.051 -19.320
  205    HB2  GLN  25           2HB      GLN  25 -35.520 -12.791 -19.679
  206    HB3  GLN  25           3HB      GLN  25 -35.844 -11.375 -20.681
  207    HG2  GLN  25           2HG      GLN  25 -33.438 -11.294 -21.341
  208    HG3  GLN  25           3HG      GLN  25 -33.146 -12.768 -20.414
  209   HE21  GLN  25          2HE2      GLN  25 -32.363 -13.127 -22.872
  210   HE22  GLN  25          1HE2      GLN  25 -33.560 -13.976 -23.843
  211    H    SER  26           H        SER  26 -35.608 -11.477 -16.501
  212    HA   SER  26           HA       SER  26 -38.348 -10.568 -16.862
  213    HB2  SER  26           2HB      SER  26 -38.512 -11.253 -14.443
  214    HB3  SER  26           3HB      SER  26 -37.932 -12.517 -15.535
  215    HG   SER  26           HG       SER  26 -36.655 -12.370 -13.631
  216    H    ARG  27           H        ARG  27 -35.496  -8.965 -15.920
  217    HA   ARG  27           HA       ARG  27 -36.584  -7.323 -13.797
  218    HB2  ARG  27           2HB      ARG  27 -33.928  -6.990 -15.225
  219    HB3  ARG  27           3HB      ARG  27 -34.351  -6.427 -13.614
  220    HG2  ARG  27           2HG      ARG  27 -33.976  -9.319 -14.504
  221    HG3  ARG  27           3HG      ARG  27 -32.927  -8.378 -13.458
  222    HD2  ARG  27           2HD      ARG  27 -34.675  -8.398 -11.710
  223    HD3  ARG  27           3HD      ARG  27 -35.791  -9.216 -12.804
  224    HE   ARG  27           HE       ARG  27 -34.743 -11.215 -12.416
  225   HH11  ARG  27          2HH1      ARG  27 -32.577  -8.738 -11.094
  226   HH12  ARG  27          1HH1      ARG  27 -31.429  -9.950 -10.591
  227   HH21  ARG  27          2HH2      ARG  27 -33.329 -12.621 -11.629
  228   HH22  ARG  27          1HH2      ARG  27 -31.803 -12.109 -10.946
  229    H    LYS  28           H        LYS  28 -36.334  -4.981 -13.681
  230    HA   LYS  28           HA       LYS  28 -37.009  -3.453 -16.128
  231    HB2  LYS  28           2HB      LYS  28 -38.978  -2.459 -14.813
  232    HB3  LYS  28           3HB      LYS  28 -39.149  -3.963 -15.695
  233    HG2  LYS  28           2HG      LYS  28 -38.578  -4.118 -12.782
  234    HG3  LYS  28           3HG      LYS  28 -40.172  -3.628 -13.290
  235    HD2  LYS  28           2HD      LYS  28 -38.867  -6.295 -13.917
  236    HD3  LYS  28           3HD      LYS  28 -40.194  -5.931 -12.828
  237    HE2  LYS  28           2HE      LYS  28 -41.565  -6.536 -14.467
  238    HE3  LYS  28           3HE      LYS  28 -41.267  -4.918 -15.113
  239    HZ1  LYS  28           HZ1      LYS  28 -39.829  -7.416 -15.869
  240    HZ2  LYS  28           HZ2      LYS  28 -40.878  -6.595 -16.842
  241    HZ3  LYS  28           HZ3      LYS  28 -39.435  -5.952 -16.455
  242    H    PHE  29           H        PHE  29 -36.821  -1.170 -15.982
  243    HA   PHE  29           HA       PHE  29 -35.706   0.080 -13.627
  244    HB2  PHE  29           2HB      PHE  29 -33.396   0.284 -14.362
  245    HB3  PHE  29           3HB      PHE  29 -33.811  -1.395 -14.188
  246    HD1  PHE  29           HD2      PHE  29 -33.988  -2.900 -16.142
  247    HD2  PHE  29           HD1      PHE  29 -32.821   1.234 -16.552
  248    HE1  PHE  29           HE2      PHE  29 -33.063  -3.384 -18.393
  249    HE2  PHE  29           HE1      PHE  29 -31.891   0.738 -18.806
  250    HZ   PHE  29           HZ       PHE  29 -31.994  -1.570 -19.717
  251    H    ILE  30           H        ILE  30 -34.772   2.101 -13.950
  252    HA   ILE  30           HA       ILE  30 -35.403   3.636 -16.398
  253    HB   ILE  30           HB       ILE  30 -35.845   5.597 -14.780
  254   HG12  ILE  30          2HG1      ILE  30 -36.872   5.150 -12.662
  255   HG13  ILE  30          3HG1      ILE  30 -36.666   3.410 -12.827
  256   HG21  ILE  30          1HG2      ILE  30 -37.872   3.366 -15.041
  257   HG22  ILE  30          2HG2      ILE  30 -38.215   5.095 -14.779
  258   HG23  ILE  30          3HG2      ILE  30 -37.439   4.559 -16.284
  259   HD11  ILE  30          3HD1      ILE  30 -34.326   5.356 -12.654
  260   HD12  ILE  30          1HD1      ILE  30 -35.059   4.560 -11.250
  261   HD13  ILE  30          2HD1      ILE  30 -34.265   3.583 -12.497
  262    H    ILE  31           H        ILE  31 -34.231   5.729 -16.419
  263    HA   ILE  31           HA       ILE  31 -31.542   5.599 -15.152
  264    HB   ILE  31           HB       ILE  31 -32.069   6.673 -17.933
  265   HG12  ILE  31          2HG1      ILE  31 -32.667   4.253 -17.999
  266   HG13  ILE  31          3HG1      ILE  31 -31.282   4.689 -19.006
  267   HG21  ILE  31          1HG2      ILE  31 -29.587   6.410 -18.109
  268   HG22  ILE  31          2HG2      ILE  31 -30.092   7.519 -16.824
  269   HG23  ILE  31          3HG2      ILE  31 -29.558   5.892 -16.404
  270   HD11  ILE  31          3HD1      ILE  31 -29.705   3.777 -17.486
  271   HD12  ILE  31          1HD1      ILE  31 -30.928   3.606 -16.215
  272   HD13  ILE  31          2HD1      ILE  31 -30.989   2.568 -17.666
  273    H    ALA  32           H        ALA  32 -31.322   7.266 -13.911
  274    HA   ALA  32           HA       ALA  32 -32.495   9.892 -14.751
  275    HB1  ALA  32           3HB      ALA  32 -33.005  10.278 -12.273
  276    HB2  ALA  32           1HB      ALA  32 -34.014   9.103 -13.142
  277    HB3  ALA  32           2HB      ALA  32 -32.736   8.547 -12.055
  278    H    ASN  33           H        ASN  33 -31.696  11.812 -13.909
  279    HA   ASN  33           HA       ASN  33 -28.772  11.751 -13.407
  280    HB2  ASN  33           2HB      ASN  33 -28.992  14.267 -13.380
  281    HB3  ASN  33           3HB      ASN  33 -29.256  13.447 -14.898
  282   HD21  ASN  33          2HD2      ASN  33 -30.131  15.640 -15.396
  283   HD22  ASN  33          1HD2      ASN  33 -31.849  15.847 -15.091
  284    H    ALA  34           H        ALA  34 -28.001  11.371 -11.457
  285    HA   ALA  34           HA       ALA  34 -29.635  11.563  -9.069
  286    HB1  ALA  34           3HB      ALA  34 -26.662  10.986  -9.413
  287    HB2  ALA  34           1HB      ALA  34 -27.619  10.692  -7.957
  288    HB3  ALA  34           2HB      ALA  34 -27.966   9.773  -9.429
  289    H    ARG  35           H        ARG  35 -27.631  13.810 -10.668
  290    HA   ARG  35           HA       ARG  35 -26.828  15.252  -8.200
  291    HB2  ARG  35           2HB      ARG  35 -25.968  15.867 -11.039
  292    HB3  ARG  35           3HB      ARG  35 -25.214  16.388  -9.540
  293    HG2  ARG  35           2HG      ARG  35 -25.161  13.650 -10.827
  294    HG3  ARG  35           3HG      ARG  35 -23.815  14.711 -10.451
  295    HD2  ARG  35           2HD      ARG  35 -25.476  13.075  -8.496
  296    HD3  ARG  35           3HD      ARG  35 -23.795  12.819  -8.966
  297    HE   ARG  35           HE       ARG  35 -23.908  15.402  -7.865
  298   HH11  ARG  35          1HH2      ARG  35 -24.335  12.096  -6.740
  299   HH12  ARG  35          2HH2      ARG  35 -23.957  12.529  -5.089
  300   HH21  ARG  35          1HH1      ARG  35 -23.404  15.856  -5.744
  301   HH22  ARG  35          2HH1      ARG  35 -23.406  14.588  -4.555
  302    H    VAL  36           H        VAL  36 -29.574  15.385  -9.797
  303    HA   VAL  36           HA       VAL  36 -29.826  18.356  -9.764
  304    HB   VAL  36           HB       VAL  36 -30.010  16.949 -11.981
  305   HG11  VAL  36          1HG1      VAL  36 -32.894  16.792 -11.031
  306   HG12  VAL  36          2HG1      VAL  36 -32.284  16.398 -12.626
  307   HG13  VAL  36          3HG1      VAL  36 -31.795  15.405 -11.234
  308   HG21  VAL  36          3HG2      VAL  36 -31.424  18.613 -12.954
  309   HG22  VAL  36          1HG2      VAL  36 -32.003  19.139 -11.349
  310   HG23  VAL  36          2HG2      VAL  36 -30.295  19.360 -11.817
  311    H    GLU  37           H        GLU  37 -31.507  19.292  -8.668
  312    HA   GLU  37           HA       GLU  37 -32.533  18.005  -6.395
  313    HB2  GLU  37           2HB      GLU  37 -32.245  20.495  -6.906
  314    HB3  GLU  37           3HB      GLU  37 -33.744  20.405  -7.823
  315    HG2  GLU  37           2HG      GLU  37 -34.271  21.299  -5.687
  316    HG3  GLU  37           3HG      GLU  37 -34.923  19.672  -5.705
  317    H    ASN  38           H        ASN  38 -33.971  18.189  -9.609
  318    HA   ASN  38           HA       ASN  38 -36.571  17.156  -8.783
  319    HB2  ASN  38           2HB      ASN  38 -36.105  18.833 -10.651
  320    HB3  ASN  38           3HB      ASN  38 -35.441  17.492 -11.587
  321   HD21  ASN  38          2HD2      ASN  38 -37.045  17.640 -13.227
  322   HD22  ASN  38          1HD2      ASN  38 -38.723  17.241 -12.906
  323    H    CYS  39           H        CYS  39 -33.643  15.532  -9.167
  324    HA   CYS  39           HA       CYS  39 -32.975  13.472  -9.896
  325    HB2  CYS  39           2HB      CYS  39 -33.861  11.729  -8.472
  326    HB3  CYS  39           3HB      CYS  39 -33.625  13.237  -7.576
  327    HG   CYS  39           HG       CYS  39 -36.201  13.979  -7.817
  328    H    ALA  40           H        ALA  40 -34.108  14.311 -12.124
  329    HA   ALA  40           HA       ALA  40 -36.439  12.753 -12.803
  330    HB1  ALA  40           3HB      ALA  40 -34.925  14.855 -14.365
  331    HB2  ALA  40           1HB      ALA  40 -36.479  14.132 -14.830
  332    HB3  ALA  40           2HB      ALA  40 -36.377  15.082 -13.347
  333    H    VAL  41           H        VAL  41 -36.851  11.473 -14.462
  334    HA   VAL  41           HA       VAL  41 -34.936   9.497 -15.254
  335    HB   VAL  41           HB       VAL  41 -37.888   9.954 -15.783
  336   HG11  VAL  41          1HG1      VAL  41 -36.275   7.456 -16.394
  337   HG12  VAL  41          2HG1      VAL  41 -38.031   7.635 -16.558
  338   HG13  VAL  41          3HG1      VAL  41 -36.960   8.540 -17.629
  339   HG21  VAL  41          3HG2      VAL  41 -38.237   8.142 -14.206
  340   HG22  VAL  41          1HG2      VAL  41 -36.483   7.880 -14.048
  341   HG23  VAL  41          2HG2      VAL  41 -37.225   9.357 -13.427
  342    H    ILE  42           H        ILE  42 -33.488  10.271 -16.600
  343    HA   ILE  42           HA       ILE  42 -34.069  11.884 -18.983
  344    HB   ILE  42           HB       ILE  42 -31.649  11.646 -19.409
  345   HG12  ILE  42          2HG1      ILE  42 -31.565  10.048 -16.811
  346   HG13  ILE  42          3HG1      ILE  42 -31.337   9.364 -18.425
  347   HG21  ILE  42          1HG2      ILE  42 -32.616  13.454 -17.950
  348   HG22  ILE  42          2HG2      ILE  42 -32.215  12.470 -16.524
  349   HG23  ILE  42          3HG2      ILE  42 -30.931  13.078 -17.587
  350   HD11  ILE  42          3HD1      ILE  42 -29.218   9.631 -17.408
  351   HD12  ILE  42          1HD1      ILE  42 -29.344  10.849 -18.696
  352   HD13  ILE  42          2HD1      ILE  42 -29.539  11.320 -16.978
  353    H    TYR  43           H        TYR  43 -33.827   8.516 -18.159
  354    HA   TYR  43           HA       TYR  43 -34.940   7.824 -20.775
  355    HB2  TYR  43           2HB      TYR  43 -32.368   7.753 -21.116
  356    HB3  TYR  43           3HB      TYR  43 -32.372   6.381 -20.056
  357    HD1  TYR  43           HD1      TYR  43 -33.719   7.673 -23.277
  358    HD2  TYR  43           HD2      TYR  43 -32.979   4.185 -20.841
  359    HE1  TYR  43           HE1      TYR  43 -34.294   6.203 -25.203
  360    HE2  TYR  43           HE2      TYR  43 -33.560   2.719 -22.770
  361    HH   TYR  43           HH       TYR  43 -34.516   4.051 -25.958
  362    H    CYS  44           H        CYS  44 -35.719   5.568 -20.927
  363    HA   CYS  44           HA       CYS  44 -36.047   4.219 -18.335
  364    HB2  CYS  44           2HB      CYS  44 -38.576   4.341 -18.598
  365    HB3  CYS  44           3HB      CYS  44 -37.781   5.871 -18.184
  366    HG   CYS  44           HG       CYS  44 -38.321   4.872 -21.278
  367    H    ASN  45           H        ASN  45 -36.683   2.037 -18.428
  368    HA   ASN  45           HA       ASN  45 -36.315   0.867 -21.113
  369    HB2  ASN  45           2HB      ASN  45 -35.040   0.152 -19.039
  370    HB3  ASN  45           3HB      ASN  45 -36.518  -0.637 -18.486
  371   HD21  ASN  45          2HD2      ASN  45 -34.148  -0.514 -21.207
  372   HD22  ASN  45          1HD2      ASN  45 -34.454  -2.169 -21.706
  373    H    ASP  46           H        ASP  46 -37.575  -0.880 -21.923
  374    HA   ASP  46           HA       ASP  46 -40.438  -0.574 -21.835
  375    HB2  ASP  46           2HB      ASP  46 -39.005  -1.611 -23.674
  376    HB3  ASP  46           3HB      ASP  46 -38.857  -3.042 -22.654
  377    H    GLY  47           H        GLY  47 -38.187  -2.565 -19.948
  378    HA2  GLY  47           HA2      GLY  47 -39.960  -4.144 -18.448
  379    HA3  GLY  47           HA3      GLY  47 -38.437  -3.456 -17.865
  380    H    PHE  48           H        PHE  48 -39.006  -0.682 -17.772
  381    HA   PHE  48           HA       PHE  48 -40.569  -0.467 -15.366
  382    HB2  PHE  48           2HB      PHE  48 -39.409   1.468 -15.346
  383    HB3  PHE  48           3HB      PHE  48 -39.017   1.353 -17.053
  384    HD1  PHE  48           HD1      PHE  48 -40.296   2.576 -18.752
  385    HD2  PHE  48           HD2      PHE  48 -41.540   2.647 -14.619
  386    HE1  PHE  48           HE1      PHE  48 -42.194   4.031 -19.344
  387    HE2  PHE  48           HE2      PHE  48 -43.422   4.134 -15.222
  388    HZ   PHE  48           HZ       PHE  48 -43.787   4.788 -17.595
  389    H    CYS  49           H        CYS  49 -41.258  -0.117 -18.812
  390    HA   CYS  49           HA       CYS  49 -43.887   0.999 -18.593
  391    HB2  CYS  49           2HB      CYS  49 -42.345   0.901 -20.653
  392    HB3  CYS  49           3HB      CYS  49 -42.988  -0.739 -20.908
  393    HG   CYS  49           HG       CYS  49 -45.535  -0.017 -20.822
  394    H    GLU  50           H        GLU  50 -42.762  -2.428 -18.641
  395    HA   GLU  50           HA       GLU  50 -45.461  -3.545 -18.435
  396    HB2  GLU  50           2HB      GLU  50 -42.883  -4.724 -17.336
  397    HB3  GLU  50           3HB      GLU  50 -44.362  -5.590 -17.737
  398    HG2  GLU  50           2HG      GLU  50 -43.999  -5.096 -20.136
  399    HG3  GLU  50           3HG      GLU  50 -42.506  -4.244 -19.723
  400    H    LEU  51           H        LEU  51 -43.079  -2.375 -16.110
  401    HA   LEU  51           HA       LEU  51 -44.196  -3.481 -13.753
  402    HB2  LEU  51           2HB      LEU  51 -41.901  -2.741 -14.062
  403    HB3  LEU  51           3HB      LEU  51 -42.409  -1.069 -14.216
  404    HG   LEU  51           HG       LEU  51 -43.328  -1.020 -11.976
  405   HD11  LEU  51          1HD1      LEU  51 -42.637  -2.811 -10.355
  406   HD12  LEU  51          2HD1      LEU  51 -43.817  -3.352 -11.549
  407   HD13  LEU  51          3HD1      LEU  51 -42.101  -3.799 -11.731
  408   HD21  LEU  51          3HD2      LEU  51 -41.072  -0.204 -12.345
  409   HD22  LEU  51          1HD2      LEU  51 -41.207  -0.991 -10.760
  410   HD23  LEU  51          2HD2      LEU  51 -40.411  -1.838 -12.090
  411    H    CYS  52           H        CYS  52 -44.584  -0.212 -15.105
  412    HA   CYS  52           HA       CYS  52 -46.698   0.378 -13.081
  413    HB2  CYS  52           2HB      CYS  52 -44.617   1.853 -13.707
  414    HB3  CYS  52           3HB      CYS  52 -45.608   2.366 -15.080
  415    HG   CYS  52           HG       CYS  52 -46.451   2.309 -11.849
  416    H    GLY  53           H        GLY  53 -46.361  -0.434 -16.451
  417    HA2  GLY  53           HA2      GLY  53 -47.999  -1.027 -17.981
  418    HA3  GLY  53           HA3      GLY  53 -49.245  -0.668 -16.796
  419    H    TYR  54           H        TYR  54 -47.158   2.026 -17.366
  420    HA   TYR  54           HA       TYR  54 -49.271   3.376 -18.966
  421    HB2  TYR  54           2HB      TYR  54 -47.096   4.437 -17.166
  422    HB3  TYR  54           3HB      TYR  54 -48.010   5.462 -18.260
  423    HD1  TYR  54           HD2      TYR  54 -50.480   5.724 -18.064
  424    HD2  TYR  54           HD1      TYR  54 -48.128   3.673 -15.095
  425    HE1  TYR  54           HE2      TYR  54 -52.316   6.017 -16.401
  426    HE2  TYR  54           HE1      TYR  54 -49.939   3.994 -13.423
  427    HH   TYR  54           HH       TYR  54 -51.965   4.988 -12.994
  428    H    SER  55           H        SER  55 -46.308   4.997 -19.316
  429    HA   SER  55           HA       SER  55 -45.377   3.626 -21.725
  430    HB2  SER  55           2HB      SER  55 -47.340   4.822 -22.611
  431    HB3  SER  55           3HB      SER  55 -46.726   6.346 -21.941
  432    HG   SER  55           HG       SER  55 -46.238   5.912 -24.225
  433    H    ARG  56           H        ARG  56 -43.395   4.379 -22.440
  434    HA   ARG  56           HA       ARG  56 -41.543   5.748 -20.699
  435    HB2  ARG  56           2HB      ARG  56 -41.566   5.269 -23.724
  436    HB3  ARG  56           3HB      ARG  56 -40.189   5.909 -22.829
  437    HG2  ARG  56           2HG      ARG  56 -40.169   3.823 -21.419
  438    HG3  ARG  56           3HG      ARG  56 -41.469   3.164 -22.401
  439    HD2  ARG  56           2HD      ARG  56 -38.825   4.098 -23.600
  440    HD3  ARG  56           3HD      ARG  56 -39.038   2.473 -22.973
  441    HE   ARG  56           HE       ARG  56 -40.098   3.542 -25.475
  442   HH11  ARG  56          1HH1      ARG  56 -40.586   1.068 -23.095
  443   HH12  ARG  56          2HH1      ARG  56 -41.323  -0.063 -24.209
  444   HH21  ARG  56          1HH2      ARG  56 -41.125   2.110 -26.889
  445   HH22  ARG  56          2HH2      ARG  56 -41.669   0.568 -26.288
  446    H    ALA  57           H        ALA  57 -43.584   6.947 -23.333
  447    HA   ALA  57           HA       ALA  57 -42.609   9.630 -23.411
  448    HB1  ALA  57           3HB      ALA  57 -45.352   8.498 -24.120
  449    HB2  ALA  57           1HB      ALA  57 -44.689  10.058 -24.654
  450    HB3  ALA  57           2HB      ALA  57 -43.935   8.548 -25.198
  451    H    GLU  58           H        GLU  58 -44.620   8.048 -21.023
  452    HA   GLU  58           HA       GLU  58 -45.655  10.587 -19.937
  453    HB2  GLU  58           2HB      GLU  58 -46.179   7.696 -19.169
  454    HB3  GLU  58           3HB      GLU  58 -46.821   9.104 -18.331
  455    HG2  GLU  58           2HG      GLU  58 -47.895   9.894 -20.422
  456    HG3  GLU  58           3HG      GLU  58 -47.285   8.483 -21.280
  457    H    VAL  59           H        VAL  59 -42.866   8.531 -19.467
  458    HA   VAL  59           HA       VAL  59 -42.356   9.847 -16.806
  459    HB   VAL  59           HB       VAL  59 -40.578   8.101 -16.510
  460   HG11  VAL  59          1HG1      VAL  59 -43.411   7.043 -16.807
  461   HG12  VAL  59          2HG1      VAL  59 -42.122   6.411 -15.752
  462   HG13  VAL  59          3HG1      VAL  59 -42.815   8.005 -15.436
  463   HG21  VAL  59          3HG2      VAL  59 -40.362   7.434 -18.893
  464   HG22  VAL  59          1HG2      VAL  59 -40.583   6.086 -17.764
  465   HG23  VAL  59          2HG2      VAL  59 -41.949   6.636 -18.757
  466    H    MET  60           H        MET  60 -41.474  10.266 -20.029
  467    HA   MET  60           HA       MET  60 -38.784  11.033 -19.956
  468    HB2  MET  60           2HB      MET  60 -41.137  12.484 -21.258
  469    HB3  MET  60           3HB      MET  60 -39.439  12.885 -21.530
  470    HG2  MET  60           2HG      MET  60 -40.744  10.289 -22.271
  471    HG3  MET  60           3HG      MET  60 -40.389  11.620 -23.346
  472    HE1  MET  60           3HE      MET  60 -38.647   9.029 -20.867
  473    HE2  MET  60           1HE      MET  60 -39.238   8.234 -22.340
  474    HE3  MET  60           2HE      MET  60 -37.493   8.348 -22.031
  475    H    GLN  61           H        GLN  61 -37.802  12.091 -18.425
  476    HA   GLN  61           HA       GLN  61 -37.017  13.803 -17.219
  477    HB2  GLN  61           2HB      GLN  61 -39.146  15.628 -18.337
  478    HB3  GLN  61           3HB      GLN  61 -37.544  16.057 -17.779
  479    HG2  GLN  61           2HG      GLN  61 -36.528  15.482 -19.752
  480    HG3  GLN  61           3HG      GLN  61 -37.538  14.120 -20.092
  481   HE21  GLN  61          2HE2      GLN  61 -39.998  14.740 -20.438
  482   HE22  GLN  61          1HE2      GLN  61 -40.135  15.841 -21.794
  483    H    ARG  62           H        ARG  62 -39.235  12.045 -16.213
  484    HA   ARG  62           HA       ARG  62 -40.518  13.799 -14.163
  485    HB2  ARG  62           2HB      ARG  62 -41.079  10.947 -15.070
  486    HB3  ARG  62           3HB      ARG  62 -42.005  11.820 -13.856
  487    HG2  ARG  62           2HG      ARG  62 -41.977  13.634 -16.005
  488    HG3  ARG  62           3HG      ARG  62 -42.025  12.092 -16.829
  489    HD2  ARG  62           2HD      ARG  62 -44.264  12.826 -16.525
  490    HD3  ARG  62           3HD      ARG  62 -44.013  11.480 -15.376
  491    HE   ARG  62           HE       ARG  62 -43.284  13.735 -13.985
  492   HH11  ARG  62          1HH1      ARG  62 -46.267  12.784 -15.536
  493   HH12  ARG  62          2HH1      ARG  62 -47.270  13.679 -14.425
  494   HH21  ARG  62          1HH2      ARG  62 -44.628  14.888 -12.574
  495   HH22  ARG  62          2HH2      ARG  62 -46.351  14.838 -12.786
  496    HA   PRO  63           HA       PRO  63 -37.880  12.561 -10.944
  497    HB2  PRO  63           2HB      PRO  63 -39.450  12.437  -8.692
  498    HB3  PRO  63           3HB      PRO  63 -39.027  13.959  -9.529
  499    HG2  PRO  63           2HG      PRO  63 -41.552  12.308  -9.855
  500    HG3  PRO  63           3HG      PRO  63 -41.413  14.072  -9.566
  501    HD2  PRO  63           2HD      PRO  63 -41.765  13.105 -12.056
  502    HD3  PRO  63           3HD      PRO  63 -40.638  14.465 -11.776
  503    H    CYS  64           H        CYS  64 -36.905  10.751 -10.175
  504    HA   CYS  64           HA       CYS  64 -38.024   8.118 -10.501
  505    HB2  CYS  64           2HB      CYS  64 -35.505   9.322  -9.398
  506    HB3  CYS  64           3HB      CYS  64 -35.926   7.684  -8.863
  507    HG   CYS  64           HG       CYS  64 -34.262   7.508 -10.863
  508    H    THR  65           H        THR  65 -38.539  10.345  -7.885
  509    HA   THR  65           HA       THR  65 -38.706   8.535  -5.755
  510    HB   THR  65           HB       THR  65 -40.402  11.038  -5.841
  511    HG1  THR  65           HG1      THR  65 -38.604  12.177  -5.216
  512   HG21  THR  65          1HG2      THR  65 -38.753   9.569  -3.738
  513   HG22  THR  65          2HG2      THR  65 -39.699  11.057  -3.453
  514   HG23  THR  65          3HG2      THR  65 -40.526   9.543  -3.856
  515    H    CYS  66           H        CYS  66 -39.778   6.818  -6.118
  516    HA   CYS  66           HA       CYS  66 -42.055   6.252  -7.471
  517    HB2  CYS  66           2HB      CYS  66 -42.130   4.145  -6.176
  518    HB3  CYS  66           3HB      CYS  66 -40.461   4.592  -6.586
  519    HG   CYS  66           HG       CYS  66 -40.509   3.621  -4.151
  520    H    ASP  67           H        ASP  67 -42.238   7.987  -4.512
  521    HA   ASP  67           HA       ASP  67 -44.886   7.340  -3.647
  522    HB2  ASP  67           2HB      ASP  67 -43.233   8.867  -2.465
  523    HB3  ASP  67           3HB      ASP  67 -43.577  10.090  -3.682
  524    H    PHE  68           H        PHE  68 -43.700   9.384  -6.318
  525    HA   PHE  68           HA       PHE  68 -46.101  10.590  -7.240
  526    HB2  PHE  68           2HB      PHE  68 -44.009  11.304  -8.110
  527    HB3  PHE  68           3HB      PHE  68 -43.501   9.664  -8.477
  528    HD1  PHE  68           HD1      PHE  68 -46.254  12.027  -9.533
  529    HD2  PHE  68           HD2      PHE  68 -43.398   8.998 -10.669
  530    HE1  PHE  68           HE1      PHE  68 -47.019  12.178 -11.891
  531    HE2  PHE  68           HE2      PHE  68 -44.148   9.172 -13.027
  532    HZ   PHE  68           HZ       PHE  68 -45.975  10.741 -13.638
  533    H    LEU  69           H        LEU  69 -45.116   7.238  -7.410
  534    HA   LEU  69           HA       LEU  69 -47.538   6.571  -8.977
  535    HB2  LEU  69           2HB      LEU  69 -46.309   4.770 -10.124
  536    HB3  LEU  69           3HB      LEU  69 -45.826   6.400 -10.535
  537    HG   LEU  69           HG       LEU  69 -43.808   6.146  -9.020
  538   HD11  LEU  69          1HD1      LEU  69 -44.524   4.210  -7.642
  539   HD12  LEU  69          2HD1      LEU  69 -44.616   3.209  -9.093
  540   HD13  LEU  69          3HD1      LEU  69 -43.050   3.846  -8.530
  541   HD21  LEU  69          3HD2      LEU  69 -43.690   5.932 -11.466
  542   HD22  LEU  69          1HD2      LEU  69 -42.555   4.837 -10.666
  543   HD23  LEU  69          2HD2      LEU  69 -44.073   4.202 -11.341
  544    H    HIS  70           H        HIS  70 -47.096   6.700  -6.022
  545    HA   HIS  70           HA       HIS  70 -47.209   3.989  -5.081
  546    HB2  HIS  70           2HB      HIS  70 -47.787   4.811  -3.030
  547    HB3  HIS  70           3HB      HIS  70 -46.906   6.160  -3.706
  548    HD2  HIS  70           HD2      HIS  70 -48.947   7.946  -5.110
  549    HE1  HIS  70           HE1      HIS  70 -51.620   7.430  -1.830
  550    HE2  HIS  70           HE2      HIS  70 -51.081   8.859  -3.869
  551    H    GLY  71           H        GLY  71 -48.914   2.620  -4.581
  552    HA2  GLY  71           HA2      GLY  71 -51.607   3.224  -5.748
  553    HA3  GLY  71           HA3      GLY  71 -50.800   1.680  -6.001
  554    HA   PRO  72           HA       PRO  72 -53.650   1.900  -2.287
  555    HB2  PRO  72           2HB      PRO  72 -54.775  -0.624  -3.502
  556    HB3  PRO  72           3HB      PRO  72 -55.639   0.727  -2.701
  557    HG2  PRO  72           2HG      PRO  72 -55.622   0.565  -5.394
  558    HG3  PRO  72           3HG      PRO  72 -55.316   2.151  -4.608
  559    HD2  PRO  72           2HD      PRO  72 -53.288   0.173  -5.697
  560    HD3  PRO  72           3HD      PRO  72 -53.399   1.937  -5.967
  561    H    ARG  73           H        ARG  73 -51.440  -0.548  -3.245
  562    HA   ARG  73           HA       ARG  73 -51.405  -1.722  -0.496
  563    HB2  ARG  73           2HB      ARG  73 -51.947  -3.254  -2.375
  564    HB3  ARG  73           3HB      ARG  73 -50.340  -2.983  -3.047
  565    HG2  ARG  73           2HG      ARG  73 -49.268  -4.090  -1.249
  566    HG3  ARG  73           3HG      ARG  73 -50.684  -3.979  -0.196
  567    HD2  ARG  73           2HD      ARG  73 -50.618  -5.640  -2.748
  568    HD3  ARG  73           3HD      ARG  73 -50.173  -6.264  -1.167
  569    HE   ARG  73           HE       ARG  73 -52.413  -5.891  -0.352
  570   HH11  ARG  73          1HH2      ARG  73 -52.254  -5.683  -3.883
  571   HH12  ARG  73          2HH2      ARG  73 -53.943  -6.080  -4.026
  572   HH21  ARG  73          2HH1      ARG  73 -54.538  -6.339  -0.664
  573   HH22  ARG  73          1HH1      ARG  73 -55.194  -6.408  -2.272
  574    H    THR  74           H        THR  74 -49.811   0.652  -2.186
  575    HA   THR  74           HA       THR  74 -47.087  -0.019  -1.345
  576    HB   THR  74           HB       THR  74 -47.999   2.716  -2.247
  577    HG1  THR  74           HG1      THR  74 -46.941   0.986  -4.122
  578   HG21  THR  74          1HG2      THR  74 -45.686   2.639  -1.501
  579   HG22  THR  74          2HG2      THR  74 -45.381   1.155  -2.425
  580   HG23  THR  74          3HG2      THR  74 -45.672   2.696  -3.266
  581    H    GLN  75           H        GLN  75 -45.916   0.753   0.313
  582    HA   GLN  75           HA       GLN  75 -47.361   2.179   2.468
  583    HB2  GLN  75           2HB      GLN  75 -44.668   0.834   2.386
  584    HB3  GLN  75           3HB      GLN  75 -45.272   1.725   3.766
  585    HG2  GLN  75           2HG      GLN  75 -46.719  -0.681   2.588
  586    HG3  GLN  75           3HG      GLN  75 -45.581  -0.765   3.929
  587   HE21  GLN  75          2HE2      GLN  75 -48.374  -1.560   4.100
  588   HE22  GLN  75          1HE2      GLN  75 -49.096  -0.483   5.288
  589    H    ARG  76           H        ARG  76 -47.052   4.125   3.025
  590    HA   ARG  76           HA       ARG  76 -45.589   5.998   1.330
  591    HB2  ARG  76           2HB      ARG  76 -46.901   6.609   3.973
  592    HB3  ARG  76           3HB      ARG  76 -46.462   7.756   2.706
  593    HG2  ARG  76           2HG      ARG  76 -48.666   5.659   2.627
  594    HG3  ARG  76           3HG      ARG  76 -48.854   7.404   2.617
  595    HD2  ARG  76           2HD      ARG  76 -47.538   5.777   0.384
  596    HD3  ARG  76           3HD      ARG  76 -49.223   6.261   0.388
  597    HE   ARG  76           HE       ARG  76 -46.946   7.921  -0.339
  598   HH11  ARG  76          2HH2      ARG  76 -50.222   8.208   0.918
  599   HH12  ARG  76          1HH2      ARG  76 -50.387   9.821   0.274
  600   HH21  ARG  76          1HH1      ARG  76 -47.230   9.836  -1.128
  601   HH22  ARG  76          2HH1      ARG  76 -48.716  10.744  -0.879
  602    H    ARG  77           H        ARG  77 -44.987   4.673   4.583
  603    HA   ARG  77           HA       ARG  77 -42.568   6.087   5.107
  604    HB2  ARG  77           2HB      ARG  77 -42.001   4.383   6.631
  605    HB3  ARG  77           3HB      ARG  77 -43.740   4.696   6.724
  606    HG2  ARG  77           2HG      ARG  77 -43.764   2.582   5.019
  607    HG3  ARG  77           3HG      ARG  77 -42.232   2.265   5.822
  608    HD2  ARG  77           2HD      ARG  77 -43.721   1.080   7.103
  609    HD3  ARG  77           3HD      ARG  77 -43.589   2.558   8.045
  610    HE   ARG  77           HE       ARG  77 -45.863   1.742   6.235
  611   HH11  ARG  77          2HH1      ARG  77 -44.895   3.812   8.908
  612   HH12  ARG  77          1HH1      ARG  77 -46.528   4.374   9.135
  613   HH21  ARG  77          1HH2      ARG  77 -47.803   2.468   6.548
  614   HH22  ARG  77          2HH2      ARG  77 -48.169   3.615   7.826
  615    H    ALA  78           H        ALA  78 -43.117   3.266   3.068
  616    HA   ALA  78           HA       ALA  78 -40.345   2.686   2.519
  617    HB1  ALA  78           3HB      ALA  78 -41.245   1.239   0.771
  618    HB2  ALA  78           1HB      ALA  78 -42.215   1.037   2.216
  619    HB3  ALA  78           2HB      ALA  78 -42.812   1.971   0.820
  620    H    ALA  79           H        ALA  79 -42.918   4.440   0.726
  621    HA   ALA  79           HA       ALA  79 -41.223   5.326  -1.414
  622    HB1  ALA  79           3HB      ALA  79 -43.092   6.698  -2.015
  623    HB2  ALA  79           1HB      ALA  79 -43.741   5.169  -1.411
  624    HB3  ALA  79           2HB      ALA  79 -43.772   6.625  -0.375
  625    H    ALA  80           H        ALA  80 -41.973   6.795   1.725
  626    HA   ALA  80           HA       ALA  80 -40.716   9.304   1.295
  627    HB1  ALA  80           3HB      ALA  80 -40.914   9.501   3.757
  628    HB2  ALA  80           1HB      ALA  80 -42.414   8.915   3.008
  629    HB3  ALA  80           2HB      ALA  80 -41.337   7.776   3.850
  630    H    GLN  81           H        GLN  81 -39.452   6.368   3.048
  631    HA   GLN  81           HA       GLN  81 -36.795   7.197   3.483
  632    HB2  GLN  81           2HB      GLN  81 -38.009   4.499   2.790
  633    HB3  GLN  81           3HB      GLN  81 -36.287   4.706   3.128
  634    HG2  GLN  81           2HG      GLN  81 -36.735   5.530   5.364
  635    HG3  GLN  81           3HG      GLN  81 -38.473   5.536   5.082
  636   HE21  GLN  81          2HE2      GLN  81 -35.620   3.326   5.287
  637   HE22  GLN  81          1HE2      GLN  81 -36.579   1.940   5.786
  638    H    ILE  82           H        ILE  82 -38.238   5.827   0.449
  639    HA   ILE  82           HA       ILE  82 -35.777   6.059  -1.053
  640    HB   ILE  82           HB       ILE  82 -38.694   5.843  -1.771
  641   HG12  ILE  82          2HG1      ILE  82 -36.282   4.119  -2.488
  642   HG13  ILE  82          3HG1      ILE  82 -37.105   3.979  -0.930
  643   HG21  ILE  82          1HG2      ILE  82 -37.871   7.344  -3.481
  644   HG22  ILE  82          2HG2      ILE  82 -36.404   6.365  -3.712
  645   HG23  ILE  82          3HG2      ILE  82 -37.997   5.732  -4.193
  646   HD11  ILE  82          3HD1      ILE  82 -39.237   3.546  -2.037
  647   HD12  ILE  82          1HD1      ILE  82 -38.405   3.553  -3.622
  648   HD13  ILE  82          2HD1      ILE  82 -37.970   2.340  -2.398
  649    H    ALA  83           H        ALA  83 -38.531   8.360  -0.740
  650    HA   ALA  83           HA       ALA  83 -37.470  10.450  -2.254
  651    HB1  ALA  83           3HB      ALA  83 -38.936  11.889  -1.063
  652    HB2  ALA  83           1HB      ALA  83 -39.739  10.297  -1.096
  653    HB3  ALA  83           2HB      ALA  83 -38.922  10.870   0.376
  654    H    GLN  84           H        GLN  84 -36.548   9.547   1.056
  655    HA   GLN  84           HA       GLN  84 -34.768  11.831   1.481
  656    HB2  GLN  84           2HB      GLN  84 -34.484   9.148   2.860
  657    HB3  GLN  84           3HB      GLN  84 -33.939  10.730   3.381
  658    HG2  GLN  84           2HG      GLN  84 -36.699   9.575   3.440
  659    HG3  GLN  84           3HG      GLN  84 -35.773  10.196   4.749
  660   HE21  GLN  84          1HE2      GLN  84 -38.216  10.913   2.505
  661   HE22  GLN  84          2HE2      GLN  84 -38.321  12.652   2.820
  662    H    ALA  85           H        ALA  85 -34.363   8.488   0.163
  663    HA   ALA  85           HA       ALA  85 -31.472   8.622  -0.001
  664    HB1  ALA  85           3HB      ALA  85 -32.754   6.501   0.049
  665    HB2  ALA  85           1HB      ALA  85 -33.448   6.885  -1.544
  666    HB3  ALA  85           2HB      ALA  85 -31.703   6.618  -1.376
  667    H    LEU  86           H        LEU  86 -34.117   9.571  -2.178
  668    HA   LEU  86           HA       LEU  86 -32.305  10.309  -4.334
  669    HB2  LEU  86           2HB      LEU  86 -35.213  11.091  -4.084
  670    HB3  LEU  86           3HB      LEU  86 -34.205  11.053  -5.518
  671    HG   LEU  86           HG       LEU  86 -35.628   8.833  -4.094
  672   HD11  LEU  86          1HD1      LEU  86 -34.979   9.315  -7.027
  673   HD12  LEU  86          2HD1      LEU  86 -36.175   8.175  -6.356
  674   HD13  LEU  86          3HD1      LEU  86 -36.411   9.926  -6.193
  675   HD21  LEU  86          3HD2      LEU  86 -33.091   8.355  -5.760
  676   HD22  LEU  86          1HD2      LEU  86 -33.370   7.815  -4.091
  677   HD23  LEU  86          2HD2      LEU  86 -34.302   7.106  -5.398
  678    H    LEU  87           H        LEU  87 -33.878  12.042  -1.673
  679    HA   LEU  87           HA       LEU  87 -33.053  14.701  -2.258
  680    HB2  LEU  87           2HB      LEU  87 -34.771  14.451  -0.763
  681    HB3  LEU  87           3HB      LEU  87 -34.088  13.031  -0.014
  682    HG   LEU  87           HG       LEU  87 -32.847  15.600   0.561
  683   HD11  LEU  87          1HD1      LEU  87 -34.385  15.854   2.503
  684   HD12  LEU  87          2HD1      LEU  87 -35.246  15.935   0.959
  685   HD13  LEU  87          3HD1      LEU  87 -35.298  14.441   1.920
  686   HD21  LEU  87          3HD2      LEU  87 -31.667  13.676   1.469
  687   HD22  LEU  87          1HD2      LEU  87 -32.367  14.635   2.762
  688   HD23  LEU  87          2HD2      LEU  87 -33.154  13.127   2.273
  689    H    GLY  88           H        GLY  88 -31.393  11.928  -0.823
  690    HA2  GLY  88           HA2      GLY  88 -29.045  11.706  -1.372
  691    HA3  GLY  88           HA3      GLY  88 -28.804  13.427  -1.092
  692    H    ALA  89           H        ALA  89 -30.772  11.719   1.257
  693    HA   ALA  89           HA       ALA  89 -29.064  12.345   3.443
  694    HB1  ALA  89           3HB      ALA  89 -30.589  10.860   4.721
  695    HB2  ALA  89           1HB      ALA  89 -31.475  11.986   3.680
  696    HB3  ALA  89           2HB      ALA  89 -31.301  10.281   3.201
  697    H    GLU  90           H        GLU  90 -29.602   9.209   1.791
  698    HA   GLU  90           HA       GLU  90 -26.819   8.500   1.924
  699    HB2  GLU  90           2HB      GLU  90 -27.082   6.382   3.159
  700    HB3  GLU  90           3HB      GLU  90 -27.297   7.792   4.180
  701    HG2  GLU  90           2HG      GLU  90 -29.778   7.490   4.066
  702    HG3  GLU  90           3HG      GLU  90 -29.541   6.047   3.078
  703    H    GLU  91           H        GLU  91 -26.279   6.705   0.616
  704    HA   GLU  91           HA       GLU  91 -28.241   5.827  -1.436
  705    HB2  GLU  91           2HB      GLU  91 -25.954   6.351  -2.063
  706    HB3  GLU  91           3HB      GLU  91 -25.296   5.186  -0.917
  707    HG2  GLU  91           2HG      GLU  91 -27.278   4.223  -2.967
  708    HG3  GLU  91           3HG      GLU  91 -25.668   4.668  -3.529
  709    H    ARG  92           H        ARG  92 -29.719   4.374  -0.757
  710    HA   ARG  92           HA       ARG  92 -28.898   1.942   0.709
  711    HB2  ARG  92           2HB      ARG  92 -29.474   3.782   2.378
  712    HB3  ARG  92           3HB      ARG  92 -31.088   3.837   1.692
  713    HG2  ARG  92           2HG      ARG  92 -31.176   2.561   3.717
  714    HG3  ARG  92           3HG      ARG  92 -31.435   1.452   2.381
  715    HD2  ARG  92           2HD      ARG  92 -29.984   0.425   4.030
  716    HD3  ARG  92           3HD      ARG  92 -29.051   0.709   2.553
  717    HE   ARG  92           HE       ARG  92 -28.781   2.970   4.324
  718   HH11  ARG  92          2HH1      ARG  92 -27.565  -0.327   4.138
  719   HH12  ARG  92          1HH1      ARG  92 -26.146   0.092   5.061
  720   HH21  ARG  92          2HH2      ARG  92 -27.124   3.403   5.407
  721   HH22  ARG  92          1HH2      ARG  92 -25.871   2.214   5.798
  722    H    LYS  93           H        LYS  93 -30.092   0.187   0.156
  723    HA   LYS  93           HA       LYS  93 -32.197   0.361  -1.866
  724    HB2  LYS  93           2HB      LYS  93 -30.510  -1.492  -1.681
  725    HB3  LYS  93           3HB      LYS  93 -31.364  -2.050  -0.231
  726    HG2  LYS  93           2HG      LYS  93 -33.468  -2.078  -1.837
  727    HG3  LYS  93           3HG      LYS  93 -32.259  -1.997  -3.114
  728    HD2  LYS  93           2HD      LYS  93 -32.508  -4.141  -0.967
  729    HD3  LYS  93           3HD      LYS  93 -32.906  -4.309  -2.681
  730    HE2  LYS  93           2HE      LYS  93 -30.464  -3.688  -3.164
  731    HE3  LYS  93           3HE      LYS  93 -30.158  -3.894  -1.430
  732    HZ1  LYS  93           HZ1      LYS  93 -31.027  -5.911  -3.403
  733    HZ2  LYS  93           HZ2      LYS  93 -29.667  -5.949  -2.510
  734    HZ3  LYS  93           HZ3      LYS  93 -31.107  -6.223  -1.775
  735    H    VAL  94           H        VAL  94 -34.344   0.249  -1.562
  736    HA   VAL  94           HA       VAL  94 -35.507  -0.509   1.078
  737    HB   VAL  94           HB       VAL  94 -36.699   1.769  -0.500
  738   HG11  VAL  94          1HG1      VAL  94 -36.834   1.048   2.463
  739   HG12  VAL  94          2HG1      VAL  94 -37.704   2.377   1.667
  740   HG13  VAL  94          3HG1      VAL  94 -38.097   0.718   1.259
  741   HG21  VAL  94          3HG2      VAL  94 -34.651   2.124   1.731
  742   HG22  VAL  94          1HG2      VAL  94 -34.479   2.659   0.041
  743   HG23  VAL  94          2HG2      VAL  94 -35.685   3.413   1.077
  744    H    GLU  95           H        GLU  95 -37.564  -1.420   0.944
  745    HA   GLU  95           HA       GLU  95 -38.257  -2.665  -1.641
  746    HB2  GLU  95           2HB      GLU  95 -39.841  -3.947  -0.306
  747    HB3  GLU  95           3HB      GLU  95 -38.225  -3.987   0.428
  748    HG2  GLU  95           2HG      GLU  95 -38.926  -2.251   2.073
  749    HG3  GLU  95           3HG      GLU  95 -40.535  -2.210   1.360
  750    H    ILE  96           H        ILE  96 -40.479  -2.409  -2.534
  751    HA   ILE  96           HA       ILE  96 -42.303  -0.573  -1.403
  752    HB   ILE  96           HB       ILE  96 -42.266   0.778  -3.805
  753   HG12  ILE  96          2HG1      ILE  96 -40.154   1.796  -4.217
  754   HG13  ILE  96          3HG1      ILE  96 -39.384   0.867  -2.924
  755   HG21  ILE  96          1HG2      ILE  96 -42.721   1.665  -1.544
  756   HG22  ILE  96          2HG2      ILE  96 -40.961   1.885  -1.345
  757   HG23  ILE  96          3HG2      ILE  96 -41.833   2.736  -2.620
  758   HD11  ILE  96          3HD1      ILE  96 -39.137  -0.991  -4.182
  759   HD12  ILE  96          1HD1      ILE  96 -40.588  -0.677  -5.176
  760   HD13  ILE  96          2HD1      ILE  96 -39.078   0.220  -5.454
  761    H    ALA  97           H        ALA  97 -44.303  -0.512  -2.467
  762    HA   ALA  97           HA       ALA  97 -44.722  -2.815  -4.281
  763    HB1  ALA  97           3HB      ALA  97 -46.885  -1.039  -3.166
  764    HB2  ALA  97           1HB      ALA  97 -47.041  -2.668  -3.773
  765    HB3  ALA  97           2HB      ALA  97 -46.199  -2.391  -2.235
  766    H    PHE  98           H        PHE  98 -45.662  -2.730  -6.293
  767    HA   PHE  98           HA       PHE  98 -45.993  -0.044  -7.580
  768    HB2  PHE  98           2HB      PHE  98 -44.659  -2.502  -8.710
  769    HB3  PHE  98           3HB      PHE  98 -45.446  -1.339  -9.758
  770    HD1  PHE  98           HD1      PHE  98 -42.653  -1.714  -7.280
  771    HD2  PHE  98           HD2      PHE  98 -44.497   0.738 -10.314
  772    HE1  PHE  98           HE1      PHE  98 -40.647  -0.237  -7.340
  773    HE2  PHE  98           HE2      PHE  98 -42.490   2.192 -10.366
  774    HZ   PHE  98           HZ       PHE  98 -40.589   1.738  -8.840
  775    H    TYR  99           H        TYR  99 -47.723   0.292  -8.866
  776    HA   TYR  99           HA       TYR  99 -49.689  -1.918  -9.046
  777    HB2  TYR  99           2HB      TYR  99 -51.490  -0.501  -8.926
  778    HB3  TYR  99           3HB      TYR  99 -50.402   0.112  -7.698
  779    HD1  TYR  99           HD1      TYR  99 -49.040   2.259  -8.181
  780    HD2  TYR  99           HD2      TYR  99 -52.296   0.863 -10.645
  781    HE1  TYR  99           HE1      TYR  99 -49.275   4.529  -9.182
  782    HE2  TYR  99           HE2      TYR  99 -52.514   3.124 -11.650
  783    HH   TYR  99           HH       TYR  99 -50.406   5.852 -10.678
  784    H    ARG 100           H        ARG 100 -50.620  -2.440 -10.921
  785    HA   ARG 100           HA       ARG 100 -49.457  -1.347 -13.437
  786    HB2  ARG 100           2HB      ARG 100 -51.580  -3.512 -13.176
  787    HB3  ARG 100           3HB      ARG 100 -50.580  -3.145 -14.580
  788    HG2  ARG 100           2HG      ARG 100 -49.658  -4.380 -11.947
  789    HG3  ARG 100           3HG      ARG 100 -49.852  -5.218 -13.478
  790    HD2  ARG 100           2HD      ARG 100 -48.051  -4.074 -14.519
  791    HD3  ARG 100           3HD      ARG 100 -47.964  -2.855 -13.261
  792    HE   ARG 100           HE       ARG 100 -46.498  -5.241 -13.311
  793   HH11  ARG 100          1HH1      ARG 100 -48.192  -3.314 -10.984
  794   HH12  ARG 100          2HH1      ARG 100 -47.221  -3.839  -9.633
  795   HH21  ARG 100          1HH2      ARG 100 -45.225  -5.865 -11.602
  796   HH22  ARG 100          2HH2      ARG 100 -45.537  -5.220 -10.016
  797    H    LYS 101           H        LYS 101 -50.534  -0.035 -14.777
  798    HA   LYS 101           HA       LYS 101 -52.574   1.687 -14.113
  799    HB2  LYS 101           2HB      LYS 101 -51.061   2.062 -15.894
  800    HB3  LYS 101           3HB      LYS 101 -51.508   0.591 -16.738
  801    HG2  LYS 101           2HG      LYS 101 -53.559   2.775 -16.360
  802    HG3  LYS 101           3HG      LYS 101 -52.315   2.948 -17.592
  803    HD2  LYS 101           2HD      LYS 101 -53.793   0.331 -17.482
  804    HD3  LYS 101           3HD      LYS 101 -54.676   1.730 -18.100
  805    HE2  LYS 101           2HE      LYS 101 -52.001   0.712 -19.159
  806    HE3  LYS 101           3HE      LYS 101 -53.574   0.277 -19.825
  807    HZ1  LYS 101           HZ1      LYS 101 -53.950   2.627 -20.341
  808    HZ2  LYS 101           HZ2      LYS 101 -52.484   3.039 -19.739
  809    HZ3  LYS 101           HZ3      LYS 101 -52.588   2.099 -21.066
  810    H    ASP 102           H        ASP 102 -53.030  -1.601 -15.246
  811    HA   ASP 102           HA       ASP 102 -55.802  -1.506 -15.899
  812    HB2  ASP 102           2HB      ASP 102 -54.169  -3.288 -16.505
  813    HB3  ASP 102           3HB      ASP 102 -54.112  -3.794 -14.817
  814    H    GLY 103           H        GLY 103 -54.278  -1.312 -12.781
  815    HA2  GLY 103           HA2      GLY 103 -55.512  -0.433 -10.963
  816    HA3  GLY 103           HA3      GLY 103 -56.950  -1.314 -11.456
  817    H    SER 104           H        SER 104 -53.592  -2.545 -10.884
  818    HA   SER 104           HA       SER 104 -54.490  -3.857  -8.369
  819    HB2  SER 104           2HB      SER 104 -54.910  -5.503 -10.189
  820    HB3  SER 104           3HB      SER 104 -53.187  -5.440 -10.612
  821    HG   SER 104           HG       SER 104 -53.742  -7.172  -9.152
  822    H    CYS 105           H        CYS 105 -52.883  -4.101  -6.845
  823    HA   CYS 105           HA       CYS 105 -50.150  -3.115  -7.522
  824    HB2  CYS 105           2HB      CYS 105 -51.664  -1.331  -6.572
  825    HB3  CYS 105           3HB      CYS 105 -51.802  -2.298  -5.100
  826    HG   CYS 105           HG       CYS 105 -50.020  -0.174  -4.948
  827    H    PHE 106           H        PHE 106 -48.415  -4.034  -6.530
  828    HA   PHE 106           HA       PHE 106 -48.803  -5.660  -4.128
  829    HB2  PHE 106           2HB      PHE 106 -47.692  -7.691  -5.172
  830    HB3  PHE 106           3HB      PHE 106 -49.376  -7.395  -5.510
  831    HD1  PHE 106           HD2      PHE 106 -50.185  -6.820  -7.731
  832    HD2  PHE 106           HD1      PHE 106 -45.982  -7.488  -7.000
  833    HE1  PHE 106           HE2      PHE 106 -49.822  -7.173 -10.158
  834    HE2  PHE 106           HE1      PHE 106 -45.645  -7.916  -9.421
  835    HZ   PHE 106           HZ       PHE 106 -47.555  -7.758 -11.003
  836    H    LEU 107           H        LEU 107 -47.043  -6.345  -3.050
  837    HA   LEU 107           HA       LEU 107 -44.573  -4.727  -3.361
  838    HB2  LEU 107           2HB      LEU 107 -46.055  -4.510  -1.321
  839    HB3  LEU 107           3HB      LEU 107 -45.749  -6.187  -0.957
  840    HG   LEU 107           HG       LEU 107 -44.507  -4.682   0.477
  841   HD11  LEU 107          1HD1      LEU 107 -42.322  -5.610   0.409
  842   HD12  LEU 107          2HD1      LEU 107 -43.385  -6.894  -0.217
  843   HD13  LEU 107          3HD1      LEU 107 -42.386  -5.916  -1.315
  844   HD21  LEU 107          3HD2      LEU 107 -42.692  -3.286  -0.255
  845   HD22  LEU 107          1HD2      LEU 107 -43.006  -3.734  -1.942
  846   HD23  LEU 107          2HD2      LEU 107 -44.217  -2.798  -1.004
  847    H    CYS 108           H        CYS 108 -42.738  -5.695  -3.868
  848    HA   CYS 108           HA       CYS 108 -42.220  -8.548  -3.202
  849    HB2  CYS 108           2HB      CYS 108 -41.956  -7.192  -5.902
  850    HB3  CYS 108           3HB      CYS 108 -40.999  -8.623  -5.480
  851    HG   CYS 108           HG       CYS 108 -43.000  -9.457  -6.923
  852    H    LEU 109           H        LEU 109 -39.704  -8.929  -3.694
  853    HA   LEU 109           HA       LEU 109 -38.333  -7.044  -1.918
  854    HB2  LEU 109           2HB      LEU 109 -37.561  -9.698  -3.180
  855    HB3  LEU 109           3HB      LEU 109 -36.449  -8.745  -2.221
  856    HG   LEU 109           HG       LEU 109 -37.370 -10.552  -0.941
  857   HD11  LEU 109          1HD1      LEU 109 -36.735  -8.446   0.207
  858   HD12  LEU 109          2HD1      LEU 109 -38.430  -7.910   0.137
  859   HD13  LEU 109          3HD1      LEU 109 -37.988  -9.356   1.065
  860   HD21  LEU 109          3HD2      LEU 109 -39.639 -10.694  -1.984
  861   HD22  LEU 109          1HD2      LEU 109 -39.643 -10.734  -0.211
  862   HD23  LEU 109          2HD2      LEU 109 -40.114  -9.253  -1.048
  863    H    VAL 110           H        VAL 110 -38.841  -5.410  -3.685
  864    HA   VAL 110           HA       VAL 110 -37.467  -5.335  -6.134
  865    HB   VAL 110           HB       VAL 110 -38.539  -3.007  -4.543
  866   HG11  VAL 110          1HG1      VAL 110 -37.111  -2.243  -6.425
  867   HG12  VAL 110          2HG1      VAL 110 -37.964  -3.359  -7.509
  868   HG13  VAL 110          3HG1      VAL 110 -38.807  -1.960  -6.822
  869   HG21  VAL 110          3HG2      VAL 110 -40.554  -3.248  -5.997
  870   HG22  VAL 110          1HG2      VAL 110 -39.862  -4.721  -6.699
  871   HG23  VAL 110          2HG2      VAL 110 -40.328  -4.664  -4.986
  872    H    ASP 111           H        ASP 111 -35.611  -4.259  -6.910
  873    HA   ASP 111           HA       ASP 111 -33.513  -4.125  -4.789
  874    HB2  ASP 111           2HB      ASP 111 -33.514  -5.892  -6.604
  875    HB3  ASP 111           3HB      ASP 111 -33.095  -4.607  -7.739
  876    H    VAL 112           H        VAL 112 -34.308  -1.881  -4.360
  877    HA   VAL 112           HA       VAL 112 -33.913   0.122  -6.435
  878    HB   VAL 112           HB       VAL 112 -34.660   0.512  -3.512
  879   HG11  VAL 112          1HG1      VAL 112 -35.316   2.217  -5.954
  880   HG12  VAL 112          2HG1      VAL 112 -35.774   2.542  -4.278
  881   HG13  VAL 112          3HG1      VAL 112 -34.077   2.639  -4.753
  882   HG21  VAL 112          3HG2      VAL 112 -36.217  -1.072  -4.522
  883   HG22  VAL 112          1HG2      VAL 112 -36.998   0.504  -4.400
  884   HG23  VAL 112          2HG2      VAL 112 -36.357  -0.061  -5.969
  885    H    VAL 113           H        VAL 113 -31.616  -0.536  -6.642
  886    HA   VAL 113           HA       VAL 113 -29.862   0.959  -4.732
  887    HB   VAL 113           HB       VAL 113 -29.084  -1.335  -6.593
  888   HG11  VAL 113          1HG1      VAL 113 -27.169   0.150  -6.099
  889   HG12  VAL 113          2HG1      VAL 113 -27.532   0.059  -4.360
  890   HG13  VAL 113          3HG1      VAL 113 -26.997  -1.383  -5.249
  891   HG21  VAL 113          3HG2      VAL 113 -29.497  -1.312  -3.589
  892   HG22  VAL 113          1HG2      VAL 113 -30.526  -2.153  -4.781
  893   HG23  VAL 113          2HG2      VAL 113 -28.856  -2.672  -4.538
  894    HA   PRO 114           HA       PRO 114 -29.200   3.444  -8.475
  895    HB2  PRO 114           2HB      PRO 114 -27.708   5.460  -7.521
  896    HB3  PRO 114           3HB      PRO 114 -29.364   5.252  -6.962
  897    HG2  PRO 114           2HG      PRO 114 -26.843   4.278  -5.604
  898    HG3  PRO 114           3HG      PRO 114 -28.197   5.223  -4.892
  899    HD2  PRO 114           2HD      PRO 114 -28.048   2.492  -4.676
  900    HD3  PRO 114           3HD      PRO 114 -29.616   3.338  -4.856
  901    H    VAL 115           H        VAL 115 -26.934   4.774  -9.334
  902    HA   VAL 115           HA       VAL 115 -24.695   2.808  -9.233
  903    HB   VAL 115           HB       VAL 115 -24.099   3.430 -11.539
  904   HG11  VAL 115          1HG1      VAL 115 -25.133   1.282 -10.982
  905   HG12  VAL 115          2HG1      VAL 115 -26.749   1.986 -11.178
  906   HG13  VAL 115          3HG1      VAL 115 -25.658   1.851 -12.574
  907   HG21  VAL 115          3HG2      VAL 115 -25.459   5.452 -11.779
  908   HG22  VAL 115          1HG2      VAL 115 -25.752   4.285 -13.074
  909   HG23  VAL 115          2HG2      VAL 115 -26.938   4.468 -11.757
  910    H    LYS 116           H        LYS 116 -22.859   3.458  -8.684
  911    HA   LYS 116           HA       LYS 116 -22.197   6.343  -8.434
  912    HB2  LYS 116           2HB      LYS 116 -20.953   5.755  -6.353
  913    HB3  LYS 116           3HB      LYS 116 -22.703   5.688  -6.197
  914    HG2  LYS 116           2HG      LYS 116 -21.116   3.163  -6.719
  915    HG3  LYS 116           3HG      LYS 116 -21.151   3.921  -5.122
  916    HD2  LYS 116           2HD      LYS 116 -23.612   3.746  -5.021
  917    HD3  LYS 116           3HD      LYS 116 -23.639   3.017  -6.625
  918    HE2  LYS 116           2HE      LYS 116 -23.821   1.197  -5.165
  919    HE3  LYS 116           3HE      LYS 116 -22.149   1.163  -5.737
  920    HZ1  LYS 116           HZ1      LYS 116 -21.531   2.268  -3.607
  921    HZ2  LYS 116           HZ2      LYS 116 -23.098   2.209  -3.112
  922    HZ3  LYS 116           HZ3      LYS 116 -22.259   0.830  -3.343
  923    H    ASN 117           H        ASN 117 -19.972   6.818  -8.217
  924    HA   ASN 117           HA       ASN 117 -18.385   5.278 -10.219
  925    HB2  ASN 117           2HB      ASN 117 -17.178   7.212 -10.637
  926    HB3  ASN 117           3HB      ASN 117 -18.803   7.811 -10.392
  927   HD21  ASN 117          2HD2      ASN 117 -19.249   8.848  -8.159
  928   HD22  ASN 117          1HD2      ASN 117 -17.847   9.591  -7.405
  929    H    GLU 118           H        GLU 118 -15.845   5.536  -9.668
  930    HA   GLU 118           HA       GLU 118 -15.324   3.624  -7.648
  931    HB2  GLU 118           2HB      GLU 118 -12.984   3.989  -8.131
  932    HB3  GLU 118           3HB      GLU 118 -13.928   3.942  -9.619
  933    HG2  GLU 118           2HG      GLU 118 -13.860   6.440  -9.728
  934    HG3  GLU 118           3HG      GLU 118 -12.892   6.471  -8.254
  935    H    ASP 119           H        ASP 119 -15.521   7.106  -7.267
  936    HA   ASP 119           HA       ASP 119 -14.232   7.205  -4.672
  937    HB2  ASP 119           2HB      ASP 119 -14.601   9.109  -6.351
  938    HB3  ASP 119           3HB      ASP 119 -16.270   9.159  -5.780
  939    H    GLY 120           H        GLY 120 -17.374   6.080  -5.668
  940    HA2  GLY 120           HA2      GLY 120 -18.888   4.961  -4.270
  941    HA3  GLY 120           HA3      GLY 120 -18.296   5.838  -2.858
  942    H    ALA 121           H        ALA 121 -18.642   8.216  -5.116
  943    HA   ALA 121           HA       ALA 121 -21.245   9.081  -4.100
  944    HB1  ALA 121           3HB      ALA 121 -19.382  10.407  -6.103
  945    HB2  ALA 121           1HB      ALA 121 -20.793  11.140  -5.323
  946    HB3  ALA 121           2HB      ALA 121 -19.385  10.675  -4.347
  947    H    VAL 122           H        VAL 122 -23.106   8.863  -4.950
  948    HA   VAL 122           HA       VAL 122 -23.710   7.357  -7.302
  949    HB   VAL 122           HB       VAL 122 -25.066   7.204  -5.383
  950   HG11  VAL 122          1HG1      VAL 122 -26.005  10.076  -5.712
  951   HG12  VAL 122          2HG1      VAL 122 -26.562   8.883  -4.532
  952   HG13  VAL 122          3HG1      VAL 122 -24.911   9.500  -4.433
  953   HG21  VAL 122          3HG2      VAL 122 -26.710   8.527  -7.560
  954   HG22  VAL 122          1HG2      VAL 122 -26.081   6.876  -7.614
  955   HG23  VAL 122          2HG2      VAL 122 -27.250   7.338  -6.362
  956    H    ILE 123           H        ILE 123 -23.009   8.134  -9.155
  957    HA   ILE 123           HA       ILE 123 -23.519  10.929  -9.879
  958    HB   ILE 123           HB       ILE 123 -22.140  10.783 -11.646
  959   HG12  ILE 123          2HG1      ILE 123 -22.855   8.917 -12.915
  960   HG13  ILE 123          3HG1      ILE 123 -21.126   8.850 -12.683
  961   HG21  ILE 123          1HG2      ILE 123 -20.037  10.005 -10.796
  962   HG22  ILE 123          2HG2      ILE 123 -21.005  10.645  -9.455
  963   HG23  ILE 123          3HG2      ILE 123 -20.846   8.891  -9.675
  964   HD11  ILE 123          3HD1      ILE 123 -23.215   7.081 -11.386
  965   HD12  ILE 123          1HD1      ILE 123 -21.978   6.624 -12.547
  966   HD13  ILE 123          2HD1      ILE 123 -21.494   7.075 -10.903
  967    H    MET 124           H        MET 124 -24.914   7.761 -10.565
  968    HA   MET 124           HA       MET 124 -27.115   9.224 -11.901
  969    HB2  MET 124           2HB      MET 124 -25.552   7.038 -13.237
  970    HB3  MET 124           3HB      MET 124 -27.304   7.023 -13.398
  971    HG2  MET 124           2HG      MET 124 -27.018   8.369 -15.124
  972    HG3  MET 124           3HG      MET 124 -26.799   9.651 -13.950
  973    HE1  MET 124           3HE      MET 124 -23.786  11.159 -15.447
  974    HE2  MET 124           1HE      MET 124 -25.561  11.163 -15.619
  975    HE3  MET 124           2HE      MET 124 -24.819  11.180 -14.004
  976    H    PHE 125           H        PHE 125 -29.026   8.367 -11.897
  977    HA   PHE 125           HA       PHE 125 -29.633   6.543  -9.588
  978    HB2  PHE 125           2HB      PHE 125 -30.918   9.025 -10.744
  979    HB3  PHE 125           3HB      PHE 125 -31.949   7.827 -10.001
  980    HD1  PHE 125           HD2      PHE 125 -29.170   7.575  -7.883
  981    HD2  PHE 125           HD1      PHE 125 -32.279  10.327  -9.044
  982    HE1  PHE 125           HE2      PHE 125 -28.930   8.760  -5.733
  983    HE2  PHE 125           HE1      PHE 125 -31.993  11.537  -6.880
  984    HZ   PHE 125           HZ       PHE 125 -30.292  10.765  -5.247
  985    H    ILE 126           H        ILE 126 -29.113   4.781 -10.946
  986    HA   ILE 126           HA       ILE 126 -31.373   4.022 -12.747
  987    HB   ILE 126           HB       ILE 126 -28.716   2.610 -12.400
  988   HG12  ILE 126          2HG1      ILE 126 -29.737   4.484 -14.574
  989   HG13  ILE 126          3HG1      ILE 126 -28.422   4.815 -13.467
  990   HG21  ILE 126          1HG2      ILE 126 -29.448   1.207 -14.251
  991   HG22  ILE 126          2HG2      ILE 126 -30.756   1.179 -13.076
  992   HG23  ILE 126          3HG2      ILE 126 -30.912   2.182 -14.491
  993   HD11  ILE 126          3HD1      ILE 126 -27.461   4.211 -15.540
  994   HD12  ILE 126          1HD1      ILE 126 -27.175   2.868 -14.396
  995   HD13  ILE 126          2HD1      ILE 126 -28.431   2.724 -15.647
  996    H    LEU 127           H        LEU 127 -32.620   4.152 -10.708
  997    HA   LEU 127           HA       LEU 127 -32.222   1.943  -8.830
  998    HB2  LEU 127           2HB      LEU 127 -34.622   3.783  -9.096
  999    HB3  LEU 127           3HB      LEU 127 -34.247   2.670  -7.800
 1000    HG   LEU 127           HG       LEU 127 -33.414   4.526  -6.794
 1001   HD11  LEU 127          1HD1      LEU 127 -31.326   4.784  -6.586
 1002   HD12  LEU 127          2HD1      LEU 127 -31.492   3.116  -7.111
 1003   HD13  LEU 127          3HD1      LEU 127 -30.989   4.372  -8.303
 1004   HD21  LEU 127          3HD2      LEU 127 -32.726   5.751  -9.444
 1005   HD22  LEU 127          1HD2      LEU 127 -34.179   6.096  -8.484
 1006   HD23  LEU 127          2HD2      LEU 127 -32.583   6.530  -7.848
 1007    H    ASN 128           H        ASN 128 -32.068   0.253 -10.115
 1008    HA   ASN 128           HA       ASN 128 -33.930  -0.789 -11.975
 1009    HB2  ASN 128           2HB      ASN 128 -32.115  -2.287 -10.025
 1010    HB3  ASN 128           3HB      ASN 128 -32.924  -3.006 -11.412
 1011   HD21  ASN 128          2HD2      ASN 128 -30.184  -1.044 -10.394
 1012   HD22  ASN 128          1HD2      ASN 128 -29.481  -0.949 -11.995
 1013    H    PHE 129           H        PHE 129 -36.150  -0.582 -11.373
 1014    HA   PHE 129           HA       PHE 129 -36.989  -1.506  -8.760
 1015    HB2  PHE 129           2HB      PHE 129 -38.574  -0.413 -11.095
 1016    HB3  PHE 129           3HB      PHE 129 -39.211  -0.838  -9.501
 1017    HD1  PHE 129           HD2      PHE 129 -38.000   0.293  -7.447
 1018    HD2  PHE 129           HD1      PHE 129 -38.104   1.891 -11.439
 1019    HE1  PHE 129           HE2      PHE 129 -37.660   2.581  -6.532
 1020    HE2  PHE 129           HE1      PHE 129 -37.757   4.178 -10.527
 1021    HZ   PHE 129           HZ       PHE 129 -37.531   4.527  -8.080
 1022    H    GLU 130           H        GLU 130 -35.869  -3.643  -9.649
 1023    HA   GLU 130           HA       GLU 130 -37.712  -5.342 -11.162
 1024    HB2  GLU 130           2HB      GLU 130 -36.054  -7.119 -10.689
 1025    HB3  GLU 130           3HB      GLU 130 -35.501  -5.710 -11.630
 1026    HG2  GLU 130           2HG      GLU 130 -34.248  -4.833  -9.903
 1027    HG3  GLU 130           3HG      GLU 130 -35.084  -5.737  -8.657
 1028    H    VAL 131           H        VAL 131 -39.400  -5.802 -10.313
 1029    HA   VAL 131           HA       VAL 131 -40.164  -6.718  -7.690
 1030    HB   VAL 131           HB       VAL 131 -41.293  -7.042 -10.483
 1031   HG11  VAL 131          1HG1      VAL 131 -42.819  -7.752  -7.967
 1032   HG12  VAL 131          2HG1      VAL 131 -43.373  -7.839  -9.645
 1033   HG13  VAL 131          3HG1      VAL 131 -42.137  -8.962  -9.089
 1034   HG21  VAL 131          3HG2      VAL 131 -41.333  -4.762  -9.488
 1035   HG22  VAL 131          1HG2      VAL 131 -42.966  -5.413  -9.686
 1036   HG23  VAL 131          2HG2      VAL 131 -42.209  -5.391  -8.081
 1037    H    VAL 132           H        VAL 132 -39.330  -8.485  -6.681
 1038    HA   VAL 132           HA       VAL 132 -39.239 -11.007  -8.213
 1039    HB   VAL 132           HB       VAL 132 -37.015 -10.175  -8.552
 1040   HG11  VAL 132          1HG1      VAL 132 -36.715  -8.714  -6.613
 1041   HG12  VAL 132          2HG1      VAL 132 -36.664 -10.126  -5.533
 1042   HG13  VAL 132          3HG1      VAL 132 -35.392  -9.874  -6.747
 1043   HG21  VAL 132          3HG2      VAL 132 -35.736 -12.080  -7.818
 1044   HG22  VAL 132          1HG2      VAL 132 -36.926 -12.470  -6.564
 1045   HG23  VAL 132          2HG2      VAL 132 -37.357 -12.612  -8.286
 1046    H    MET 133           H        MET 133 -39.712 -12.793  -7.097
 1047    HA   MET 133           HA       MET 133 -40.853 -12.439  -4.409
 1048    HB2  MET 133           2HB      MET 133 -42.109 -14.430  -4.912
 1049    HB3  MET 133           3HB      MET 133 -42.237 -13.309  -6.262
 1050    HG2  MET 133           2HG      MET 133 -40.492 -14.602  -7.488
 1051    HG3  MET 133           3HG      MET 133 -40.405 -15.748  -6.152
 1052    HE1  MET 133           3HE      MET 133 -43.358 -16.390  -5.272
 1053    HE2  MET 133           1HE      MET 133 -43.695 -17.746  -6.366
 1054    HE3  MET 133           2HE      MET 133 -42.090 -17.584  -5.625
 1055    H    GLU 134           H        GLU 134 -40.844 -14.601  -3.169
 1056    HA   GLU 134           HA       GLU 134 -38.075 -15.688  -2.891
 1057    HB2  GLU 134           2HB      GLU 134 -39.996 -15.300  -0.582
 1058    HB3  GLU 134           3HB      GLU 134 -38.280 -15.728  -0.541
 1059    HG2  GLU 134           2HG      GLU 134 -37.910 -13.423  -1.715
 1060    HG3  GLU 134           3HG      GLU 134 -39.555 -13.056  -1.199
 1061    H    LYS 135           H        LYS 135 -37.854 -17.833  -2.128
 1062    HA   LYS 135           HA       LYS 135 -39.812 -19.625  -3.314
 1063    HB2  LYS 135           2HB      LYS 135 -38.142 -21.316  -3.124
 1064    HB3  LYS 135           3HB      LYS 135 -37.396 -19.845  -3.733
 1065    HG2  LYS 135           2HG      LYS 135 -36.541 -19.372  -1.401
 1066    HG3  LYS 135           3HG      LYS 135 -37.221 -20.929  -0.884
 1067    HD2  LYS 135           2HD      LYS 135 -35.756 -22.112  -2.505
 1068    HD3  LYS 135           3HD      LYS 135 -35.129 -20.559  -3.065
 1069    HE2  LYS 135           2HE      LYS 135 -33.507 -21.478  -1.567
 1070    HE3  LYS 135           3HE      LYS 135 -34.248 -20.081  -0.785
 1071    HZ1  LYS 135           HZ1      LYS 135 -34.943 -22.919  -0.226
 1072    HZ2  LYS 135           HZ2      LYS 135 -34.037 -21.967   0.737
 1073    HZ3  LYS 135           HZ3      LYS 135 -35.610 -21.632   0.534
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1 -31.077 -58.411   2.927
    2    H2   MET   1           2H       MET   1 -32.215 -58.744   4.053
    3    H3   MET   1           3H       MET   1 -31.444 -57.295   4.061
    4    HA   MET   1           HA       MET   1 -33.256 -58.243   1.938
    5    HB2  MET   1           2HB      MET   1 -33.688 -56.137   4.105
    6    HB3  MET   1           3HB      MET   1 -34.698 -56.289   2.666
    7    HG2  MET   1           2HG      MET   1 -35.267 -58.617   3.295
    8    HG3  MET   1           3HG      MET   1 -34.321 -58.441   4.779
    9    HE1  MET   1           3HE      MET   1 -38.015 -58.536   6.083
   10    HE2  MET   1           1HE      MET   1 -37.345 -59.429   4.699
   11    HE3  MET   1           2HE      MET   1 -36.395 -59.260   6.195
   12    HA   PRO   2           HA       PRO   2 -31.191 -55.261  -0.620
   13    HB2  PRO   2           2HB      PRO   2 -33.069 -54.729  -2.530
   14    HB3  PRO   2           3HB      PRO   2 -32.238 -56.309  -2.396
   15    HG2  PRO   2           2HG      PRO   2 -34.958 -55.542  -1.280
   16    HG3  PRO   2           3HG      PRO   2 -34.538 -56.975  -2.273
   17    HD2  PRO   2           2HD      PRO   2 -34.686 -57.115   0.431
   18    HD3  PRO   2           3HD      PRO   2 -33.427 -58.016  -0.467
   19    H    VAL   3           H        VAL   3 -31.180 -53.039  -1.244
   20    HA   VAL   3           HA       VAL   3 -33.126 -51.199   0.053
   21    HB   VAL   3           HB       VAL   3 -31.285 -49.752   0.830
   22   HG11  VAL   3          1HG1      VAL   3 -32.428 -51.307   2.382
   23   HG12  VAL   3          2HG1      VAL   3 -31.171 -52.525   2.074
   24   HG13  VAL   3          3HG1      VAL   3 -30.749 -50.984   2.845
   25   HG21  VAL   3          3HG2      VAL   3 -29.430 -50.574  -0.600
   26   HG22  VAL   3          1HG2      VAL   3 -29.016 -50.605   1.118
   27   HG23  VAL   3          2HG2      VAL   3 -29.435 -52.115   0.287
   28    H    ARG   4           H        ARG   4 -33.096 -49.038  -0.750
   29    HA   ARG   4           HA       ARG   4 -31.770 -48.489  -3.335
   30    HB2  ARG   4           2HB      ARG   4 -33.814 -47.891  -4.469
   31    HB3  ARG   4           3HB      ARG   4 -33.739 -49.605  -4.096
   32    HG2  ARG   4           2HG      ARG   4 -35.388 -49.491  -2.435
   33    HG3  ARG   4           3HG      ARG   4 -35.203 -47.750  -2.184
   34    HD2  ARG   4           2HD      ARG   4 -36.240 -48.959  -4.773
   35    HD3  ARG   4           3HD      ARG   4 -37.248 -48.449  -3.409
   36    HE   ARG   4           HE       ARG   4 -35.628 -46.242  -3.952
   37   HH11  ARG   4          1HH1      ARG   4 -38.098 -47.923  -5.790
   38   HH12  ARG   4          2HH1      ARG   4 -38.482 -46.493  -6.712
   39   HH21  ARG   4          1HH2      ARG   4 -36.111 -44.551  -5.100
   40   HH22  ARG   4          2HH2      ARG   4 -37.368 -44.585  -6.326
   41    H    ARG   5           H        ARG   5 -32.084 -46.291  -4.090
   42    HA   ARG   5           HA       ARG   5 -31.946 -44.249  -2.007
   43    HB2  ARG   5           2HB      ARG   5 -30.712 -44.335  -4.302
   44    HB3  ARG   5           3HB      ARG   5 -32.240 -43.815  -4.999
   45    HG2  ARG   5           2HG      ARG   5 -31.947 -41.887  -3.063
   46    HG3  ARG   5           3HG      ARG   5 -30.260 -42.341  -3.270
   47    HD2  ARG   5           2HD      ARG   5 -30.712 -40.498  -4.745
   48    HD3  ARG   5           3HD      ARG   5 -30.548 -41.947  -5.757
   49    HE   ARG   5           HE       ARG   5 -33.301 -41.357  -4.898
   50   HH11  ARG   5          1HH2      ARG   5 -31.033 -40.604  -7.469
   51   HH12  ARG   5          2HH2      ARG   5 -32.319 -40.266  -8.595
   52   HH21  ARG   5          1HH1      ARG   5 -34.811 -40.987  -6.305
   53   HH22  ARG   5          2HH1      ARG   5 -34.455 -40.481  -7.948
   54    H    GLY   6           H        GLY   6 -33.446 -42.621  -1.558
   55    HA2  GLY   6           HA2      GLY   6 -36.276 -43.138  -1.976
   56    HA3  GLY   6           HA3      GLY   6 -35.554 -41.745  -1.179
   57    H    HIS   7           H        HIS   7 -37.543 -40.882  -2.392
   58    HA   HIS   7           HA       HIS   7 -37.244 -40.286  -5.235
   59    HB2  HIS   7           2HB      HIS   7 -39.453 -40.514  -4.193
   60    HB3  HIS   7           3HB      HIS   7 -39.120 -39.135  -3.142
   61    HD2  HIS   7           HD2      HIS   7 -39.500 -36.711  -4.146
   62    HE1  HIS   7           HE1      HIS   7 -40.477 -37.816  -8.148
   63    HE2  HIS   7           HE2      HIS   7 -40.385 -35.888  -6.488
   64    H    VAL   8           H        VAL   8 -36.633 -38.412  -6.209
   65    HA   VAL   8           HA       VAL   8 -35.667 -36.111  -4.596
   66    HB   VAL   8           HB       VAL   8 -34.131 -37.284  -6.952
   67   HG11  VAL   8          1HG1      VAL   8 -32.417 -35.582  -6.348
   68   HG12  VAL   8          2HG1      VAL   8 -33.919 -34.831  -6.872
   69   HG13  VAL   8          3HG1      VAL   8 -33.525 -34.898  -5.140
   70   HG21  VAL   8          3HG2      VAL   8 -32.329 -37.708  -5.308
   71   HG22  VAL   8          1HG2      VAL   8 -33.391 -37.158  -3.991
   72   HG23  VAL   8          2HG2      VAL   8 -33.776 -38.631  -4.900
   73    H    ALA   9           H        ALA   9 -36.334 -34.168  -5.402
   74    HA   ALA   9           HA       ALA   9 -38.399 -34.076  -7.388
   75    HB1  ALA   9           3HB      ALA   9 -38.238 -31.615  -6.962
   76    HB2  ALA   9           1HB      ALA   9 -38.248 -32.547  -5.457
   77    HB3  ALA   9           2HB      ALA   9 -36.724 -31.877  -6.083
   78    HA   PRO  10           HA       PRO  10 -36.145 -33.546 -11.148
   79    HB2  PRO  10           2HB      PRO  10 -37.544 -31.665 -12.599
   80    HB3  PRO  10           3HB      PRO  10 -38.036 -33.358 -12.341
   81    HG2  PRO  10           2HG      PRO  10 -38.927 -30.900 -10.788
   82    HG3  PRO  10           3HG      PRO  10 -39.947 -32.218 -11.448
   83    HD2  PRO  10           2HD      PRO  10 -39.203 -32.169  -8.851
   84    HD3  PRO  10           3HD      PRO  10 -39.250 -33.714  -9.749
   85    H    GLN  11           H        GLN  11 -34.207 -32.835 -10.735
   86    HA   GLN  11           HA       GLN  11 -33.548 -30.364  -9.568
   87    HB2  GLN  11           2HB      GLN  11 -31.293 -31.011  -9.734
   88    HB3  GLN  11           3HB      GLN  11 -32.231 -32.457  -9.407
   89    HG2  GLN  11           2HG      GLN  11 -31.012 -31.631 -12.083
   90    HG3  GLN  11           3HG      GLN  11 -30.421 -32.884 -11.003
   91   HE21  GLN  11          2HE2      GLN  11 -31.608 -32.810 -13.920
   92   HE22  GLN  11          1HE2      GLN  11 -32.690 -34.203 -13.858
   93    H    ASN  12           H        ASN  12 -33.930 -31.106 -12.972
   94    HA   ASN  12           HA       ASN  12 -32.301 -28.937 -13.998
   95    HB2  ASN  12           2HB      ASN  12 -34.451 -30.753 -15.189
   96    HB3  ASN  12           3HB      ASN  12 -33.756 -29.413 -16.094
   97   HD21  ASN  12          2HD2      ASN  12 -33.255 -31.406 -17.496
   98   HD22  ASN  12          1HD2      ASN  12 -31.673 -32.116 -17.207
   99    H    THR  13           H        THR  13 -35.846 -29.292 -13.542
  100    HA   THR  13           HA       THR  13 -36.394 -26.524 -14.260
  101    HB   THR  13           HB       THR  13 -37.886 -28.582 -14.498
  102    HG1  THR  13           HG1      THR  13 -39.702 -27.260 -14.331
  103   HG21  THR  13          1HG2      THR  13 -38.746 -27.837 -11.684
  104   HG22  THR  13          2HG2      THR  13 -39.429 -29.104 -12.739
  105   HG23  THR  13          3HG2      THR  13 -37.776 -29.253 -12.106
  106    H    PHE  14           H        PHE  14 -36.008 -28.306 -11.187
  107    HA   PHE  14           HA       PHE  14 -36.657 -26.222  -9.374
  108    HB2  PHE  14           2HB      PHE  14 -36.232 -28.581  -8.814
  109    HB3  PHE  14           3HB      PHE  14 -34.544 -28.401  -9.247
  110    HD1  PHE  14           HD1      PHE  14 -37.147 -27.389  -6.779
  111    HD2  PHE  14           HD2      PHE  14 -32.938 -27.390  -7.734
  112    HE1  PHE  14           HE1      PHE  14 -36.618 -26.653  -4.464
  113    HE2  PHE  14           HE2      PHE  14 -32.415 -26.652  -5.419
  114    HZ   PHE  14           HZ       PHE  14 -34.253 -26.281  -3.783
  115    H    LEU  15           H        LEU  15 -33.609 -26.974 -11.080
  116    HA   LEU  15           HA       LEU  15 -32.212 -24.634 -10.057
  117    HB2  LEU  15           2HB      LEU  15 -30.915 -26.525 -10.779
  118    HB3  LEU  15           3HB      LEU  15 -31.627 -26.472 -12.397
  119    HG   LEU  15           HG       LEU  15 -30.558 -24.342 -12.872
  120   HD11  LEU  15          1HD1      LEU  15 -28.850 -23.362 -11.360
  121   HD12  LEU  15          2HD1      LEU  15 -30.445 -23.298 -10.644
  122   HD13  LEU  15          3HD1      LEU  15 -29.307 -24.534 -10.091
  123   HD21  LEU  15          3HD2      LEU  15 -28.227 -25.099 -12.941
  124   HD22  LEU  15          1HD2      LEU  15 -28.581 -26.355 -11.732
  125   HD23  LEU  15          2HD2      LEU  15 -29.332 -26.423 -13.344
  126    H    ASP  16           H        ASP  16 -33.878 -25.240 -13.212
  127    HA   ASP  16           HA       ASP  16 -33.547 -22.819 -14.485
  128    HB2  ASP  16           2HB      ASP  16 -34.865 -24.904 -15.174
  129    HB3  ASP  16           3HB      ASP  16 -36.237 -24.215 -14.307
  130    H    THR  17           H        THR  17 -35.782 -23.455 -11.799
  131    HA   THR  17           HA       THR  17 -37.026 -20.841 -11.715
  132    HB   THR  17           HB       THR  17 -36.589 -22.814  -9.431
  133    HG1  THR  17           HG1      THR  17 -37.771 -23.708 -11.136
  134   HG21  THR  17          1HG2      THR  17 -38.618 -21.745  -8.462
  135   HG22  THR  17          2HG2      THR  17 -37.248 -20.631  -8.545
  136   HG23  THR  17          3HG2      THR  17 -38.560 -20.510  -9.740
  137    H    ILE  18           H        ILE  18 -34.053 -22.103 -10.236
  138    HA   ILE  18           HA       ILE  18 -33.488 -19.699  -8.697
  139    HB   ILE  18           HB       ILE  18 -31.598 -21.884  -9.581
  140   HG12  ILE  18          2HG1      ILE  18 -33.365 -22.941  -8.319
  141   HG13  ILE  18          3HG1      ILE  18 -31.834 -23.005  -7.490
  142   HG21  ILE  18          1HG2      ILE  18 -31.342 -19.790  -7.398
  143   HG22  ILE  18          2HG2      ILE  18 -30.273 -21.204  -7.545
  144   HG23  ILE  18          3HG2      ILE  18 -30.325 -20.009  -8.833
  145   HD11  ILE  18          3HD1      ILE  18 -33.744 -22.543  -5.960
  146   HD12  ILE  18          1HD1      ILE  18 -32.611 -21.181  -5.957
  147   HD13  ILE  18          2HD1      ILE  18 -34.136 -21.074  -6.873
  148    H    ILE  19           H        ILE  19 -32.656 -20.923 -11.951
  149    HA   ILE  19           HA       ILE  19 -30.820 -18.890 -12.634
  150    HB   ILE  19           HB       ILE  19 -32.872 -20.152 -14.493
  151   HG12  ILE  19          2HG1      ILE  19 -31.645 -22.011 -13.689
  152   HG13  ILE  19          3HG1      ILE  19 -30.989 -21.633 -15.258
  153   HG21  ILE  19          1HG2      ILE  19 -31.220 -19.551 -16.266
  154   HG22  ILE  19          2HG2      ILE  19 -31.907 -18.144 -15.455
  155   HG23  ILE  19          3HG2      ILE  19 -30.269 -18.682 -15.042
  156   HD11  ILE  19          3HD1      ILE  19 -29.205 -22.202 -13.750
  157   HD12  ILE  19          1HD1      ILE  19 -29.074 -20.453 -14.095
  158   HD13  ILE  19          2HD1      ILE  19 -29.751 -21.026 -12.547
  159    H    ARG  20           H        ARG  20 -34.412 -18.998 -13.126
  160    HA   ARG  20           HA       ARG  20 -34.734 -16.267 -13.914
  161    HB2  ARG  20           2HB      ARG  20 -36.473 -18.522 -12.846
  162    HB3  ARG  20           3HB      ARG  20 -37.096 -16.884 -12.764
  163    HG2  ARG  20           2HG      ARG  20 -37.892 -17.487 -14.770
  164    HG3  ARG  20           3HG      ARG  20 -36.427 -16.652 -15.266
  165    HD2  ARG  20           2HD      ARG  20 -36.398 -19.664 -14.876
  166    HD3  ARG  20           3HD      ARG  20 -37.191 -18.979 -16.296
  167    HE   ARG  20           HE       ARG  20 -34.635 -17.745 -16.043
  168   HH11  ARG  20          2HH1      ARG  20 -35.824 -20.906 -17.008
  169   HH12  ARG  20          1HH1      ARG  20 -34.753 -20.949 -18.376
  170   HH21  ARG  20          1HH2      ARG  20 -33.440 -17.829 -17.729
  171   HH22  ARG  20          2HH2      ARG  20 -33.344 -19.255 -18.765
  172    H    LYS  21           H        LYS  21 -34.341 -17.639 -10.717
  173    HA   LYS  21           HA       LYS  21 -35.110 -15.278  -9.239
  174    HB2  LYS  21           2HB      LYS  21 -34.479 -17.811  -8.478
  175    HB3  LYS  21           3HB      LYS  21 -32.951 -17.017  -8.109
  176    HG2  LYS  21           2HG      LYS  21 -34.055 -16.726  -6.110
  177    HG3  LYS  21           3HG      LYS  21 -34.549 -15.229  -6.914
  178    HD2  LYS  21           2HD      LYS  21 -36.657 -16.471  -7.685
  179    HD3  LYS  21           3HD      LYS  21 -36.108 -17.850  -6.711
  180    HE2  LYS  21           2HE      LYS  21 -36.006 -16.148  -4.738
  181    HE3  LYS  21           3HE      LYS  21 -36.969 -15.090  -5.776
  182    HZ1  LYS  21           HZ1      LYS  21 -38.570 -17.053  -5.928
  183    HZ2  LYS  21           HZ2      LYS  21 -37.711 -17.757  -4.699
  184    HZ3  LYS  21           HZ3      LYS  21 -38.465 -16.363  -4.438
  185    H    PHE  22           H        PHE  22 -31.855 -16.320 -10.422
  186    HA   PHE  22           HA       PHE  22 -30.849 -13.594  -9.709
  187    HB2  PHE  22           2HB      PHE  22 -28.677 -14.450  -9.637
  188    HB3  PHE  22           3HB      PHE  22 -29.706 -15.544  -8.748
  189    HD1  PHE  22           HD2      PHE  22 -27.879 -15.110 -12.018
  190    HD2  PHE  22           HD1      PHE  22 -29.679 -17.868  -9.243
  191    HE1  PHE  22           HE2      PHE  22 -26.940 -17.003 -13.299
  192    HE2  PHE  22           HE1      PHE  22 -28.710 -19.771 -10.521
  193    HZ   PHE  22           HZ       PHE  22 -27.350 -19.341 -12.554
  194    H    GLU  23           H        GLU  23 -32.006 -14.945 -12.488
  195    HA   GLU  23           HA       GLU  23 -30.299 -14.810 -14.483
  196    HB2  GLU  23           2HB      GLU  23 -32.648 -15.494 -14.638
  197    HB3  GLU  23           3HB      GLU  23 -33.183 -13.829 -14.515
  198    HG2  GLU  23           2HG      GLU  23 -32.276 -13.315 -16.698
  199    HG3  GLU  23           3HG      GLU  23 -31.475 -14.896 -16.794
  200    H    GLY  24           H        GLY  24 -31.625 -11.821 -13.135
  201    HA2  GLY  24           HA2      GLY  24 -31.186  -9.595 -13.447
  202    HA3  GLY  24           HA3      GLY  24 -29.654 -10.107 -14.144
  203    H    GLN  25           H        GLN  25 -31.862 -11.376 -16.237
  204    HA   GLN  25           HA       GLN  25 -31.557  -9.077 -18.112
  205    HB2  GLN  25           2HB      GLN  25 -31.739 -12.076 -18.517
  206    HB3  GLN  25           3HB      GLN  25 -31.714 -10.913 -19.841
  207    HG2  GLN  25           2HG      GLN  25 -29.503 -10.228 -19.419
  208    HG3  GLN  25           3HG      GLN  25 -29.504 -10.827 -17.765
  209   HE21  GLN  25          1HE2      GLN  25 -29.303 -13.112 -17.354
  210   HE22  GLN  25          2HE2      GLN  25 -28.639 -14.170 -18.606
  211    H    SER  26           H        SER  26 -34.077 -11.187 -16.801
  212    HA   SER  26           HA       SER  26 -36.162  -9.896 -18.467
  213    HB2  SER  26           2HB      SER  26 -36.395 -12.014 -16.301
  214    HB3  SER  26           3HB      SER  26 -37.729 -11.373 -17.278
  215    HG   SER  26           HG       SER  26 -35.668 -13.119 -17.976
  216    H    ARG  27           H        ARG  27 -34.450  -8.491 -16.364
  217    HA   ARG  27           HA       ARG  27 -36.448  -7.542 -14.399
  218    HB2  ARG  27           2HB      ARG  27 -33.451  -7.045 -14.655
  219    HB3  ARG  27           3HB      ARG  27 -34.467  -6.393 -13.384
  220    HG2  ARG  27           2HG      ARG  27 -33.714  -9.305 -13.815
  221    HG3  ARG  27           3HG      ARG  27 -33.361  -8.247 -12.459
  222    HD2  ARG  27           2HD      ARG  27 -36.048  -8.218 -12.304
  223    HD3  ARG  27           3HD      ARG  27 -35.887  -9.727 -13.173
  224    HE   ARG  27           HE       ARG  27 -34.779  -9.042 -10.461
  225   HH11  ARG  27          2HH1      ARG  27 -35.411 -11.684 -12.696
  226   HH12  ARG  27          1HH1      ARG  27 -34.934 -12.881 -11.530
  227   HH21  ARG  27          1HH2      ARG  27 -34.158 -10.486  -9.123
  228   HH22  ARG  27          2HH2      ARG  27 -34.084 -12.189  -9.537
  229    H    LYS  28           H        LYS  28 -36.442  -5.235 -13.861
  230    HA   LYS  28           HA       LYS  28 -36.898  -3.599 -16.336
  231    HB2  LYS  28           2HB      LYS  28 -38.635  -3.768 -13.824
  232    HB3  LYS  28           3HB      LYS  28 -38.912  -2.752 -15.214
  233    HG2  LYS  28           2HG      LYS  28 -40.348  -4.434 -15.697
  234    HG3  LYS  28           3HG      LYS  28 -38.940  -5.010 -16.576
  235    HD2  LYS  28           2HD      LYS  28 -38.488  -6.624 -14.770
  236    HD3  LYS  28           3HD      LYS  28 -39.815  -5.957 -13.798
  237    HE2  LYS  28           2HE      LYS  28 -41.467  -6.765 -15.273
  238    HE3  LYS  28           3HE      LYS  28 -40.346  -6.873 -16.627
  239    HZ1  LYS  28           HZ1      LYS  28 -40.870  -9.074 -15.747
  240    HZ2  LYS  28           HZ2      LYS  28 -39.277  -8.770 -15.551
  241    HZ3  LYS  28           HZ3      LYS  28 -40.300  -8.684 -14.267
  242    H    PHE  29           H        PHE  29 -36.521  -1.341 -16.218
  243    HA   PHE  29           HA       PHE  29 -35.604  -0.051 -13.781
  244    HB2  PHE  29           2HB      PHE  29 -33.244   0.120 -14.358
  245    HB3  PHE  29           3HB      PHE  29 -33.693  -1.553 -14.199
  246    HD1  PHE  29           HD1      PHE  29 -33.805  -3.064 -16.175
  247    HD2  PHE  29           HD2      PHE  29 -32.462   1.028 -16.484
  248    HE1  PHE  29           HE1      PHE  29 -32.747  -3.574 -18.359
  249    HE2  PHE  29           HE2      PHE  29 -31.392   0.503 -18.667
  250    HZ   PHE  29           HZ       PHE  29 -31.522  -1.799 -19.598
  251    H    ILE  30           H        ILE  30 -34.631   1.964 -14.025
  252    HA   ILE  30           HA       ILE  30 -35.177   3.526 -16.487
  253    HB   ILE  30           HB       ILE  30 -35.571   5.477 -14.822
  254   HG12  ILE  30          2HG1      ILE  30 -36.713   4.959 -12.750
  255   HG13  ILE  30          3HG1      ILE  30 -36.411   3.236 -12.937
  256   HG21  ILE  30          1HG2      ILE  30 -37.628   3.306 -15.192
  257   HG22  ILE  30          2HG2      ILE  30 -37.947   5.028 -14.876
  258   HG23  ILE  30          3HG2      ILE  30 -37.152   4.540 -16.389
  259   HD11  ILE  30          3HD1      ILE  30 -34.032   3.540 -12.536
  260   HD12  ILE  30          1HD1      ILE  30 -34.192   5.309 -12.662
  261   HD13  ILE  30          2HD1      ILE  30 -34.915   4.450 -11.294
  262    H    ILE  31           H        ILE  31 -34.019   5.601 -16.502
  263    HA   ILE  31           HA       ILE  31 -31.373   5.541 -15.151
  264    HB   ILE  31           HB       ILE  31 -31.830   6.692 -17.909
  265   HG12  ILE  31          2HG1      ILE  31 -32.376   4.262 -18.079
  266   HG13  ILE  31          3HG1      ILE  31 -30.965   4.760 -19.024
  267   HG21  ILE  31          1HG2      ILE  31 -29.918   7.538 -16.697
  268   HG22  ILE  31          2HG2      ILE  31 -29.365   5.906 -16.310
  269   HG23  ILE  31          3HG2      ILE  31 -29.337   6.483 -17.996
  270   HD11  ILE  31          3HD1      ILE  31 -30.700   2.594 -17.736
  271   HD12  ILE  31          1HD1      ILE  31 -29.429   3.811 -17.492
  272   HD13  ILE  31          2HD1      ILE  31 -30.683   3.597 -16.259
  273    H    ALA  32           H        ALA  32 -31.277   7.156 -13.850
  274    HA   ALA  32           HA       ALA  32 -32.582   9.737 -14.610
  275    HB1  ALA  32           3HB      ALA  32 -32.813   8.298 -11.965
  276    HB2  ALA  32           1HB      ALA  32 -33.117  10.029 -12.100
  277    HB3  ALA  32           2HB      ALA  32 -34.069   8.884 -13.067
  278    H    ASN  33           H        ASN  33 -31.975  11.662 -13.699
  279    HA   ASN  33           HA       ASN  33 -29.043  11.874 -13.334
  280    HB2  ASN  33           2HB      ASN  33 -29.580  14.370 -13.174
  281    HB3  ASN  33           3HB      ASN  33 -29.758  13.564 -14.711
  282   HD21  ASN  33          2HD2      ASN  33 -31.000  15.472 -15.303
  283   HD22  ASN  33          1HD2      ASN  33 -32.702  15.491 -14.872
  284    H    ALA  34           H        ALA  34 -28.253  11.234 -11.422
  285    HA   ALA  34           HA       ALA  34 -29.720  11.430  -8.948
  286    HB1  ALA  34           3HB      ALA  34 -26.769  10.870  -9.471
  287    HB2  ALA  34           1HB      ALA  34 -27.645  10.544  -7.968
  288    HB3  ALA  34           2HB      ALA  34 -28.072   9.656  -9.437
  289    H    ARG  35           H        ARG  35 -27.859  13.753 -10.601
  290    HA   ARG  35           HA       ARG  35 -26.925  15.149  -8.152
  291    HB2  ARG  35           2HB      ARG  35 -26.281  15.843 -11.033
  292    HB3  ARG  35           3HB      ARG  35 -25.447  16.375  -9.582
  293    HG2  ARG  35           2HG      ARG  35 -25.388  13.648 -10.892
  294    HG3  ARG  35           3HG      ARG  35 -24.058  14.755 -10.605
  295    HD2  ARG  35           2HD      ARG  35 -25.524  13.056  -8.552
  296    HD3  ARG  35           3HD      ARG  35 -23.865  12.867  -9.126
  297    HE   ARG  35           HE       ARG  35 -23.978  15.435  -8.025
  298   HH11  ARG  35          1HH1      ARG  35 -24.317  12.141  -6.845
  299   HH12  ARG  35          2HH1      ARG  35 -23.888  12.600  -5.211
  300   HH21  ARG  35          2HH2      ARG  35 -23.404  15.926  -5.929
  301   HH22  ARG  35          1HH2      ARG  35 -23.344  14.673  -4.725
  302    H    VAL  36           H        VAL  36 -29.780  15.258  -9.562
  303    HA   VAL  36           HA       VAL  36 -30.130  18.204  -9.324
  304    HB   VAL  36           HB       VAL  36 -30.163  17.027 -11.686
  305   HG11  VAL  36          1HG1      VAL  36 -33.071  16.656 -10.881
  306   HG12  VAL  36          2HG1      VAL  36 -32.370  16.437 -12.475
  307   HG13  VAL  36          3HG1      VAL  36 -31.902  15.345 -11.148
  308   HG21  VAL  36          3HG2      VAL  36 -30.569  19.392 -11.280
  309   HG22  VAL  36          1HG2      VAL  36 -31.635  18.726 -12.527
  310   HG23  VAL  36          2HG2      VAL  36 -32.277  19.046 -10.893
  311    H    GLU  37           H        GLU  37 -31.908  18.952  -8.229
  312    HA   GLU  37           HA       GLU  37 -32.973  17.367  -6.160
  313    HB2  GLU  37           2HB      GLU  37 -32.684  19.851  -6.250
  314    HB3  GLU  37           3HB      GLU  37 -34.090  19.955  -7.315
  315    HG2  GLU  37           2HG      GLU  37 -35.538  19.078  -5.527
  316    HG3  GLU  37           3HG      GLU  37 -34.131  18.789  -4.495
  317    H    ASN  38           H        ASN  38 -34.245  17.734  -9.415
  318    HA   ASN  38           HA       ASN  38 -36.893  16.673  -8.829
  319    HB2  ASN  38           2HB      ASN  38 -36.271  18.222 -10.743
  320    HB3  ASN  38           3HB      ASN  38 -35.427  16.865 -11.493
  321   HD21  ASN  38          2HD2      ASN  38 -36.828  17.017 -13.342
  322   HD22  ASN  38          1HD2      ASN  38 -38.477  16.424 -13.243
  323    H    CYS  39           H        CYS  39 -33.790  15.147  -9.244
  324    HA   CYS  39           HA       CYS  39 -33.092  13.022  -9.725
  325    HB2  CYS  39           2HB      CYS  39 -35.423  12.277  -7.933
  326    HB3  CYS  39           3HB      CYS  39 -33.885  11.438  -8.131
  327    HG   CYS  39           HG       CYS  39 -32.602  13.916  -7.443
  328    H    ALA  40           H        ALA  40 -34.436  13.664 -11.989
  329    HA   ALA  40           HA       ALA  40 -36.573  11.669 -12.364
  330    HB1  ALA  40           3HB      ALA  40 -37.310  13.922 -12.568
  331    HB2  ALA  40           1HB      ALA  40 -36.058  14.281 -13.801
  332    HB3  ALA  40           2HB      ALA  40 -37.380  13.143 -14.138
  333    H    VAL  41           H        VAL  41 -37.099  10.924 -14.399
  334    HA   VAL  41           HA       VAL  41 -35.095   9.136 -15.351
  335    HB   VAL  41           HB       VAL  41 -38.016   9.562 -16.117
  336   HG11  VAL  41          1HG1      VAL  41 -36.227   7.148 -16.570
  337   HG12  VAL  41          2HG1      VAL  41 -37.954   7.242 -16.941
  338   HG13  VAL  41          3HG1      VAL  41 -36.810   8.234 -17.856
  339   HG21  VAL  41          3HG2      VAL  41 -36.768   7.504 -14.248
  340   HG22  VAL  41          1HG2      VAL  41 -37.696   8.911 -13.718
  341   HG23  VAL  41          2HG2      VAL  41 -38.490   7.659 -14.662
  342    H    ILE  42           H        ILE  42 -33.611  10.120 -16.525
  343    HA   ILE  42           HA       ILE  42 -34.160  11.850 -18.846
  344    HB   ILE  42           HB       ILE  42 -31.717  11.795 -19.147
  345   HG12  ILE  42          2HG1      ILE  42 -31.623  10.080 -16.626
  346   HG13  ILE  42          3HG1      ILE  42 -31.305   9.479 -18.256
  347   HG21  ILE  42          1HG2      ILE  42 -32.871  13.446 -17.640
  348   HG22  ILE  42          2HG2      ILE  42 -32.471  12.407 -16.255
  349   HG23  ILE  42          3HG2      ILE  42 -31.182  13.160 -17.216
  350   HD11  ILE  42          3HD1      ILE  42 -29.396  11.073 -18.414
  351   HD12  ILE  42          1HD1      ILE  42 -29.667  11.485 -16.692
  352   HD13  ILE  42          2HD1      ILE  42 -29.240   9.828 -17.154
  353    H    TYR  43           H        TYR  43 -33.728   8.471 -18.148
  354    HA   TYR  43           HA       TYR  43 -34.611   7.814 -20.848
  355    HB2  TYR  43           2HB      TYR  43 -32.001   7.948 -20.988
  356    HB3  TYR  43           3HB      TYR  43 -32.007   6.485 -20.055
  357    HD1  TYR  43           HD1      TYR  43 -33.183   8.010 -23.241
  358    HD2  TYR  43           HD2      TYR  43 -32.477   4.344 -21.072
  359    HE1  TYR  43           HE1      TYR  43 -33.571   6.701 -25.324
  360    HE2  TYR  43           HE2      TYR  43 -32.878   3.039 -23.154
  361    HH   TYR  43           HH       TYR  43 -33.642   4.619 -26.281
  362    H    CYS  44           H        CYS  44 -35.140   5.461 -21.101
  363    HA   CYS  44           HA       CYS  44 -35.638   4.126 -18.517
  364    HB2  CYS  44           2HB      CYS  44 -38.070   3.957 -19.044
  365    HB3  CYS  44           3HB      CYS  44 -37.538   5.623 -18.745
  366    HG   CYS  44           HG       CYS  44 -37.274   6.317 -21.238
  367    H    ASN  45           H        ASN  45 -36.164   1.889 -18.642
  368    HA   ASN  45           HA       ASN  45 -35.647   0.651 -21.283
  369    HB2  ASN  45           2HB      ASN  45 -34.575  -0.161 -19.134
  370    HB3  ASN  45           3HB      ASN  45 -36.151  -0.812 -18.675
  371   HD21  ASN  45          2HD2      ASN  45 -33.575  -0.920 -21.193
  372   HD22  ASN  45          1HD2      ASN  45 -34.007  -2.530 -21.747
  373    H    ASP  46           H        ASP  46 -37.027  -0.864 -22.214
  374    HA   ASP  46           HA       ASP  46 -39.850  -0.213 -22.238
  375    HB2  ASP  46           2HB      ASP  46 -38.420  -2.695 -23.277
  376    HB3  ASP  46           3HB      ASP  46 -40.056  -2.187 -23.691
  377    H    GLY  47           H        GLY  47 -37.914  -2.664 -20.502
  378    HA2  GLY  47           HA2      GLY  47 -39.920  -4.331 -19.486
  379    HA3  GLY  47           HA3      GLY  47 -38.422  -3.900 -18.644
  380    H    PHE  48           H        PHE  48 -38.745  -1.230 -17.976
  381    HA   PHE  48           HA       PHE  48 -40.680  -1.406 -15.848
  382    HB2  PHE  48           2HB      PHE  48 -39.227  -0.054 -14.961
  383    HB3  PHE  48           3HB      PHE  48 -38.465   0.285 -16.493
  384    HD1  PHE  48           HD1      PHE  48 -39.067   2.284 -17.833
  385    HD2  PHE  48           HD2      PHE  48 -40.923   1.462 -14.029
  386    HE1  PHE  48           HE1      PHE  48 -39.834   4.628 -17.673
  387    HE2  PHE  48           HE2      PHE  48 -41.698   3.807 -13.889
  388    HZ   PHE  48           HZ       PHE  48 -41.145   5.406 -15.710
  389    H    CYS  49           H        CYS  49 -40.794  -0.103 -19.073
  390    HA   CYS  49           HA       CYS  49 -43.189   1.502 -18.807
  391    HB2  CYS  49           2HB      CYS  49 -41.554   1.635 -20.708
  392    HB3  CYS  49           3HB      CYS  49 -42.145   0.057 -21.275
  393    HG   CYS  49           HG       CYS  49 -44.699   0.763 -21.365
  394    H    GLU  50           H        GLU  50 -42.564  -1.980 -19.472
  395    HA   GLU  50           HA       GLU  50 -45.430  -2.624 -19.637
  396    HB2  GLU  50           2HB      GLU  50 -43.020  -4.441 -19.251
  397    HB3  GLU  50           3HB      GLU  50 -44.668  -4.951 -19.628
  398    HG2  GLU  50           2HG      GLU  50 -44.578  -3.618 -21.749
  399    HG3  GLU  50           3HG      GLU  50 -42.892  -3.241 -21.417
  400    H    LEU  51           H        LEU  51 -42.971  -2.607 -17.088
  401    HA   LEU  51           HA       LEU  51 -44.291  -3.976 -15.030
  402    HB2  LEU  51           2HB      LEU  51 -41.967  -3.191 -14.996
  403    HB3  LEU  51           3HB      LEU  51 -42.527  -1.530 -14.939
  404    HG   LEU  51           HG       LEU  51 -43.531  -1.788 -12.781
  405   HD11  LEU  51          1HD1      LEU  51 -42.131  -4.496 -12.718
  406   HD12  LEU  51          2HD1      LEU  51 -42.955  -3.679 -11.368
  407   HD13  LEU  51          3HD1      LEU  51 -43.895  -4.234 -12.755
  408   HD21  LEU  51          3HD2      LEU  51 -41.288  -0.860 -13.025
  409   HD22  LEU  51          1HD2      LEU  51 -41.415  -1.800 -11.529
  410   HD23  LEU  51          2HD2      LEU  51 -40.581  -2.492 -12.940
  411    H    CYS  52           H        CYS  52 -44.375  -0.404 -15.631
  412    HA   CYS  52           HA       CYS  52 -46.715  -0.112 -13.869
  413    HB2  CYS  52           2HB      CYS  52 -46.551   2.252 -14.383
  414    HB3  CYS  52           3HB      CYS  52 -44.966   1.610 -13.942
  415    HG   CYS  52           HG       CYS  52 -43.957   1.437 -16.304
  416    H    GLY  53           H        GLY  53 -46.174  -0.464 -17.303
  417    HA2  GLY  53           HA2      GLY  53 -47.688  -1.244 -18.880
  418    HA3  GLY  53           HA3      GLY  53 -49.039  -0.914 -17.799
  419    H    TYR  54           H        TYR  54 -46.961   1.824 -18.188
  420    HA   TYR  54           HA       TYR  54 -49.041   3.203 -19.773
  421    HB2  TYR  54           2HB      TYR  54 -46.686   4.212 -18.168
  422    HB3  TYR  54           3HB      TYR  54 -47.701   5.251 -19.157
  423    HD1  TYR  54           HD2      TYR  54 -50.244   5.245 -18.787
  424    HD2  TYR  54           HD1      TYR  54 -47.367   3.850 -15.894
  425    HE1  TYR  54           HE2      TYR  54 -51.886   5.645 -16.964
  426    HE2  TYR  54           HE1      TYR  54 -49.018   4.248 -14.065
  427    HH   TYR  54           HH       TYR  54 -52.284   5.580 -14.717
  428    H    SER  55           H        SER  55 -46.228   4.870 -20.384
  429    HA   SER  55           HA       SER  55 -45.365   3.535 -22.847
  430    HB2  SER  55           2HB      SER  55 -47.472   4.591 -23.580
  431    HB3  SER  55           3HB      SER  55 -46.897   6.157 -22.971
  432    HG   SER  55           HG       SER  55 -46.522   5.797 -25.256
  433    H    ARG  56           H        ARG  56 -43.379   4.371 -23.534
  434    HA   ARG  56           HA       ARG  56 -41.778   5.662 -21.534
  435    HB2  ARG  56           2HB      ARG  56 -41.211   5.056 -24.466
  436    HB3  ARG  56           3HB      ARG  56 -39.995   5.598 -23.302
  437    HG2  ARG  56           2HG      ARG  56 -40.402   3.601 -21.888
  438    HG3  ARG  56           3HG      ARG  56 -41.703   3.094 -22.957
  439    HD2  ARG  56           2HD      ARG  56 -39.897   1.721 -23.464
  440    HD3  ARG  56           3HD      ARG  56 -40.092   2.835 -24.821
  441    HE   ARG  56           HE       ARG  56 -38.125   3.719 -22.836
  442   HH11  ARG  56          2HH1      ARG  56 -38.401   1.486 -25.518
  443   HH12  ARG  56          1HH1      ARG  56 -36.809   1.857 -26.106
  444   HH21  ARG  56          1HH2      ARG  56 -35.966   3.634 -23.342
  445   HH22  ARG  56          2HH2      ARG  56 -35.457   3.128 -24.924
  446    H    ALA  57           H        ALA  57 -43.401   7.008 -24.345
  447    HA   ALA  57           HA       ALA  57 -42.262   9.635 -24.301
  448    HB1  ALA  57           3HB      ALA  57 -45.021   8.675 -25.184
  449    HB2  ALA  57           1HB      ALA  57 -44.261  10.218 -25.627
  450    HB3  ALA  57           2HB      ALA  57 -43.551   8.693 -26.188
  451    H    GLU  58           H        GLU  58 -44.326   8.119 -22.001
  452    HA   GLU  58           HA       GLU  58 -45.392  10.630 -20.893
  453    HB2  GLU  58           2HB      GLU  58 -46.092   7.754 -20.201
  454    HB3  GLU  58           3HB      GLU  58 -46.775   9.205 -19.502
  455    HG2  GLU  58           2HG      GLU  58 -47.575   9.916 -21.766
  456    HG3  GLU  58           3HG      GLU  58 -47.006   8.383 -22.422
  457    H    VAL  59           H        VAL  59 -42.719   8.413 -20.387
  458    HA   VAL  59           HA       VAL  59 -42.670   8.985 -17.466
  459    HB   VAL  59           HB       VAL  59 -41.063   7.396 -17.162
  460   HG11  VAL  59          1HG1      VAL  59 -42.012   5.379 -18.136
  461   HG12  VAL  59          2HG1      VAL  59 -43.313   6.518 -17.770
  462   HG13  VAL  59          3HG1      VAL  59 -42.748   6.300 -19.440
  463   HG21  VAL  59          3HG2      VAL  59 -40.426   7.474 -20.116
  464   HG22  VAL  59          1HG2      VAL  59 -39.362   7.849 -18.758
  465   HG23  VAL  59          2HG2      VAL  59 -39.898   6.195 -19.052
  466    H    MET  60           H        MET  60 -41.258  10.192 -20.329
  467    HA   MET  60           HA       MET  60 -38.702  11.023 -19.674
  468    HB2  MET  60           2HB      MET  60 -40.814  12.537 -21.283
  469    HB3  MET  60           3HB      MET  60 -39.103  12.968 -21.216
  470    HG2  MET  60           2HG      MET  60 -40.232  10.433 -22.361
  471    HG3  MET  60           3HG      MET  60 -39.623  11.811 -23.242
  472    HE1  MET  60           3HE      MET  60 -37.134   8.352 -21.605
  473    HE2  MET  60           1HE      MET  60 -38.399   9.042 -20.573
  474    HE3  MET  60           2HE      MET  60 -38.827   8.344 -22.152
  475    H    GLN  61           H        GLN  61 -37.948  12.034 -18.051
  476    HA   GLN  61           HA       GLN  61 -37.391  13.668 -16.635
  477    HB2  GLN  61           2HB      GLN  61 -39.456  15.489 -17.863
  478    HB3  GLN  61           3HB      GLN  61 -37.958  15.936 -17.078
  479    HG2  GLN  61           2HG      GLN  61 -36.679  15.557 -18.938
  480    HG3  GLN  61           3HG      GLN  61 -37.564  14.183 -19.495
  481   HE21  GLN  61          2HE2      GLN  61 -39.998  14.730 -20.120
  482   HE22  GLN  61          1HE2      GLN  61 -40.019  15.939 -21.387
  483    H    ARG  62           H        ARG  62 -39.803  11.822 -16.017
  484    HA   ARG  62           HA       ARG  62 -40.980  13.336 -13.723
  485    HB2  ARG  62           2HB      ARG  62 -41.274  10.582 -14.906
  486    HB3  ARG  62           3HB      ARG  62 -41.955  10.952 -13.320
  487    HG2  ARG  62           2HG      ARG  62 -43.544  12.439 -14.129
  488    HG3  ARG  62           3HG      ARG  62 -42.640  12.800 -15.612
  489    HD2  ARG  62           2HD      ARG  62 -44.686  11.319 -15.917
  490    HD3  ARG  62           3HD      ARG  62 -43.142  10.771 -16.599
  491    HE   ARG  62           HE       ARG  62 -43.156   9.590 -14.139
  492   HH11  ARG  62          1HH1      ARG  62 -45.158   9.387 -16.989
  493   HH12  ARG  62          2HH1      ARG  62 -45.835   7.830 -16.556
  494   HH21  ARG  62          2HH2      ARG  62 -44.011   7.547 -13.646
  495   HH22  ARG  62          1HH2      ARG  62 -45.130   6.790 -14.736
  496    HA   PRO  63           HA       PRO  63 -38.014  12.014 -10.701
  497    HB2  PRO  63           2HB      PRO  63 -39.517  11.754  -8.422
  498    HB3  PRO  63           3HB      PRO  63 -39.133  13.331  -9.170
  499    HG2  PRO  63           2HG      PRO  63 -41.651  11.680  -9.534
  500    HG3  PRO  63           3HG      PRO  63 -41.518  13.420  -9.116
  501    HD2  PRO  63           2HD      PRO  63 -41.934  12.640 -11.662
  502    HD3  PRO  63           3HD      PRO  63 -40.804  13.983 -11.311
  503    H    CYS  64           H        CYS  64 -37.050  10.123 -10.069
  504    HA   CYS  64           HA       CYS  64 -38.324   7.524 -10.415
  505    HB2  CYS  64           2HB      CYS  64 -35.681   8.404  -9.204
  506    HB3  CYS  64           3HB      CYS  64 -36.232   6.712  -9.313
  507    HG   CYS  64           HG       CYS  64 -35.930   8.918 -11.740
  508    H    THR  65           H        THR  65 -38.463   9.765  -7.807
  509    HA   THR  65           HA       THR  65 -38.538   8.193  -5.534
  510    HB   THR  65           HB       THR  65 -40.349  10.591  -5.874
  511    HG1  THR  65           HG1      THR  65 -38.573  11.890  -5.487
  512   HG21  THR  65          1HG2      THR  65 -39.572  11.040  -3.566
  513   HG22  THR  65          2HG2      THR  65 -40.309   9.434  -3.683
  514   HG23  THR  65          3HG2      THR  65 -38.538   9.593  -3.650
  515    H    CYS  66           H        CYS  66 -39.584   6.357  -5.728
  516    HA   CYS  66           HA       CYS  66 -41.819   5.624  -6.996
  517    HB2  CYS  66           2HB      CYS  66 -41.034   4.459  -4.296
  518    HB3  CYS  66           3HB      CYS  66 -41.950   3.648  -5.579
  519    HG   CYS  66           HG       CYS  66 -40.016   3.903  -7.425
  520    H    ASP  67           H        ASP  67 -42.117   7.649  -4.262
  521    HA   ASP  67           HA       ASP  67 -44.800   7.176  -3.390
  522    HB2  ASP  67           2HB      ASP  67 -43.192   8.766  -2.350
  523    HB3  ASP  67           3HB      ASP  67 -43.250   9.772  -3.791
  524    H    PHE  68           H        PHE  68 -43.473   8.866  -6.251
  525    HA   PHE  68           HA       PHE  68 -45.879   9.904  -7.376
  526    HB2  PHE  68           2HB      PHE  68 -43.405  10.371  -7.906
  527    HB3  PHE  68           3HB      PHE  68 -43.414   8.894  -8.851
  528    HD1  PHE  68           HD1      PHE  68 -44.797   8.782 -10.967
  529    HD2  PHE  68           HD2      PHE  68 -44.423  12.409  -8.665
  530    HE1  PHE  68           HE1      PHE  68 -45.652  10.100 -12.895
  531    HE2  PHE  68           HE2      PHE  68 -45.233  13.726 -10.609
  532    HZ   PHE  68           HZ       PHE  68 -45.852  12.572 -12.725
  533    H    LEU  69           H        LEU  69 -44.763   6.649  -7.114
  534    HA   LEU  69           HA       LEU  69 -46.765   5.617  -9.050
  535    HB2  LEU  69           2HB      LEU  69 -44.031   5.346  -9.210
  536    HB3  LEU  69           3HB      LEU  69 -44.410   3.946  -8.245
  537    HG   LEU  69           HG       LEU  69 -44.186   3.424 -10.598
  538   HD11  LEU  69          1HD1      LEU  69 -47.123   3.159  -9.890
  539   HD12  LEU  69          2HD1      LEU  69 -46.204   2.182 -11.050
  540   HD13  LEU  69          3HD1      LEU  69 -45.820   2.090  -9.324
  541   HD21  LEU  69          3HD2      LEU  69 -45.632   4.245 -12.341
  542   HD22  LEU  69          1HD2      LEU  69 -46.575   5.212 -11.194
  543   HD23  LEU  69          2HD2      LEU  69 -44.877   5.624 -11.523
  544    H    HIS  70           H        HIS  70 -46.897   6.313  -5.997
  545    HA   HIS  70           HA       HIS  70 -47.240   3.752  -4.723
  546    HB2  HIS  70           2HB      HIS  70 -47.756   4.850  -2.816
  547    HB3  HIS  70           3HB      HIS  70 -46.785   6.056  -3.617
  548    HD2  HIS  70           HD2      HIS  70 -48.820   7.699  -5.312
  549    HE1  HIS  70           HE1      HIS  70 -51.400   7.827  -1.920
  550    HE2  HIS  70           HE2      HIS  70 -50.878   8.887  -4.177
  551    H    GLY  71           H        GLY  71 -49.068   2.695  -4.007
  552    HA2  GLY  71           HA2      GLY  71 -51.735   3.438  -5.110
  553    HA3  GLY  71           HA3      GLY  71 -51.106   1.813  -5.376
  554    HA   PRO  72           HA       PRO  72 -53.547   2.194  -1.370
  555    HB2  PRO  72           2HB      PRO  72 -55.240   0.042  -1.716
  556    HB3  PRO  72           3HB      PRO  72 -55.540   1.675  -2.378
  557    HG2  PRO  72           2HG      PRO  72 -54.267  -0.694  -3.792
  558    HG3  PRO  72           3HG      PRO  72 -55.619   0.339  -4.366
  559    HD2  PRO  72           2HD      PRO  72 -53.099   0.815  -5.181
  560    HD3  PRO  72           3HD      PRO  72 -54.161   2.184  -4.743
  561    H    ARG  73           H        ARG  73 -51.483  -0.233  -2.671
  562    HA   ARG  73           HA       ARG  73 -51.318  -1.767  -0.120
  563    HB2  ARG  73           2HB      ARG  73 -51.348  -2.660  -2.640
  564    HB3  ARG  73           3HB      ARG  73 -49.655  -2.229  -2.597
  565    HG2  ARG  73           2HG      ARG  73 -49.539  -4.459  -1.988
  566    HG3  ARG  73           3HG      ARG  73 -49.632  -3.722  -0.393
  567    HD2  ARG  73           2HD      ARG  73 -51.214  -5.432  -0.286
  568    HD3  ARG  73           3HD      ARG  73 -52.221  -4.011  -0.614
  569    HE   ARG  73           HE       ARG  73 -51.693  -4.919  -3.142
  570   HH11  ARG  73          2HH1      ARG  73 -53.001  -6.671  -0.397
  571   HH12  ARG  73          1HH1      ARG  73 -53.852  -7.784  -1.434
  572   HH21  ARG  73          1HH2      ARG  73 -52.729  -6.295  -4.348
  573   HH22  ARG  73          2HH2      ARG  73 -53.707  -7.578  -3.656
  574    H    THR  74           H        THR  74 -49.802   1.016  -1.465
  575    HA   THR  74           HA       THR  74 -47.102   0.326  -0.624
  576    HB   THR  74           HB       THR  74 -47.977   3.104  -1.421
  577    HG1  THR  74           HG1      THR  74 -46.972   1.427  -3.368
  578   HG21  THR  74          1HG2      THR  74 -45.647   2.927  -0.706
  579   HG22  THR  74          2HG2      THR  74 -45.402   1.474  -1.696
  580   HG23  THR  74          3HG2      THR  74 -45.663   3.058  -2.468
  581    H    GLN  75           H        GLN  75 -45.884   1.041   1.035
  582    HA   GLN  75           HA       GLN  75 -47.357   2.266   3.303
  583    HB2  GLN  75           2HB      GLN  75 -44.634   0.914   3.323
  584    HB3  GLN  75           3HB      GLN  75 -45.598   1.412   4.714
  585    HG2  GLN  75           2HG      GLN  75 -46.193  -0.846   2.768
  586    HG3  GLN  75           3HG      GLN  75 -45.783  -0.963   4.477
  587   HE21  GLN  75          2HE2      GLN  75 -48.422  -1.130   2.349
  588   HE22  GLN  75          1HE2      GLN  75 -49.661  -0.732   3.529
  589    H    ARG  76           H        ARG  76 -46.736   3.981   4.394
  590    HA   ARG  76           HA       ARG  76 -45.536   6.116   2.870
  591    HB2  ARG  76           2HB      ARG  76 -46.121   6.146   5.832
  592    HB3  ARG  76           3HB      ARG  76 -46.027   7.519   4.734
  593    HG2  ARG  76           2HG      ARG  76 -48.289   7.395   4.672
  594    HG3  ARG  76           3HG      ARG  76 -48.029   6.076   3.514
  595    HD2  ARG  76           2HD      ARG  76 -48.115   4.449   5.413
  596    HD3  ARG  76           3HD      ARG  76 -48.436   5.797   6.521
  597    HE   ARG  76           HE       ARG  76 -50.345   5.861   4.394
  598   HH11  ARG  76          2HH1      ARG  76 -49.671   3.914   7.233
  599   HH12  ARG  76          1HH1      ARG  76 -51.333   3.417   7.392
  600   HH21  ARG  76          1HH2      ARG  76 -52.442   5.187   4.661
  601   HH22  ARG  76          2HH2      ARG  76 -52.855   4.124   5.975
  602    H    ARG  77           H        ARG  77 -44.393   4.185   5.625
  603    HA   ARG  77           HA       ARG  77 -41.869   5.442   6.000
  604    HB2  ARG  77           2HB      ARG  77 -41.185   3.440   7.115
  605    HB3  ARG  77           3HB      ARG  77 -42.855   3.819   7.558
  606    HG2  ARG  77           2HG      ARG  77 -43.560   2.057   5.804
  607    HG3  ARG  77           3HG      ARG  77 -41.848   1.594   5.735
  608    HD2  ARG  77           2HD      ARG  77 -41.925   1.184   8.211
  609    HD3  ARG  77           3HD      ARG  77 -43.670   1.528   8.163
  610    HE   ARG  77           HE       ARG  77 -42.952  -0.505   6.240
  611   HH11  ARG  77          1HH1      ARG  77 -43.488  -0.149   9.684
  612   HH12  ARG  77          2HH1      ARG  77 -43.920  -1.826   9.882
  613   HH21  ARG  77          1HH2      ARG  77 -43.506  -2.635   6.566
  614   HH22  ARG  77          2HH2      ARG  77 -43.925  -3.187   8.159
  615    H    ALA  78           H        ALA  78 -42.795   2.924   3.702
  616    HA   ALA  78           HA       ALA  78 -40.187   2.412   2.614
  617    HB1  ALA  78           3HB      ALA  78 -41.532   1.385   0.771
  618    HB2  ALA  78           1HB      ALA  78 -42.042   0.828   2.359
  619    HB3  ALA  78           2HB      ALA  78 -42.998   2.015   1.443
  620    H    ALA  79           H        ALA  79 -42.937   4.479   1.534
  621    HA   ALA  79           HA       ALA  79 -41.550   5.592  -0.734
  622    HB1  ALA  79           3HB      ALA  79 -44.026   5.495  -0.471
  623    HB2  ALA  79           1HB      ALA  79 -43.929   6.612   0.909
  624    HB3  ALA  79           2HB      ALA  79 -43.485   7.168  -0.715
  625    H    ALA  80           H        ALA  80 -41.785   6.671   2.653
  626    HA   ALA  80           HA       ALA  80 -40.562   9.223   2.269
  627    HB1  ALA  80           3HB      ALA  80 -40.356   9.155   4.744
  628    HB2  ALA  80           1HB      ALA  80 -41.978   8.689   4.186
  629    HB3  ALA  80           2HB      ALA  80 -40.829   7.439   4.721
  630    H    GLN  81           H        GLN  81 -39.150   6.158   3.619
  631    HA   GLN  81           HA       GLN  81 -36.470   6.952   3.715
  632    HB2  GLN  81           2HB      GLN  81 -37.510   4.853   4.613
  633    HB3  GLN  81           3HB      GLN  81 -37.451   4.176   2.980
  634    HG2  GLN  81           2HG      GLN  81 -34.991   4.382   2.963
  635    HG3  GLN  81           3HG      GLN  81 -35.024   5.257   4.495
  636   HE21  GLN  81          2HE2      GLN  81 -35.983   3.998   6.438
  637   HE22  GLN  81          1HE2      GLN  81 -35.620   2.278   6.468
  638    H    ILE  82           H        ILE  82 -38.288   5.766   0.812
  639    HA   ILE  82           HA       ILE  82 -36.000   5.892  -0.925
  640    HB   ILE  82           HB       ILE  82 -38.980   5.915  -1.366
  641   HG12  ILE  82          2HG1      ILE  82 -36.770   3.963  -2.196
  642   HG13  ILE  82          3HG1      ILE  82 -37.588   3.889  -0.629
  643   HG21  ILE  82          1HG2      ILE  82 -38.136   7.322  -3.139
  644   HG22  ILE  82          2HG2      ILE  82 -36.781   6.217  -3.453
  645   HG23  ILE  82          3HG2      ILE  82 -38.453   5.725  -3.833
  646   HD11  ILE  82          3HD1      ILE  82 -38.669   2.348  -2.019
  647   HD12  ILE  82          1HD1      ILE  82 -39.770   3.731  -1.783
  648   HD13  ILE  82          2HD1      ILE  82 -38.885   3.527  -3.326
  649    H    ALA  83           H        ALA  83 -38.606   8.318  -0.293
  650    HA   ALA  83           HA       ALA  83 -37.575  10.378  -1.891
  651    HB1  ALA  83           3HB      ALA  83 -38.948  10.637   0.808
  652    HB2  ALA  83           1HB      ALA  83 -38.823  11.884  -0.441
  653    HB3  ALA  83           2HB      ALA  83 -39.769  10.405  -0.752
  654    H    GLN  84           H        GLN  84 -36.497   9.388   1.348
  655    HA   GLN  84           HA       GLN  84 -34.628  11.611   1.686
  656    HB2  GLN  84           2HB      GLN  84 -34.390   8.922   3.067
  657    HB3  GLN  84           3HB      GLN  84 -33.732  10.474   3.544
  658    HG2  GLN  84           2HG      GLN  84 -36.504   9.434   3.825
  659    HG3  GLN  84           3HG      GLN  84 -35.483  10.102   5.034
  660   HE21  GLN  84          1HE2      GLN  84 -38.035  10.736   2.864
  661   HE22  GLN  84          2HE2      GLN  84 -38.124  12.486   3.119
  662    H    ALA  85           H        ALA  85 -34.404   8.264   0.336
  663    HA   ALA  85           HA       ALA  85 -31.524   8.242   0.181
  664    HB1  ALA  85           3HB      ALA  85 -33.614   6.597  -1.317
  665    HB2  ALA  85           1HB      ALA  85 -31.886   6.223  -1.174
  666    HB3  ALA  85           2HB      ALA  85 -32.917   6.194   0.270
  667    H    LEU  86           H        LEU  86 -34.118   9.271  -2.004
  668    HA   LEU  86           HA       LEU  86 -32.260   9.900  -4.165
  669    HB2  LEU  86           2HB      LEU  86 -35.154  10.748  -3.940
  670    HB3  LEU  86           3HB      LEU  86 -34.135  10.693  -5.368
  671    HG   LEU  86           HG       LEU  86 -35.568   8.472  -3.932
  672   HD11  LEU  86          1HD1      LEU  86 -34.944   8.968  -6.880
  673   HD12  LEU  86          2HD1      LEU  86 -36.133   7.826  -6.206
  674   HD13  LEU  86          3HD1      LEU  86 -36.368   9.576  -6.030
  675   HD21  LEU  86          3HD2      LEU  86 -33.307   7.470  -3.959
  676   HD22  LEU  86          1HD2      LEU  86 -34.254   6.755  -5.251
  677   HD23  LEU  86          2HD2      LEU  86 -33.053   8.009  -5.632
  678    H    LEU  87           H        LEU  87 -33.836  11.740  -1.548
  679    HA   LEU  87           HA       LEU  87 -32.905  14.346  -2.160
  680    HB2  LEU  87           2HB      LEU  87 -34.606  14.172  -0.631
  681    HB3  LEU  87           3HB      LEU  87 -33.937  12.752   0.136
  682    HG   LEU  87           HG       LEU  87 -32.637  15.299   0.632
  683   HD11  LEU  87          1HD1      LEU  87 -35.078  14.215   2.065
  684   HD12  LEU  87          2HD1      LEU  87 -34.128  15.621   2.602
  685   HD13  LEU  87          3HD1      LEU  87 -35.017  15.688   1.074
  686   HD21  LEU  87          3HD2      LEU  87 -31.460  13.394   1.564
  687   HD22  LEU  87          1HD2      LEU  87 -32.141  14.367   2.854
  688   HD23  LEU  87          2HD2      LEU  87 -32.942  12.857   2.389
  689    H    GLY  88           H        GLY  88 -31.294  11.560  -0.683
  690    HA2  GLY  88           HA2      GLY  88 -28.956  11.270  -1.240
  691    HA3  GLY  88           HA3      GLY  88 -28.674  12.993  -1.010
  692    H    ALA  89           H        ALA  89 -30.654  11.384   1.397
  693    HA   ALA  89           HA       ALA  89 -28.894  11.976   3.557
  694    HB1  ALA  89           3HB      ALA  89 -31.312  11.714   3.836
  695    HB2  ALA  89           1HB      ALA  89 -31.212   9.999   3.369
  696    HB3  ALA  89           2HB      ALA  89 -30.453  10.562   4.873
  697    H    GLU  90           H        GLU  90 -29.596   8.881   1.927
  698    HA   GLU  90           HA       GLU  90 -26.852   7.981   2.063
  699    HB2  GLU  90           2HB      GLU  90 -27.421   5.777   3.133
  700    HB3  GLU  90           3HB      GLU  90 -27.387   7.151   4.231
  701    HG2  GLU  90           2HG      GLU  90 -29.844   7.245   4.276
  702    HG3  GLU  90           3HG      GLU  90 -29.946   5.968   3.069
  703    H    GLU  91           H        GLU  91 -26.430   6.403   0.446
  704    HA   GLU  91           HA       GLU  91 -28.584   5.863  -1.530
  705    HB2  GLU  91           2HB      GLU  91 -25.646   5.077  -1.364
  706    HB3  GLU  91           3HB      GLU  91 -26.784   4.358  -2.509
  707    HG2  GLU  91           2HG      GLU  91 -26.021   6.081  -3.792
  708    HG3  GLU  91           3HG      GLU  91 -27.468   6.794  -3.088
  709    H    ARG  92           H        ARG  92 -30.046   4.494  -1.134
  710    HA   ARG  92           HA       ARG  92 -29.524   2.034   0.490
  711    HB2  ARG  92           2HB      ARG  92 -30.165   3.917   1.976
  712    HB3  ARG  92           3HB      ARG  92 -31.633   4.169   1.039
  713    HG2  ARG  92           2HG      ARG  92 -32.214   3.019   3.042
  714    HG3  ARG  92           3HG      ARG  92 -32.410   1.880   1.708
  715    HD2  ARG  92           2HD      ARG  92 -30.308   0.771   2.272
  716    HD3  ARG  92           3HD      ARG  92 -29.948   1.977   3.504
  717    HE   ARG  92           HE       ARG  92 -31.925  -0.219   3.644
  718   HH11  ARG  92          1HH2      ARG  92 -30.752   2.700   5.281
  719   HH12  ARG  92          2HH2      ARG  92 -31.484   2.209   6.786
  720   HH21  ARG  92          1HH1      ARG  92 -32.798  -0.734   5.608
  721   HH22  ARG  92          2HH1      ARG  92 -32.596   0.332   6.966
  722    H    LYS  93           H        LYS  93 -30.624   0.330  -0.015
  723    HA   LYS  93           HA       LYS  93 -32.679   0.318  -2.162
  724    HB2  LYS  93           2HB      LYS  93 -30.793  -1.232  -2.299
  725    HB3  LYS  93           3HB      LYS  93 -31.288  -1.961  -0.750
  726    HG2  LYS  93           2HG      LYS  93 -33.561  -2.388  -1.985
  727    HG3  LYS  93           3HG      LYS  93 -32.648  -2.016  -3.450
  728    HD2  LYS  93           2HD      LYS  93 -31.953  -4.175  -1.423
  729    HD3  LYS  93           3HD      LYS  93 -32.746  -4.442  -2.982
  730    HE2  LYS  93           2HE      LYS  93 -30.752  -3.415  -4.118
  731    HE3  LYS  93           3HE      LYS  93 -29.937  -3.317  -2.547
  732    HZ1  LYS  93           HZ1      LYS  93 -30.166  -5.780  -2.413
  733    HZ2  LYS  93           HZ2      LYS  93 -30.840  -5.783  -3.920
  734    HZ3  LYS  93           HZ3      LYS  93 -29.286  -5.327  -3.722
  735    H    VAL  94           H        VAL  94 -34.735   0.134  -1.764
  736    HA   VAL  94           HA       VAL  94 -35.771  -0.627   0.928
  737    HB   VAL  94           HB       VAL  94 -36.901   1.698  -0.632
  738   HG11  VAL  94          1HG1      VAL  94 -36.993   1.018   2.341
  739   HG12  VAL  94          2HG1      VAL  94 -37.834   2.365   1.541
  740   HG13  VAL  94          3HG1      VAL  94 -38.296   0.712   1.175
  741   HG21  VAL  94          3HG2      VAL  94 -34.637   2.480  -0.172
  742   HG22  VAL  94          1HG2      VAL  94 -35.760   3.288   0.922
  743   HG23  VAL  94          2HG2      VAL  94 -34.772   1.936   1.520
  744    H    GLU  95           H        GLU  95 -37.763  -1.564   0.905
  745    HA   GLU  95           HA       GLU  95 -38.699  -2.674  -1.666
  746    HB2  GLU  95           2HB      GLU  95 -40.124  -4.072  -0.298
  747    HB3  GLU  95           3HB      GLU  95 -38.448  -4.138   0.286
  748    HG2  GLU  95           2HG      GLU  95 -39.021  -2.537   2.109
  749    HG3  GLU  95           3HG      GLU  95 -40.689  -2.485   1.546
  750    H    ILE  96           H        ILE  96 -40.920  -2.365  -2.360
  751    HA   ILE  96           HA       ILE  96 -42.604  -0.432  -1.128
  752    HB   ILE  96           HB       ILE  96 -42.567   0.885  -3.560
  753   HG12  ILE  96          2HG1      ILE  96 -40.326   1.722  -4.023
  754   HG13  ILE  96          3HG1      ILE  96 -39.626   0.573  -2.873
  755   HG21  ILE  96          1HG2      ILE  96 -41.878   2.815  -2.456
  756   HG22  ILE  96          2HG2      ILE  96 -42.798   1.857  -1.293
  757   HG23  ILE  96          3HG2      ILE  96 -41.014   1.893  -1.215
  758   HD11  ILE  96          3HD1      ILE  96 -39.375  -0.198  -5.186
  759   HD12  ILE  96          1HD1      ILE  96 -40.403  -1.287  -4.255
  760   HD13  ILE  96          2HD1      ILE  96 -41.153  -0.156  -5.387
  761    H    ALA  97           H        ALA  97 -44.643  -0.292  -2.062
  762    HA   ALA  97           HA       ALA  97 -45.246  -2.475  -3.964
  763    HB1  ALA  97           3HB      ALA  97 -46.624  -2.239  -1.871
  764    HB2  ALA  97           1HB      ALA  97 -47.225  -0.704  -2.526
  765    HB3  ALA  97           2HB      ALA  97 -47.551  -2.197  -3.381
  766    H    PHE  98           H        PHE  98 -46.278  -2.193  -5.901
  767    HA   PHE  98           HA       PHE  98 -46.402   0.589  -7.030
  768    HB2  PHE  98           2HB      PHE  98 -45.633  -1.985  -8.453
  769    HB3  PHE  98           3HB      PHE  98 -45.873  -0.435  -9.233
  770    HD1  PHE  98           HD2      PHE  98 -44.407   1.500  -7.564
  771    HD2  PHE  98           HD1      PHE  98 -43.389  -2.536  -8.715
  772    HE1  PHE  98           HE2      PHE  98 -41.997   2.074  -7.466
  773    HE2  PHE  98           HE1      PHE  98 -40.990  -1.964  -8.587
  774    HZ   PHE  98           HZ       PHE  98 -40.287   0.355  -7.973
  775    H    TYR  99           H        TYR  99 -47.982   0.929  -8.644
  776    HA   TYR  99           HA       TYR  99 -50.125  -1.119  -8.804
  777    HB2  TYR  99           2HB      TYR  99 -51.819   0.427  -8.948
  778    HB3  TYR  99           3HB      TYR  99 -50.838   1.011  -7.619
  779    HD1  TYR  99           HD1      TYR  99 -49.348   3.044  -7.975
  780    HD2  TYR  99           HD2      TYR  99 -52.152   1.686 -10.954
  781    HE1  TYR  99           HE1      TYR  99 -49.144   5.227  -9.169
  782    HE2  TYR  99           HE2      TYR  99 -51.928   3.847 -12.157
  783    HH   TYR  99           HH       TYR  99 -50.885   5.871 -12.237
  784    H    ARG 100           H        ARG 100 -50.772  -1.733 -10.779
  785    HA   ARG 100           HA       ARG 100 -49.373  -0.662 -13.188
  786    HB2  ARG 100           2HB      ARG 100 -51.149  -3.125 -12.966
  787    HB3  ARG 100           3HB      ARG 100 -50.089  -2.656 -14.304
  788    HG2  ARG 100           2HG      ARG 100 -48.135  -2.824 -12.605
  789    HG3  ARG 100           3HG      ARG 100 -49.288  -3.575 -11.502
  790    HD2  ARG 100           2HD      ARG 100 -48.067  -5.317 -12.609
  791    HD3  ARG 100           3HD      ARG 100 -49.742  -5.344 -13.172
  792    HE   ARG 100           HE       ARG 100 -47.551  -3.961 -14.699
  793   HH11  ARG 100          1HH2      ARG 100 -50.089  -6.407 -14.717
  794   HH12  ARG 100          2HH2      ARG 100 -49.962  -6.663 -16.434
  795   HH21  ARG 100          1HH1      ARG 100 -47.412  -4.417 -16.904
  796   HH22  ARG 100          2HH1      ARG 100 -48.510  -5.566 -17.624
  797    H    LYS 101           H        LYS 101 -50.575   0.073 -14.988
  798    HA   LYS 101           HA       LYS 101 -52.661   1.803 -14.233
  799    HB2  LYS 101           2HB      LYS 101 -52.707   2.607 -16.463
  800    HB3  LYS 101           3HB      LYS 101 -51.058   2.243 -15.989
  801    HG2  LYS 101           2HG      LYS 101 -51.106   1.486 -18.133
  802    HG3  LYS 101           3HG      LYS 101 -51.370  -0.012 -17.235
  803    HD2  LYS 101           2HD      LYS 101 -53.894   0.377 -17.684
  804    HD3  LYS 101           3HD      LYS 101 -53.413   1.666 -18.780
  805    HE2  LYS 101           2HE      LYS 101 -52.423  -1.206 -18.912
  806    HE3  LYS 101           3HE      LYS 101 -53.868  -0.655 -19.773
  807    HZ1  LYS 101           HZ1      LYS 101 -51.954  -0.591 -21.239
  808    HZ2  LYS 101           HZ2      LYS 101 -52.470   0.936 -20.986
  809    HZ3  LYS 101           HZ3      LYS 101 -51.119   0.387 -20.235
  810    H    ASP 102           H        ASP 102 -53.088  -1.449 -15.153
  811    HA   ASP 102           HA       ASP 102 -55.897  -1.281 -15.870
  812    HB2  ASP 102           2HB      ASP 102 -54.280  -3.088 -16.543
  813    HB3  ASP 102           3HB      ASP 102 -54.275  -3.650 -14.871
  814    H    GLY 103           H        GLY 103 -54.325  -0.876 -12.876
  815    HA2  GLY 103           HA2      GLY 103 -55.523  -0.093 -10.992
  816    HA3  GLY 103           HA3      GLY 103 -56.897  -1.119 -11.389
  817    H    SER 104           H        SER 104 -53.891  -2.807 -11.584
  818    HA   SER 104           HA       SER 104 -54.509  -4.284  -9.066
  819    HB2  SER 104           2HB      SER 104 -52.546  -4.903 -11.301
  820    HB3  SER 104           3HB      SER 104 -52.860  -5.921  -9.881
  821    HG   SER 104           HG       SER 104 -54.095  -6.577 -11.712
  822    H    CYS 105           H        CYS 105 -53.245  -4.165  -7.229
  823    HA   CYS 105           HA       CYS 105 -50.644  -2.731  -7.397
  824    HB2  CYS 105           2HB      CYS 105 -52.454  -1.153  -6.791
  825    HB3  CYS 105           3HB      CYS 105 -52.859  -2.162  -5.390
  826    HG   CYS 105           HG       CYS 105 -49.842  -0.946  -6.062
  827    H    PHE 106           H        PHE 106 -48.997  -3.578  -6.294
  828    HA   PHE 106           HA       PHE 106 -49.431  -5.500  -4.087
  829    HB2  PHE 106           2HB      PHE 106 -48.152  -7.288  -5.276
  830    HB3  PHE 106           3HB      PHE 106 -49.753  -6.970  -5.910
  831    HD1  PHE 106           HD1      PHE 106 -46.108  -6.418  -6.544
  832    HD2  PHE 106           HD2      PHE 106 -50.099  -6.260  -8.178
  833    HE1  PHE 106           HE1      PHE 106 -45.176  -6.032  -8.802
  834    HE2  PHE 106           HE2      PHE 106 -49.158  -5.906 -10.442
  835    HZ   PHE 106           HZ       PHE 106 -46.683  -5.779 -10.760
  836    H    LEU 107           H        LEU 107 -47.599  -6.119  -2.939
  837    HA   LEU 107           HA       LEU 107 -45.194  -4.379  -3.149
  838    HB2  LEU 107           2HB      LEU 107 -46.580  -4.387  -1.046
  839    HB3  LEU 107           3HB      LEU 107 -46.232  -6.084  -0.852
  840    HG   LEU 107           HG       LEU 107 -44.972  -4.643   0.656
  841   HD11  LEU 107          1HD1      LEU 107 -43.882  -6.828  -0.269
  842   HD12  LEU 107          2HD1      LEU 107 -42.834  -5.718  -1.182
  843   HD13  LEU 107          3HD1      LEU 107 -42.857  -5.629   0.562
  844   HD21  LEU 107          3HD2      LEU 107 -43.156  -3.234  -0.011
  845   HD22  LEU 107          1HD2      LEU 107 -43.509  -3.569  -1.715
  846   HD23  LEU 107          2HD2      LEU 107 -44.688  -2.676  -0.693
  847    H    CYS 108           H        CYS 108 -43.252  -5.224  -3.573
  848    HA   CYS 108           HA       CYS 108 -42.659  -8.071  -3.116
  849    HB2  CYS 108           2HB      CYS 108 -42.647  -6.723  -5.814
  850    HB3  CYS 108           3HB      CYS 108 -41.348  -7.869  -5.442
  851    HG   CYS 108           HG       CYS 108 -44.532  -8.486  -4.826
  852    H    LEU 109           H        LEU 109 -40.205  -8.414  -3.401
  853    HA   LEU 109           HA       LEU 109 -38.869  -6.383  -1.772
  854    HB2  LEU 109           2HB      LEU 109 -38.759  -8.813  -1.294
  855    HB3  LEU 109           3HB      LEU 109 -37.918  -9.077  -2.817
  856    HG   LEU 109           HG       LEU 109 -35.973  -7.787  -2.002
  857   HD11  LEU 109          1HD1      LEU 109 -35.862  -7.090   0.387
  858   HD12  LEU 109          2HD1      LEU 109 -37.018  -6.134  -0.540
  859   HD13  LEU 109          3HD1      LEU 109 -37.602  -7.419   0.547
  860   HD21  LEU 109          3HD2      LEU 109 -36.935  -9.841   0.027
  861   HD22  LEU 109          1HD2      LEU 109 -36.136 -10.202  -1.521
  862   HD23  LEU 109          2HD2      LEU 109 -35.253  -9.334  -0.254
  863    H    VAL 110           H        VAL 110 -39.341  -4.927  -3.709
  864    HA   VAL 110           HA       VAL 110 -37.933  -5.107  -6.137
  865    HB   VAL 110           HB       VAL 110 -38.805  -2.566  -4.790
  866   HG11  VAL 110          1HG1      VAL 110 -37.420  -2.133  -6.794
  867   HG12  VAL 110          2HG1      VAL 110 -38.438  -3.255  -7.730
  868   HG13  VAL 110          3HG1      VAL 110 -39.096  -1.725  -7.116
  869   HG21  VAL 110          3HG2      VAL 110 -40.359  -4.455  -6.637
  870   HG22  VAL 110          1HG2      VAL 110 -40.749  -4.087  -4.942
  871   HG23  VAL 110          2HG2      VAL 110 -40.915  -2.840  -6.156
  872    H    ASP 111           H        ASP 111 -36.037  -4.040  -6.977
  873    HA   ASP 111           HA       ASP 111 -33.975  -3.873  -4.805
  874    HB2  ASP 111           2HB      ASP 111 -34.073  -5.720  -6.643
  875    HB3  ASP 111           3HB      ASP 111 -33.337  -4.499  -7.677
  876    H    VAL 112           H        VAL 112 -34.804  -1.602  -4.557
  877    HA   VAL 112           HA       VAL 112 -34.302   0.289  -6.687
  878    HB   VAL 112           HB       VAL 112 -35.082   0.797  -3.784
  879   HG11  VAL 112          1HG1      VAL 112 -34.505   2.862  -5.144
  880   HG12  VAL 112          2HG1      VAL 112 -35.795   2.394  -6.282
  881   HG13  VAL 112          3HG1      VAL 112 -36.184   2.793  -4.603
  882   HG21  VAL 112          3HG2      VAL 112 -36.644  -0.835  -4.718
  883   HG22  VAL 112          1HG2      VAL 112 -37.416   0.747  -4.629
  884   HG23  VAL 112          2HG2      VAL 112 -36.821   0.131  -6.194
  885    H    VAL 113           H        VAL 113 -31.981  -0.394  -6.809
  886    HA   VAL 113           HA       VAL 113 -30.261   1.042  -4.830
  887    HB   VAL 113           HB       VAL 113 -30.171  -1.410  -4.823
  888   HG11  VAL 113          1HG1      VAL 113 -28.655  -1.201  -7.456
  889   HG12  VAL 113          2HG1      VAL 113 -28.937  -2.653  -6.483
  890   HG13  VAL 113          3HG1      VAL 113 -30.301  -1.853  -7.274
  891   HG21  VAL 113          3HG2      VAL 113 -27.749  -1.567  -4.613
  892   HG22  VAL 113          1HG2      VAL 113 -27.542  -0.045  -5.500
  893   HG23  VAL 113          2HG2      VAL 113 -28.346  -0.059  -3.909
  894    HA   PRO 114           HA       PRO 114 -29.078   3.537  -8.333
  895    HB2  PRO 114           2HB      PRO 114 -27.546   5.370  -7.156
  896    HB3  PRO 114           3HB      PRO 114 -29.225   5.154  -6.618
  897    HG2  PRO 114           2HG      PRO 114 -26.749   3.971  -5.338
  898    HG3  PRO 114           3HG      PRO 114 -28.070   4.926  -4.570
  899    HD2  PRO 114           2HD      PRO 114 -28.093   2.202  -4.578
  900    HD3  PRO 114           3HD      PRO 114 -29.584   3.184  -4.715
  901    H    VAL 115           H        VAL 115 -26.828   4.760  -9.149
  902    HA   VAL 115           HA       VAL 115 -24.590   2.793  -9.058
  903    HB   VAL 115           HB       VAL 115 -24.064   3.312 -11.414
  904   HG11  VAL 115          1HG1      VAL 115 -25.630   1.685 -12.337
  905   HG12  VAL 115          2HG1      VAL 115 -25.080   1.188 -10.729
  906   HG13  VAL 115          3HG1      VAL 115 -26.702   1.882 -10.935
  907   HG21  VAL 115          3HG2      VAL 115 -26.913   4.330 -11.590
  908   HG22  VAL 115          1HG2      VAL 115 -25.443   5.320 -11.705
  909   HG23  VAL 115          2HG2      VAL 115 -25.765   4.094 -12.934
  910    H    LYS 116           H        LYS 116 -22.711   3.453  -8.675
  911    HA   LYS 116           HA       LYS 116 -22.111   6.344  -8.359
  912    HB2  LYS 116           2HB      LYS 116 -20.797   3.991  -6.939
  913    HB3  LYS 116           3HB      LYS 116 -20.467   5.676  -6.624
  914    HG2  LYS 116           2HG      LYS 116 -22.698   6.013  -5.702
  915    HG3  LYS 116           3HG      LYS 116 -23.162   4.396  -6.219
  916    HD2  LYS 116           2HD      LYS 116 -21.356   3.457  -4.684
  917    HD3  LYS 116           3HD      LYS 116 -21.049   5.106  -4.150
  918    HE2  LYS 116           2HE      LYS 116 -22.425   4.269  -2.476
  919    HE3  LYS 116           3HE      LYS 116 -23.530   5.218  -3.470
  920    HZ1  LYS 116           HZ1      LYS 116 -23.177   2.259  -3.611
  921    HZ2  LYS 116           HZ2      LYS 116 -24.437   3.010  -2.910
  922    HZ3  LYS 116           HZ3      LYS 116 -24.227   3.105  -4.534
  923    H    ASN 117           H        ASN 117 -19.850   6.758  -8.281
  924    HA   ASN 117           HA       ASN 117 -18.337   5.519 -10.580
  925    HB2  ASN 117           2HB      ASN 117 -17.347   7.533 -11.119
  926    HB3  ASN 117           3HB      ASN 117 -18.995   7.996 -10.778
  927   HD21  ASN 117          2HD2      ASN 117 -19.350   8.931  -8.425
  928   HD22  ASN 117          1HD2      ASN 117 -17.981   9.858  -7.825
  929    H    GLU 118           H        GLU 118 -15.818   6.011 -10.233
  930    HA   GLU 118           HA       GLU 118 -14.990   4.233  -8.183
  931    HB2  GLU 118           2HB      GLU 118 -12.740   4.700  -8.932
  932    HB3  GLU 118           3HB      GLU 118 -13.825   4.508 -10.306
  933    HG2  GLU 118           2HG      GLU 118 -13.927   6.995 -10.560
  934    HG3  GLU 118           3HG      GLU 118 -12.819   7.170  -9.198
  935    H    ASP 119           H        ASP 119 -15.414   7.704  -7.959
  936    HA   ASP 119           HA       ASP 119 -13.854   8.107  -5.566
  937    HB2  ASP 119           2HB      ASP 119 -14.795   9.843  -7.227
  938    HB3  ASP 119           3HB      ASP 119 -16.332   9.652  -6.390
  939    H    GLY 120           H        GLY 120 -16.880   6.467  -6.078
  940    HA2  GLY 120           HA2      GLY 120 -18.145   5.319  -4.497
  941    HA3  GLY 120           HA3      GLY 120 -17.381   6.204  -3.176
  942    H    ALA 121           H        ALA 121 -18.595   8.114  -5.838
  943    HA   ALA 121           HA       ALA 121 -21.003   8.869  -4.246
  944    HB1  ALA 121           3HB      ALA 121 -19.253  10.653  -4.493
  945    HB2  ALA 121           1HB      ALA 121 -19.473  10.569  -6.261
  946    HB3  ALA 121           2HB      ALA 121 -20.811  11.094  -5.226
  947    H    VAL 122           H        VAL 122 -22.954   9.100  -5.086
  948    HA   VAL 122           HA       VAL 122 -23.598   7.450  -7.359
  949    HB   VAL 122           HB       VAL 122 -24.899   7.324  -5.400
  950   HG11  VAL 122          1HG1      VAL 122 -25.990  10.123  -5.853
  951   HG12  VAL 122          2HG1      VAL 122 -26.503   8.950  -4.641
  952   HG13  VAL 122          3HG1      VAL 122 -24.880   9.649  -4.543
  953   HG21  VAL 122          3HG2      VAL 122 -26.587   8.444  -7.658
  954   HG22  VAL 122          1HG2      VAL 122 -25.918   6.808  -7.574
  955   HG23  VAL 122          2HG2      VAL 122 -27.100   7.343  -6.369
  956    H    ILE 123           H        ILE 123 -22.996   8.184  -9.252
  957    HA   ILE 123           HA       ILE 123 -23.618  10.954 -10.039
  958    HB   ILE 123           HB       ILE 123 -22.231  10.834 -11.780
  959   HG12  ILE 123          2HG1      ILE 123 -22.934   8.946 -13.035
  960   HG13  ILE 123          3HG1      ILE 123 -21.201   8.919 -12.832
  961   HG21  ILE 123          1HG2      ILE 123 -20.111  10.109 -10.927
  962   HG22  ILE 123          2HG2      ILE 123 -21.088  10.703  -9.573
  963   HG23  ILE 123          3HG2      ILE 123 -20.890   8.960  -9.816
  964   HD11  ILE 123          3HD1      ILE 123 -21.484   7.146 -11.063
  965   HD12  ILE 123          1HD1      ILE 123 -23.216   7.104 -11.475
  966   HD13  ILE 123          2HD1      ILE 123 -22.016   6.677 -12.686
  967    H    MET 124           H        MET 124 -24.915   7.717 -10.591
  968    HA   MET 124           HA       MET 124 -27.171   9.081 -11.939
  969    HB2  MET 124           2HB      MET 124 -25.562   6.889 -13.205
  970    HB3  MET 124           3HB      MET 124 -27.316   6.807 -13.338
  971    HG2  MET 124           2HG      MET 124 -27.126   8.099 -15.114
  972    HG3  MET 124           3HG      MET 124 -26.890   9.433 -14.003
  973    HE1  MET 124           3HE      MET 124 -25.732  10.894 -15.769
  974    HE2  MET 124           1HE      MET 124 -24.944  10.985 -14.178
  975    HE3  MET 124           2HE      MET 124 -23.953  10.925 -15.650
  976    H    PHE 125           H        PHE 125 -29.058   8.205 -11.856
  977    HA   PHE 125           HA       PHE 125 -29.611   6.371  -9.544
  978    HB2  PHE 125           2HB      PHE 125 -30.939   8.847 -10.642
  979    HB3  PHE 125           3HB      PHE 125 -31.937   7.620  -9.911
  980    HD1  PHE 125           HD2      PHE 125 -29.104   7.358  -7.847
  981    HD2  PHE 125           HD1      PHE 125 -32.288  10.088  -8.869
  982    HE1  PHE 125           HE2      PHE 125 -28.869   8.464  -5.656
  983    HE2  PHE 125           HE1      PHE 125 -31.984  11.222  -6.670
  984    HZ   PHE 125           HZ       PHE 125 -30.257  10.423  -5.086
  985    H    ILE 126           H        ILE 126 -29.110   4.601 -10.878
  986    HA   ILE 126           HA       ILE 126 -31.323   3.897 -12.762
  987    HB   ILE 126           HB       ILE 126 -28.689   2.468 -12.321
  988   HG12  ILE 126          2HG1      ILE 126 -29.624   4.399 -14.485
  989   HG13  ILE 126          3HG1      ILE 126 -28.319   4.665 -13.349
  990   HG21  ILE 126          1HG2      ILE 126 -30.646   2.064 -14.616
  991   HG22  ILE 126          2HG2      ILE 126 -29.293   1.032 -14.118
  992   HG23  ILE 126          3HG2      ILE 126 -30.771   1.106 -13.158
  993   HD11  ILE 126          3HD1      ILE 126 -28.359   2.635 -15.580
  994   HD12  ILE 126          1HD1      ILE 126 -27.351   4.094 -15.427
  995   HD13  ILE 126          2HD1      ILE 126 -27.117   2.707 -14.313
  996    H    LEU 127           H        LEU 127 -32.599   4.050 -10.740
  997    HA   LEU 127           HA       LEU 127 -32.244   1.867  -8.833
  998    HB2  LEU 127           2HB      LEU 127 -34.637   3.696  -9.026
  999    HB3  LEU 127           3HB      LEU 127 -34.108   2.693  -7.702
 1000    HG   LEU 127           HG       LEU 127 -33.250   4.507  -6.825
 1001   HD11  LEU 127          1HD1      LEU 127 -31.184   3.586  -7.297
 1002   HD12  LEU 127          2HD1      LEU 127 -31.039   4.619  -8.754
 1003   HD13  LEU 127          3HD1      LEU 127 -31.209   5.341  -7.138
 1004   HD21  LEU 127          3HD2      LEU 127 -34.529   5.960  -8.230
 1005   HD22  LEU 127          1HD2      LEU 127 -32.934   6.664  -7.977
 1006   HD23  LEU 127          2HD2      LEU 127 -33.312   5.852  -9.525
 1007    H    ASN 128           H        ASN 128 -32.255   0.152 -10.203
 1008    HA   ASN 128           HA       ASN 128 -34.147  -0.682 -12.041
 1009    HB2  ASN 128           2HB      ASN 128 -32.715  -2.571 -10.119
 1010    HB3  ASN 128           3HB      ASN 128 -33.305  -2.949 -11.731
 1011   HD21  ASN 128          2HD2      ASN 128 -30.666  -1.644  -9.875
 1012   HD22  ASN 128          1HD2      ASN 128 -29.656  -1.243 -11.250
 1013    H    PHE 129           H        PHE 129 -36.405  -0.777 -11.774
 1014    HA   PHE 129           HA       PHE 129 -37.437  -1.433  -9.130
 1015    HB2  PHE 129           2HB      PHE 129 -38.962  -0.711 -11.636
 1016    HB3  PHE 129           3HB      PHE 129 -39.555  -0.831  -9.975
 1017    HD1  PHE 129           HD2      PHE 129 -37.656   0.723  -8.366
 1018    HD2  PHE 129           HD1      PHE 129 -39.227   1.505 -12.306
 1019    HE1  PHE 129           HE2      PHE 129 -37.321   3.158  -8.026
 1020    HE2  PHE 129           HE1      PHE 129 -38.917   3.937 -11.947
 1021    HZ   PHE 129           HZ       PHE 129 -37.947   4.766  -9.810
 1022    H    GLU 130           H        GLU 130 -36.198  -3.601  -9.744
 1023    HA   GLU 130           HA       GLU 130 -37.916  -5.450 -11.245
 1024    HB2  GLU 130           2HB      GLU 130 -36.306  -7.162 -10.500
 1025    HB3  GLU 130           3HB      GLU 130 -35.675  -5.834 -11.519
 1026    HG2  GLU 130           2HG      GLU 130 -34.586  -4.801  -9.734
 1027    HG3  GLU 130           3HG      GLU 130 -35.455  -5.724  -8.524
 1028    H    VAL 131           H        VAL 131 -39.669  -5.880 -10.463
 1029    HA   VAL 131           HA       VAL 131 -40.515  -6.500  -7.763
 1030    HB   VAL 131           HB       VAL 131 -41.610  -7.056 -10.525
 1031   HG11  VAL 131          1HG1      VAL 131 -43.073  -7.659  -7.937
 1032   HG12  VAL 131          2HG1      VAL 131 -43.729  -7.768  -9.581
 1033   HG13  VAL 131          3HG1      VAL 131 -42.465  -8.883  -9.076
 1034   HG21  VAL 131          3HG2      VAL 131 -43.280  -5.372  -9.870
 1035   HG22  VAL 131          1HG2      VAL 131 -42.563  -5.252  -8.249
 1036   HG23  VAL 131          2HG2      VAL 131 -41.651  -4.710  -9.672
 1037    H    VAL 132           H        VAL 132 -39.688  -8.139  -6.588
 1038    HA   VAL 132           HA       VAL 132 -39.673 -10.810  -7.801
 1039    HB   VAL 132           HB       VAL 132 -37.408 -10.111  -8.232
 1040   HG11  VAL 132          1HG1      VAL 132 -35.776  -9.647  -6.472
 1041   HG12  VAL 132          2HG1      VAL 132 -37.055  -8.430  -6.485
 1042   HG13  VAL 132          3HG1      VAL 132 -37.055  -9.699  -5.242
 1043   HG21  VAL 132          3HG2      VAL 132 -37.846 -12.479  -7.664
 1044   HG22  VAL 132          1HG2      VAL 132 -36.207 -11.956  -7.248
 1045   HG23  VAL 132          2HG2      VAL 132 -37.419 -12.137  -5.969
 1046    H    MET 133           H        MET 133 -40.235 -12.418  -6.395
 1047    HA   MET 133           HA       MET 133 -41.392 -11.565  -3.849
 1048    HB2  MET 133           2HB      MET 133 -42.507 -13.716  -3.898
 1049    HB3  MET 133           3HB      MET 133 -42.693 -12.883  -5.435
 1050    HG2  MET 133           2HG      MET 133 -40.928 -14.310  -6.438
 1051    HG3  MET 133           3HG      MET 133 -40.677 -15.094  -4.880
 1052    HE1  MET 133           3HE      MET 133 -44.370 -15.691  -7.622
 1053    HE2  MET 133           1HE      MET 133 -44.102 -14.146  -6.793
 1054    HE3  MET 133           2HE      MET 133 -42.947 -14.708  -8.025
 1055    H    GLU 134           H        GLU 134 -41.306 -13.432  -2.166
 1056    HA   GLU 134           HA       GLU 134 -38.713 -13.475  -0.927
 1057    HB2  GLU 134           2HB      GLU 134 -41.190 -15.165  -0.387
 1058    HB3  GLU 134           3HB      GLU 134 -39.760 -15.092   0.651
 1059    HG2  GLU 134           2HG      GLU 134 -40.111 -12.636   0.942
 1060    HG3  GLU 134           3HG      GLU 134 -41.594 -12.747  -0.008
 1061    H    LYS 135           H        LYS 135 -37.451 -15.372  -0.332
 1062    HA   LYS 135           HA       LYS 135 -36.358 -16.607  -2.583
 1063    HB2  LYS 135           2HB      LYS 135 -35.214 -16.124  -0.436
 1064    HB3  LYS 135           3HB      LYS 135 -36.068 -17.482   0.314
 1065    HG2  LYS 135           2HG      LYS 135 -34.991 -19.045  -1.291
 1066    HG3  LYS 135           3HG      LYS 135 -34.178 -17.679  -2.080
 1067    HD2  LYS 135           2HD      LYS 135 -32.985 -17.167   0.036
 1068    HD3  LYS 135           3HD      LYS 135 -33.810 -18.528   0.829
 1069    HE2  LYS 135           2HE      LYS 135 -32.794 -20.093  -0.815
 1070    HE3  LYS 135           3HE      LYS 135 -31.974 -18.739  -1.602
 1071    HZ1  LYS 135           HZ1      LYS 135 -30.506 -19.874  -0.036
 1072    HZ2  LYS 135           HZ2      LYS 135 -30.765 -18.349   0.481
 1073    HZ3  LYS 135           HZ3      LYS 135 -31.525 -19.601   1.208
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1   6.772 -22.957 -18.895
    2    H2   MET   1           2H       MET   1   6.401 -21.588 -19.710
    3    H3   MET   1           3H       MET   1   5.268 -22.334 -18.784
    4    HA   MET   1           HA       MET   1   7.750 -21.128 -17.763
    5    HB2  MET   1           2HB      MET   1   6.394 -19.328 -16.792
    6    HB3  MET   1           3HB      MET   1   6.318 -19.344 -18.546
    7    HG2  MET   1           2HG      MET   1   4.071 -20.429 -18.432
    8    HG3  MET   1           3HG      MET   1   4.162 -20.377 -16.666
    9    HE1  MET   1           3HE      MET   1   1.425 -17.725 -17.304
   10    HE2  MET   1           1HE      MET   1   1.669 -19.253 -18.180
   11    HE3  MET   1           2HE      MET   1   1.912 -19.187 -16.420
   12    HA   PRO   2           HA       PRO   2   6.976 -23.665 -14.291
   13    HB2  PRO   2           2HB      PRO   2   8.583 -22.605 -12.379
   14    HB3  PRO   2           3HB      PRO   2   9.219 -23.285 -13.905
   15    HG2  PRO   2           2HG      PRO   2   8.658 -20.365 -13.273
   16    HG3  PRO   2           3HG      PRO   2  10.153 -21.082 -13.953
   17    HD2  PRO   2           2HD      PRO   2   8.223 -19.964 -15.523
   18    HD3  PRO   2           3HD      PRO   2   9.161 -21.392 -16.053
   19    H    VAL   3           H        VAL   3   5.903 -20.368 -13.989
   20    HA   VAL   3           HA       VAL   3   4.381 -20.944 -11.472
   21    HB   VAL   3           HB       VAL   3   5.986 -18.458 -12.187
   22   HG11  VAL   3          1HG1      VAL   3   4.219 -18.964  -9.750
   23   HG12  VAL   3          2HG1      VAL   3   5.391 -17.641  -9.905
   24   HG13  VAL   3          3HG1      VAL   3   4.009 -17.691 -10.985
   25   HG21  VAL   3          3HG2      VAL   3   7.382 -20.302 -11.306
   26   HG22  VAL   3          1HG2      VAL   3   7.256 -19.004 -10.127
   27   HG23  VAL   3          2HG2      VAL   3   6.290 -20.482  -9.920
   28    H    ARG   4           H        ARG   4   2.455 -19.780 -11.167
   29    HA   ARG   4           HA       ARG   4   0.385 -19.080 -11.742
   30    HB2  ARG   4           2HB      ARG   4   1.896 -17.020 -11.873
   31    HB3  ARG   4           3HB      ARG   4   1.703 -17.115 -13.624
   32    HG2  ARG   4           2HG      ARG   4  -0.781 -16.920 -13.323
   33    HG3  ARG   4           3HG      ARG   4  -0.562 -16.850 -11.574
   34    HD2  ARG   4           2HD      ARG   4   0.605 -14.864 -13.568
   35    HD3  ARG   4           3HD      ARG   4  -0.911 -14.628 -12.681
   36    HE   ARG   4           HE       ARG   4   0.995 -15.146 -10.711
   37   HH11  ARG   4          1HH1      ARG   4   0.571 -12.636 -13.117
   38   HH12  ARG   4          2HH1      ARG   4   1.418 -11.449 -12.161
   39   HH21  ARG   4          2HH2      ARG   4   2.072 -13.589  -9.547
   40   HH22  ARG   4          1HH2      ARG   4   2.239 -11.983 -10.192
   41    H    ARG   5           H        ARG   5   0.916 -21.344 -12.960
   42    HA   ARG   5           HA       ARG   5  -1.121 -21.263 -15.068
   43    HB2  ARG   5           2HB      ARG   5   0.111 -22.954 -16.489
   44    HB3  ARG   5           3HB      ARG   5   0.649 -21.292 -16.562
   45    HG2  ARG   5           2HG      ARG   5   2.519 -22.808 -16.644
   46    HG3  ARG   5           3HG      ARG   5   2.629 -21.784 -15.216
   47    HD2  ARG   5           2HD      ARG   5   2.018 -23.585 -13.759
   48    HD3  ARG   5           3HD      ARG   5   1.500 -24.607 -15.123
   49    HE   ARG   5           HE       ARG   5   4.221 -23.946 -15.524
   50   HH11  ARG   5          1HH1      ARG   5   2.422 -25.794 -13.149
   51   HH12  ARG   5          2HH1      ARG   5   3.729 -26.921 -12.902
   52   HH21  ARG   5          1HH2      ARG   5   5.791 -25.470 -15.247
   53   HH22  ARG   5          2HH2      ARG   5   5.608 -26.718 -14.046
   54    H    GLY   6           H        GLY   6  -2.261 -23.221 -15.385
   55    HA2  GLY   6           HA2      GLY   6  -3.310 -25.156 -14.705
   56    HA3  GLY   6           HA3      GLY   6  -1.897 -25.553 -13.728
   57    H    HIS   7           H        HIS   7  -3.084 -22.511 -12.815
   58    HA   HIS   7           HA       HIS   7  -4.180 -23.514 -10.283
   59    HB2  HIS   7           2HB      HIS   7  -4.042 -21.150  -9.633
   60    HB3  HIS   7           3HB      HIS   7  -2.518 -21.721 -10.303
   61    HD2  HIS   7           HD2      HIS   7  -5.212 -19.105 -10.836
   62    HE1  HIS   7           HE1      HIS   7  -2.581 -18.701 -14.164
   63    HE2  HIS   7           HE2      HIS   7  -4.537 -17.649 -12.925
   64    H    VAL   8           H        VAL   8  -6.143 -22.550  -9.348
   65    HA   VAL   8           HA       VAL   8  -8.423 -22.566 -11.194
   66    HB   VAL   8           HB       VAL   8  -8.439 -21.895  -8.223
   67   HG11  VAL   8          1HG1      VAL   8 -10.802 -22.634  -8.367
   68   HG12  VAL   8          2HG1      VAL   8 -10.513 -21.257  -9.425
   69   HG13  VAL   8          3HG1      VAL   8 -10.625 -22.889 -10.116
   70   HG21  VAL   8          3HG2      VAL   8  -9.148 -24.261  -7.888
   71   HG22  VAL   8          1HG2      VAL   8  -8.806 -24.595  -9.601
   72   HG23  VAL   8          2HG2      VAL   8  -7.494 -24.153  -8.486
   73    H    ALA   9           H        ALA   9  -9.372 -20.811 -12.096
   74    HA   ALA   9           HA       ALA   9  -8.247 -18.185 -12.010
   75    HB1  ALA   9           3HB      ALA   9 -11.011 -19.144 -12.875
   76    HB2  ALA   9           1HB      ALA   9 -10.274 -17.588 -13.302
   77    HB3  ALA   9           2HB      ALA   9  -9.554 -19.093 -13.896
   78    HA   PRO  10           HA       PRO  10 -10.061 -16.166  -8.473
   79    HB2  PRO  10           2HB      PRO  10 -11.081 -14.064 -10.369
   80    HB3  PRO  10           3HB      PRO  10 -10.222 -13.858  -8.817
   81    HG2  PRO  10           2HG      PRO  10  -8.891 -13.599 -11.174
   82    HG3  PRO  10           3HG      PRO  10  -8.139 -14.462  -9.794
   83    HD2  PRO  10           2HD      PRO  10  -9.444 -15.645 -12.252
   84    HD3  PRO  10           3HD      PRO  10  -7.983 -16.155 -11.367
   85    H    GLN  11           H        GLN  11 -11.698 -17.195  -7.610
   86    HA   GLN  11           HA       GLN  11 -13.844 -18.246  -9.085
   87    HB2  GLN  11           2HB      GLN  11 -14.554 -19.304  -7.118
   88    HB3  GLN  11           3HB      GLN  11 -12.801 -19.276  -7.095
   89    HG2  GLN  11           2HG      GLN  11 -14.688 -17.516  -5.469
   90    HG3  GLN  11           3HG      GLN  11 -13.728 -18.870  -4.883
   91   HE21  GLN  11          2HE2      GLN  11 -13.797 -15.741  -4.374
   92   HE22  GLN  11          1HE2      GLN  11 -12.068 -15.394  -4.355
   93    H    ASN  12           H        ASN  12 -13.730 -15.212  -7.354
   94    HA   ASN  12           HA       ASN  12 -16.578 -14.835  -7.035
   95    HB2  ASN  12           2HB      ASN  12 -14.143 -12.987  -6.979
   96    HB3  ASN  12           3HB      ASN  12 -15.787 -12.367  -6.868
   97   HD21  ASN  12          2HD2      ASN  12 -14.707 -11.580  -4.768
   98   HD22  ASN  12          1HD2      ASN  12 -14.945 -12.643  -3.388
   99    H    THR  13           H        THR  13 -14.254 -13.651  -9.515
  100    HA   THR  13           HA       THR  13 -16.348 -12.479 -11.159
  101    HB   THR  13           HB       THR  13 -13.873 -11.829 -10.952
  102    HG1  THR  13           HG1      THR  13 -13.990 -10.951 -13.019
  103   HG21  THR  13          1HG2      THR  13 -12.334 -12.698 -12.576
  104   HG22  THR  13          2HG2      THR  13 -12.970 -14.059 -11.637
  105   HG23  THR  13          3HG2      THR  13 -13.577 -13.773 -13.271
  106    H    PHE  14           H        PHE  14 -14.531 -15.552 -11.223
  107    HA   PHE  14           HA       PHE  14 -15.552 -16.635 -13.633
  108    HB2  PHE  14           2HB      PHE  14 -13.723 -17.537 -12.197
  109    HB3  PHE  14           3HB      PHE  14 -14.912 -18.016 -11.001
  110    HD1  PHE  14           HD2      PHE  14 -13.613 -18.687 -14.416
  111    HD2  PHE  14           HD1      PHE  14 -16.299 -20.002 -11.307
  112    HE1  PHE  14           HE2      PHE  14 -13.919 -20.855 -15.594
  113    HE2  PHE  14           HE1      PHE  14 -16.604 -22.167 -12.488
  114    HZ   PHE  14           HZ       PHE  14 -15.415 -22.595 -14.631
  115    H    LEU  15           H        LEU  15 -16.914 -16.575 -10.345
  116    HA   LEU  15           HA       LEU  15 -19.402 -17.886 -11.117
  117    HB2  LEU  15           2HB      LEU  15 -18.718 -18.025  -8.818
  118    HB3  LEU  15           3HB      LEU  15 -18.643 -16.265  -8.670
  119    HG   LEU  15           HG       LEU  15 -21.059 -16.077  -8.953
  120   HD11  LEU  15          1HD1      LEU  15 -21.162 -19.129  -8.988
  121   HD12  LEU  15          2HD1      LEU  15 -22.554 -18.004  -8.999
  122   HD13  LEU  15          3HD1      LEU  15 -21.479 -18.091 -10.382
  123   HD21  LEU  15          3HD2      LEU  15 -20.307 -18.138  -6.845
  124   HD22  LEU  15          1HD2      LEU  15 -20.140 -16.374  -6.695
  125   HD23  LEU  15          2HD2      LEU  15 -21.751 -17.098  -6.831
  126    H    ASP  16           H        ASP  16 -18.570 -14.402 -10.620
  127    HA   ASP  16           HA       ASP  16 -20.939 -13.154 -11.218
  128    HB2  ASP  16           2HB      ASP  16 -18.617 -12.190 -10.719
  129    HB3  ASP  16           3HB      ASP  16 -18.320 -12.261 -12.456
  130    H    THR  17           H        THR  17 -18.758 -14.630 -13.630
  131    HA   THR  17           HA       THR  17 -20.266 -13.866 -15.981
  132    HB   THR  17           HB       THR  17 -18.554 -16.355 -15.563
  133    HG1  THR  17           HG1      THR  17 -17.900 -13.792 -16.605
  134   HG21  THR  17          1HG2      THR  17 -19.854 -16.589 -17.614
  135   HG22  THR  17          2HG2      THR  17 -19.429 -14.939 -18.119
  136   HG23  THR  17          3HG2      THR  17 -18.181 -16.204 -18.029
  137    H    ILE  18           H        ILE  18 -20.598 -16.606 -13.762
  138    HA   ILE  18           HA       ILE  18 -22.664 -17.953 -15.324
  139    HB   ILE  18           HB       ILE  18 -21.927 -18.286 -12.415
  140   HG12  ILE  18          2HG1      ILE  18 -19.927 -18.696 -13.715
  141   HG13  ILE  18          3HG1      ILE  18 -20.522 -20.139 -12.936
  142   HG21  ILE  18          1HG2      ILE  18 -22.852 -20.614 -12.716
  143   HG22  ILE  18          2HG2      ILE  18 -24.039 -19.318 -12.797
  144   HG23  ILE  18          3HG2      ILE  18 -23.484 -20.089 -14.295
  145   HD11  ILE  18          3HD1      ILE  18 -20.905 -19.404 -15.895
  146   HD12  ILE  18          1HD1      ILE  18 -19.704 -20.545 -15.263
  147   HD13  ILE  18          2HD1      ILE  18 -21.430 -20.927 -15.137
  148    H    ILE  19           H        ILE  19 -22.567 -15.560 -12.664
  149    HA   ILE  19           HA       ILE  19 -25.356 -15.515 -12.158
  150    HB   ILE  19           HB       ILE  19 -23.515 -13.092 -12.209
  151   HG12  ILE  19          2HG1      ILE  19 -22.514 -14.577 -10.630
  152   HG13  ILE  19          3HG1      ILE  19 -23.378 -13.356  -9.727
  153   HG21  ILE  19          1HG2      ILE  19 -25.846 -12.445 -12.236
  154   HG22  ILE  19          2HG2      ILE  19 -26.224 -13.572 -10.923
  155   HG23  ILE  19          3HG2      ILE  19 -25.196 -12.152 -10.620
  156   HD11  ILE  19          3HD1      ILE  19 -24.225 -16.235 -10.213
  157   HD12  ILE  19          1HD1      ILE  19 -23.691 -15.506  -8.691
  158   HD13  ILE  19          2HD1      ILE  19 -25.257 -15.024  -9.410
  159    H    ARG  20           H        ARG  20 -23.403 -13.534 -14.495
  160    HA   ARG  20           HA       ARG  20 -25.612 -12.426 -15.921
  161    HB2  ARG  20           2HB      ARG  20 -22.638 -12.843 -16.378
  162    HB3  ARG  20           3HB      ARG  20 -23.650 -12.467 -17.761
  163    HG2  ARG  20           2HG      ARG  20 -23.060 -10.391 -17.157
  164    HG3  ARG  20           3HG      ARG  20 -24.615 -10.508 -16.347
  165    HD2  ARG  20           2HD      ARG  20 -22.075 -11.191 -14.832
  166    HD3  ARG  20           3HD      ARG  20 -22.435  -9.504 -15.197
  167    HE   ARG  20           HE       ARG  20 -24.787 -10.712 -14.107
  168   HH11  ARG  20          1HH2      ARG  20 -21.680  -9.626 -12.878
  169   HH12  ARG  20          2HH2      ARG  20 -22.422  -8.860 -11.511
  170   HH21  ARG  20          2HH1      ARG  20 -25.613  -9.739 -12.452
  171   HH22  ARG  20          1HH1      ARG  20 -24.624  -8.969 -11.210
  172    H    LYS  21           H        LYS  21 -24.213 -15.618 -16.186
  173    HA   LYS  21           HA       LYS  21 -25.569 -16.353 -18.642
  174    HB2  LYS  21           2HB      LYS  21 -23.618 -17.581 -17.350
  175    HB3  LYS  21           3HB      LYS  21 -24.946 -18.350 -16.466
  176    HG2  LYS  21           2HG      LYS  21 -24.393 -19.850 -18.171
  177    HG3  LYS  21           3HG      LYS  21 -25.888 -19.081 -18.713
  178    HD2  LYS  21           2HD      LYS  21 -24.525 -17.572 -20.205
  179    HD3  LYS  21           3HD      LYS  21 -23.055 -18.327 -19.581
  180    HE2  LYS  21           2HE      LYS  21 -23.499 -19.307 -21.708
  181    HE3  LYS  21           3HE      LYS  21 -23.818 -20.530 -20.477
  182    HZ1  LYS  21           HZ1      LYS  21 -26.202 -20.061 -20.731
  183    HZ2  LYS  21           HZ2      LYS  21 -25.901 -18.901 -21.846
  184    HZ3  LYS  21           HZ3      LYS  21 -25.563 -20.461 -22.176
  185    H    PHE  22           H        PHE  22 -26.565 -16.775 -15.197
  186    HA   PHE  22           HA       PHE  22 -29.240 -17.639 -16.186
  187    HB2  PHE  22           2HB      PHE  22 -29.654 -18.663 -14.125
  188    HB3  PHE  22           3HB      PHE  22 -28.077 -19.153 -14.686
  189    HD1  PHE  22           HD2      PHE  22 -29.779 -16.792 -12.261
  190    HD2  PHE  22           HD1      PHE  22 -26.263 -19.096 -13.199
  191    HE1  PHE  22           HE2      PHE  22 -28.852 -16.274 -10.032
  192    HE2  PHE  22           HE1      PHE  22 -25.343 -18.594 -10.940
  193    HZ   PHE  22           HZ       PHE  22 -26.636 -17.181  -9.358
  194    H    GLU  23           H        GLU  23 -27.977 -14.759 -15.280
  195    HA   GLU  23           HA       GLU  23 -29.302 -13.594 -13.333
  196    HB2  GLU  23           2HB      GLU  23 -27.508 -12.589 -14.588
  197    HB3  GLU  23           3HB      GLU  23 -28.519 -12.360 -15.999
  198    HG2  GLU  23           2HG      GLU  23 -29.732 -10.584 -14.932
  199    HG3  GLU  23           3HG      GLU  23 -29.097 -11.024 -13.334
  200    H    GLY  24           H        GLY  24 -30.952 -14.155 -16.422
  201    HA2  GLY  24           HA2      GLY  24 -33.202 -13.924 -16.979
  202    HA3  GLY  24           HA3      GLY  24 -33.539 -13.541 -15.287
  203    H    GLN  25           H        GLN  25 -31.802 -11.991 -17.998
  204    HA   GLN  25           HA       GLN  25 -32.006  -9.363 -17.034
  205    HB2  GLN  25           2HB      GLN  25 -31.198 -10.476 -19.740
  206    HB3  GLN  25           3HB      GLN  25 -31.050  -8.767 -19.296
  207    HG2  GLN  25           2HG      GLN  25 -29.692  -9.398 -17.311
  208    HG3  GLN  25           3HG      GLN  25 -29.698 -11.081 -17.841
  209   HE21  GLN  25          2HE2      GLN  25 -27.373  -9.422 -17.417
  210   HE22  GLN  25          1HE2      GLN  25 -26.557  -9.311 -18.990
  211    H    SER  26           H        SER  26 -34.686 -10.807 -17.919
  212    HA   SER  26           HA       SER  26 -36.027  -8.611 -19.346
  213    HB2  SER  26           2HB      SER  26 -38.074  -9.921 -18.837
  214    HB3  SER  26           3HB      SER  26 -36.844 -10.858 -19.701
  215    HG   SER  26           HG       SER  26 -37.742 -12.023 -17.928
  216    H    ARG  27           H        ARG  27 -34.640  -8.786 -16.413
  217    HA   ARG  27           HA       ARG  27 -36.388  -7.628 -14.512
  218    HB2  ARG  27           2HB      ARG  27 -33.455  -6.965 -14.861
  219    HB3  ARG  27           3HB      ARG  27 -34.448  -6.738 -13.421
  220    HG2  ARG  27           2HG      ARG  27 -34.852  -9.442 -13.925
  221    HG3  ARG  27           3HG      ARG  27 -33.198  -9.177 -14.518
  222    HD2  ARG  27           2HD      ARG  27 -32.855  -7.980 -12.248
  223    HD3  ARG  27           3HD      ARG  27 -34.313  -8.835 -11.730
  224    HE   ARG  27           HE       ARG  27 -32.653 -10.758 -12.977
  225   HH11  ARG  27          2HH2      ARG  27 -32.554  -8.972  -9.918
  226   HH12  ARG  27          1HH2      ARG  27 -31.454 -10.142  -9.239
  227   HH21  ARG  27          1HH1      ARG  27 -31.350 -12.126 -12.042
  228   HH22  ARG  27          2HH1      ARG  27 -30.822 -11.919 -10.380
  229    H    LYS  28           H        LYS  28 -36.398  -5.394 -13.720
  230    HA   LYS  28           HA       LYS  28 -36.979  -3.556 -16.027
  231    HB2  LYS  28           2HB      LYS  28 -38.525  -3.706 -13.414
  232    HB3  LYS  28           3HB      LYS  28 -38.907  -2.764 -14.830
  233    HG2  LYS  28           2HG      LYS  28 -40.287  -4.448 -15.336
  234    HG3  LYS  28           3HG      LYS  28 -38.863  -5.244 -15.984
  235    HD2  LYS  28           2HD      LYS  28 -38.645  -6.485 -13.789
  236    HD3  LYS  28           3HD      LYS  28 -40.033  -5.571 -13.182
  237    HE2  LYS  28           2HE      LYS  28 -41.125  -7.467 -13.869
  238    HE3  LYS  28           3HE      LYS  28 -41.282  -6.465 -15.305
  239    HZ1  LYS  28           HZ1      LYS  28 -40.554  -8.649 -15.959
  240    HZ2  LYS  28           HZ2      LYS  28 -39.263  -7.674 -16.199
  241    HZ3  LYS  28           HZ3      LYS  28 -39.319  -8.664 -14.902
  242    H    PHE  29           H        PHE  29 -36.592  -1.350 -15.874
  243    HA   PHE  29           HA       PHE  29 -35.563  -0.079 -13.501
  244    HB2  PHE  29           2HB      PHE  29 -33.243   0.200 -14.178
  245    HB3  PHE  29           3HB      PHE  29 -33.609  -1.492 -14.003
  246    HD1  PHE  29           HD2      PHE  29 -33.725  -3.007 -15.968
  247    HD2  PHE  29           HD1      PHE  29 -32.583   1.138 -16.334
  248    HE1  PHE  29           HE2      PHE  29 -32.724  -3.479 -18.188
  249    HE2  PHE  29           HE1      PHE  29 -31.576   0.656 -18.557
  250    HZ   PHE  29           HZ       PHE  29 -31.645  -1.649 -19.483
  251    H    ILE  30           H        ILE  30 -34.786   1.980 -13.743
  252    HA   ILE  30           HA       ILE  30 -35.415   3.503 -16.213
  253    HB   ILE  30           HB       ILE  30 -35.778   5.454 -14.513
  254   HG12  ILE  30          2HG1      ILE  30 -36.911   4.896 -12.446
  255   HG13  ILE  30          3HG1      ILE  30 -36.605   3.177 -12.666
  256   HG21  ILE  30          1HG2      ILE  30 -38.158   5.001 -14.557
  257   HG22  ILE  30          2HG2      ILE  30 -37.372   4.549 -16.087
  258   HG23  ILE  30          3HG2      ILE  30 -37.832   3.287 -14.911
  259   HD11  ILE  30          3HD1      ILE  30 -35.097   4.322 -11.020
  260   HD12  ILE  30          1HD1      ILE  30 -34.204   3.509 -12.315
  261   HD13  ILE  30          2HD1      ILE  30 -34.422   5.282 -12.345
  262    H    ILE  31           H        ILE  31 -34.298   5.589 -16.267
  263    HA   ILE  31           HA       ILE  31 -31.634   5.589 -14.943
  264    HB   ILE  31           HB       ILE  31 -32.171   6.791 -17.659
  265   HG12  ILE  31          2HG1      ILE  31 -32.646   4.361 -17.895
  266   HG13  ILE  31          3HG1      ILE  31 -31.247   4.915 -18.834
  267   HG21  ILE  31          1HG2      ILE  31 -29.699   6.713 -17.816
  268   HG22  ILE  31          2HG2      ILE  31 -30.265   7.643 -16.418
  269   HG23  ILE  31          3HG2      ILE  31 -29.631   6.017 -16.175
  270   HD11  ILE  31          3HD1      ILE  31 -29.686   3.959 -17.344
  271   HD12  ILE  31          1HD1      ILE  31 -30.928   3.678 -16.108
  272   HD13  ILE  31          2HD1      ILE  31 -30.930   2.723 -17.617
  273    H    ALA  32           H        ALA  32 -31.560   7.176 -13.621
  274    HA   ALA  32           HA       ALA  32 -32.904   9.753 -14.344
  275    HB1  ALA  32           3HB      ALA  32 -34.337   8.762 -12.706
  276    HB2  ALA  32           1HB      ALA  32 -32.975   8.391 -11.640
  277    HB3  ALA  32           2HB      ALA  32 -33.438  10.073 -11.897
  278    H    ASN  33           H        ASN  33 -32.124  11.697 -13.519
  279    HA   ASN  33           HA       ASN  33 -29.184  11.684 -13.191
  280    HB2  ASN  33           2HB      ASN  33 -29.479  14.213 -13.091
  281    HB3  ASN  33           3HB      ASN  33 -29.757  13.392 -14.604
  282   HD21  ASN  33          2HD2      ASN  33 -30.781  15.453 -15.168
  283   HD22  ASN  33          1HD2      ASN  33 -32.478  15.626 -14.752
  284    H    ALA  34           H        ALA  34 -28.321  11.164 -11.313
  285    HA   ALA  34           HA       ALA  34 -29.675  11.422  -8.782
  286    HB1  ALA  34           3HB      ALA  34 -27.553  10.576  -7.851
  287    HB2  ALA  34           1HB      ALA  34 -28.001   9.649  -9.291
  288    HB3  ALA  34           2HB      ALA  34 -26.729  10.890  -9.375
  289    H    ARG  35           H        ARG  35 -27.951  13.699 -10.594
  290    HA   ARG  35           HA       ARG  35 -26.895  15.179  -8.237
  291    HB2  ARG  35           2HB      ARG  35 -26.284  15.718 -11.152
  292    HB3  ARG  35           3HB      ARG  35 -25.399  16.268  -9.738
  293    HG2  ARG  35           2HG      ARG  35 -25.485  13.494 -10.947
  294    HG3  ARG  35           3HG      ARG  35 -24.105  14.555 -10.739
  295    HD2  ARG  35           2HD      ARG  35 -25.567  12.980  -8.586
  296    HD3  ARG  35           3HD      ARG  35 -23.936  12.722  -9.201
  297    HE   ARG  35           HE       ARG  35 -23.976  15.332  -8.158
  298   HH11  ARG  35          1HH1      ARG  35 -24.228  12.040  -6.927
  299   HH12  ARG  35          2HH1      ARG  35 -23.709  12.521  -5.330
  300   HH21  ARG  35          1HH2      ARG  35 -23.283  15.840  -6.103
  301   HH22  ARG  35          2HH2      ARG  35 -23.148  14.598  -4.895
  302    H    VAL  36           H        VAL  36 -29.777  15.324  -9.640
  303    HA   VAL  36           HA       VAL  36 -29.972  18.300  -9.547
  304    HB   VAL  36           HB       VAL  36 -30.236  16.964 -11.804
  305   HG11  VAL  36          1HG1      VAL  36 -32.523  16.448 -12.399
  306   HG12  VAL  36          2HG1      VAL  36 -32.029  15.433 -11.023
  307   HG13  VAL  36          3HG1      VAL  36 -33.100  16.837 -10.790
  308   HG21  VAL  36          3HG2      VAL  36 -31.656  18.680 -12.678
  309   HG22  VAL  36          1HG2      VAL  36 -32.169  19.164 -11.038
  310   HG23  VAL  36          2HG2      VAL  36 -30.474  19.369 -11.557
  311    H    GLU  37           H        GLU  37 -31.615  19.224  -8.377
  312    HA   GLU  37           HA       GLU  37 -32.595  17.807  -6.147
  313    HB2  GLU  37           2HB      GLU  37 -33.820  19.825  -5.618
  314    HB3  GLU  37           3HB      GLU  37 -32.197  20.208  -6.194
  315    HG2  GLU  37           2HG      GLU  37 -33.152  20.781  -8.436
  316    HG3  GLU  37           3HG      GLU  37 -34.769  20.438  -7.819
  317    H    ASN  38           H        ASN  38 -34.107  18.125  -9.259
  318    HA   ASN  38           HA       ASN  38 -36.744  17.205  -8.375
  319    HB2  ASN  38           2HB      ASN  38 -36.273  18.827 -10.283
  320    HB3  ASN  38           3HB      ASN  38 -35.631  17.460 -11.197
  321   HD21  ASN  38          2HD2      ASN  38 -37.246  17.627 -12.832
  322   HD22  ASN  38          1HD2      ASN  38 -38.927  17.249 -12.493
  323    H    CYS  39           H        CYS  39 -33.812  15.575  -9.037
  324    HA   CYS  39           HA       CYS  39 -33.209  13.472  -9.705
  325    HB2  CYS  39           2HB      CYS  39 -35.451  12.723  -7.797
  326    HB3  CYS  39           3HB      CYS  39 -33.963  11.829  -8.127
  327    HG   CYS  39           HG       CYS  39 -32.522  14.198  -7.429
  328    H    ALA  40           H        ALA  40 -34.337  14.046 -11.968
  329    HA   ALA  40           HA       ALA  40 -36.818  12.503 -12.353
  330    HB1  ALA  40           3HB      ALA  40 -36.830  14.878 -12.902
  331    HB2  ALA  40           1HB      ALA  40 -35.568  14.608 -14.133
  332    HB3  ALA  40           2HB      ALA  40 -37.179  13.868 -14.304
  333    H    VAL  41           H        VAL  41 -37.278  11.285 -14.141
  334    HA   VAL  41           HA       VAL  41 -35.301   9.312 -14.863
  335    HB   VAL  41           HB       VAL  41 -38.243   9.641 -15.588
  336   HG11  VAL  41          1HG1      VAL  41 -36.409   7.227 -15.880
  337   HG12  VAL  41          2HG1      VAL  41 -38.171   7.214 -16.120
  338   HG13  VAL  41          3HG1      VAL  41 -37.143   8.135 -17.214
  339   HG21  VAL  41          3HG2      VAL  41 -37.875   9.308 -13.157
  340   HG22  VAL  41          1HG2      VAL  41 -38.647   7.916 -13.902
  341   HG23  VAL  41          2HG2      VAL  41 -36.911   7.857 -13.501
  342    H    ILE  42           H        ILE  42 -33.831  10.362 -16.138
  343    HA   ILE  42           HA       ILE  42 -34.474  11.865 -18.534
  344    HB   ILE  42           HB       ILE  42 -32.050  11.713 -18.974
  345   HG12  ILE  42          2HG1      ILE  42 -31.907  10.032 -16.426
  346   HG13  ILE  42          3HG1      ILE  42 -31.670   9.412 -18.065
  347   HG21  ILE  42          1HG2      ILE  42 -31.366  13.109 -17.115
  348   HG22  ILE  42          2HG2      ILE  42 -33.064  13.445 -17.455
  349   HG23  ILE  42          3HG2      ILE  42 -32.625  12.432 -16.064
  350   HD11  ILE  42          3HD1      ILE  42 -29.919  11.370 -16.571
  351   HD12  ILE  42          1HD1      ILE  42 -29.552   9.710 -17.070
  352   HD13  ILE  42          2HD1      ILE  42 -29.736  10.968 -18.309
  353    H    TYR  43           H        TYR  43 -34.156   8.473 -17.832
  354    HA   TYR  43           HA       TYR  43 -35.084   7.814 -20.515
  355    HB2  TYR  43           2HB      TYR  43 -32.547   7.972 -20.813
  356    HB3  TYR  43           3HB      TYR  43 -32.409   6.608 -19.760
  357    HD1  TYR  43           HD1      TYR  43 -33.856   7.740 -22.998
  358    HD2  TYR  43           HD2      TYR  43 -32.706   4.364 -20.567
  359    HE1  TYR  43           HE1      TYR  43 -34.150   6.218 -24.955
  360    HE2  TYR  43           HE2      TYR  43 -32.972   2.858 -22.521
  361    HH   TYR  43           HH       TYR  43 -33.412   2.716 -24.771
  362    H    CYS  44           H        CYS  44 -35.637   5.505 -20.802
  363    HA   CYS  44           HA       CYS  44 -36.139   4.112 -18.234
  364    HB2  CYS  44           2HB      CYS  44 -38.563   3.938 -18.885
  365    HB3  CYS  44           3HB      CYS  44 -38.039   5.585 -18.474
  366    HG   CYS  44           HG       CYS  44 -37.908   4.349 -21.523
  367    H    ASN  45           H        ASN  45 -36.284   1.873 -18.343
  368    HA   ASN  45           HA       ASN  45 -35.860   0.668 -20.996
  369    HB2  ASN  45           2HB      ASN  45 -34.623  -0.065 -18.925
  370    HB3  ASN  45           3HB      ASN  45 -36.121  -0.809 -18.366
  371   HD21  ASN  45          2HD2      ASN  45 -35.799  -3.042 -18.701
  372   HD22  ASN  45          1HD2      ASN  45 -35.227  -3.695 -20.216
  373    H    ASP  46           H        ASP  46 -37.140  -0.946 -21.881
  374    HA   ASP  46           HA       ASP  46 -39.975  -0.453 -21.886
  375    HB2  ASP  46           2HB      ASP  46 -38.641  -1.343 -23.793
  376    HB3  ASP  46           3HB      ASP  46 -38.400  -2.849 -22.905
  377    H    GLY  47           H        GLY  47 -37.934  -2.794 -20.141
  378    HA2  GLY  47           HA2      GLY  47 -39.825  -4.492 -18.980
  379    HA3  GLY  47           HA3      GLY  47 -38.354  -3.920 -18.177
  380    H    PHE  48           H        PHE  48 -38.813  -1.251 -17.612
  381    HA   PHE  48           HA       PHE  48 -40.753  -1.470 -15.495
  382    HB2  PHE  48           2HB      PHE  48 -39.390  -0.029 -14.617
  383    HB3  PHE  48           3HB      PHE  48 -38.628   0.325 -16.142
  384    HD1  PHE  48           HD1      PHE  48 -41.227   1.367 -13.768
  385    HD2  PHE  48           HD2      PHE  48 -39.219   2.349 -17.454
  386    HE1  PHE  48           HE1      PHE  48 -42.026   3.696 -13.565
  387    HE2  PHE  48           HE2      PHE  48 -39.983   4.704 -17.205
  388    HZ   PHE  48           HZ       PHE  48 -41.376   5.381 -15.274
  389    H    CYS  49           H        CYS  49 -40.894  -0.283 -18.747
  390    HA   CYS  49           HA       CYS  49 -43.336   1.255 -18.588
  391    HB2  CYS  49           2HB      CYS  49 -41.605   1.248 -20.469
  392    HB3  CYS  49           3HB      CYS  49 -42.291  -0.311 -20.978
  393    HG   CYS  49           HG       CYS  49 -43.279   1.424 -22.550
  394    H    GLU  50           H        GLU  50 -42.611  -2.246 -19.063
  395    HA   GLU  50           HA       GLU  50 -45.462  -2.982 -19.170
  396    HB2  GLU  50           2HB      GLU  50 -43.009  -4.729 -18.752
  397    HB3  GLU  50           3HB      GLU  50 -44.648  -5.275 -19.122
  398    HG2  GLU  50           2HG      GLU  50 -44.545  -3.948 -21.269
  399    HG3  GLU  50           3HG      GLU  50 -42.842  -3.644 -20.944
  400    H    LEU  51           H        LEU  51 -42.988  -2.756 -16.659
  401    HA   LEU  51           HA       LEU  51 -44.230  -4.134 -14.541
  402    HB2  LEU  51           2HB      LEU  51 -41.947  -3.256 -14.539
  403    HB3  LEU  51           3HB      LEU  51 -42.573  -1.613 -14.547
  404    HG   LEU  51           HG       LEU  51 -43.561  -1.821 -12.384
  405   HD11  LEU  51          1HD1      LEU  51 -42.897  -3.665 -10.892
  406   HD12  LEU  51          2HD1      LEU  51 -43.873  -4.261 -12.239
  407   HD13  LEU  51          3HD1      LEU  51 -42.107  -4.500 -12.250
  408   HD21  LEU  51          3HD2      LEU  51 -41.351  -0.833 -12.648
  409   HD22  LEU  51          1HD2      LEU  51 -41.419  -1.755 -11.139
  410   HD23  LEU  51          2HD2      LEU  51 -40.589  -2.439 -12.556
  411    H    CYS  52           H        CYS  52 -44.482  -0.618 -15.318
  412    HA   CYS  52           HA       CYS  52 -46.861  -0.354 -13.584
  413    HB2  CYS  52           2HB      CYS  52 -45.327   1.676 -15.256
  414    HB3  CYS  52           3HB      CYS  52 -46.641   2.038 -14.121
  415    HG   CYS  52           HG       CYS  52 -45.503   1.048 -11.990
  416    H    GLY  53           H        GLY  53 -46.259  -0.824 -16.978
  417    HA2  GLY  53           HA2      GLY  53 -47.783  -1.362 -18.642
  418    HA3  GLY  53           HA3      GLY  53 -49.125  -1.070 -17.536
  419    H    TYR  54           H        TYR  54 -46.563   1.262 -18.446
  420    HA   TYR  54           HA       TYR  54 -48.680   3.155 -19.408
  421    HB2  TYR  54           2HB      TYR  54 -45.863   3.719 -18.448
  422    HB3  TYR  54           3HB      TYR  54 -47.078   4.918 -18.884
  423    HD1  TYR  54           HD1      TYR  54 -49.456   3.461 -17.378
  424    HD2  TYR  54           HD2      TYR  54 -45.458   4.683 -16.296
  425    HE1  TYR  54           HE1      TYR  54 -50.170   3.719 -15.013
  426    HE2  TYR  54           HE2      TYR  54 -46.189   4.972 -13.939
  427    HH   TYR  54           HH       TYR  54 -47.928   4.832 -12.452
  428    H    SER  55           H        SER  55 -46.026   4.556 -20.462
  429    HA   SER  55           HA       SER  55 -45.353   3.209 -22.958
  430    HB2  SER  55           2HB      SER  55 -47.050   5.737 -22.924
  431    HB3  SER  55           3HB      SER  55 -46.025   5.282 -24.295
  432    HG   SER  55           HG       SER  55 -48.194   4.578 -24.548
  433    H    ARG  56           H        ARG  56 -43.391   4.115 -23.749
  434    HA   ARG  56           HA       ARG  56 -41.772   5.245 -21.684
  435    HB2  ARG  56           2HB      ARG  56 -41.083   4.903 -24.619
  436    HB3  ARG  56           3HB      ARG  56 -39.955   5.279 -23.313
  437    HG2  ARG  56           2HG      ARG  56 -41.039   3.111 -22.175
  438    HG3  ARG  56           3HG      ARG  56 -41.459   2.709 -23.841
  439    HD2  ARG  56           2HD      ARG  56 -38.705   3.155 -22.646
  440    HD3  ARG  56           3HD      ARG  56 -39.375   1.632 -23.217
  441    HE   ARG  56           HE       ARG  56 -39.451   2.932 -25.518
  442   HH11  ARG  56          1HH1      ARG  56 -36.770   3.050 -23.192
  443   HH12  ARG  56          2HH1      ARG  56 -35.633   3.391 -24.468
  444   HH21  ARG  56          1HH2      ARG  56 -37.874   3.373 -27.029
  445   HH22  ARG  56          2HH2      ARG  56 -36.218   3.544 -26.524
  446    H    ALA  57           H        ALA  57 -43.166   6.813 -24.505
  447    HA   ALA  57           HA       ALA  57 -42.000   9.399 -24.185
  448    HB1  ALA  57           3HB      ALA  57 -43.111   8.596 -26.240
  449    HB2  ALA  57           1HB      ALA  57 -44.675   8.559 -25.391
  450    HB3  ALA  57           2HB      ALA  57 -43.845  10.106 -25.667
  451    H    GLU  58           H        GLU  58 -44.405   7.810 -22.223
  452    HA   GLU  58           HA       GLU  58 -45.533  10.317 -21.147
  453    HB2  GLU  58           2HB      GLU  58 -46.119   7.425 -20.424
  454    HB3  GLU  58           3HB      GLU  58 -47.005   8.832 -19.897
  455    HG2  GLU  58           2HG      GLU  58 -46.785   8.033 -22.835
  456    HG3  GLU  58           3HG      GLU  58 -48.038   7.456 -21.768
  457    H    VAL  59           H        VAL  59 -42.925   8.076 -20.432
  458    HA   VAL  59           HA       VAL  59 -42.938   8.871 -17.546
  459    HB   VAL  59           HB       VAL  59 -41.074   7.208 -17.286
  460   HG11  VAL  59          1HG1      VAL  59 -43.832   6.313 -18.268
  461   HG12  VAL  59          2HG1      VAL  59 -42.709   5.297 -17.359
  462   HG13  VAL  59          3HG1      VAL  59 -43.390   6.748 -16.603
  463   HG21  VAL  59          3HG2      VAL  59 -42.080   6.265 -19.962
  464   HG22  VAL  59          1HG2      VAL  59 -40.484   7.031 -19.715
  465   HG23  VAL  59          2HG2      VAL  59 -40.875   5.462 -18.979
  466    H    MET  60           H        MET  60 -41.460   9.836 -20.439
  467    HA   MET  60           HA       MET  60 -38.892  10.606 -19.822
  468    HB2  MET  60           2HB      MET  60 -41.020  12.076 -21.441
  469    HB3  MET  60           3HB      MET  60 -39.340  12.598 -21.364
  470    HG2  MET  60           2HG      MET  60 -40.298   9.942 -22.451
  471    HG3  MET  60           3HG      MET  60 -39.810  11.342 -23.384
  472    HE1  MET  60           3HE      MET  60 -38.506   8.626 -20.769
  473    HE2  MET  60           1HE      MET  60 -38.787   7.980 -22.398
  474    HE3  MET  60           2HE      MET  60 -37.138   8.062 -21.750
  475    H    GLN  61           H        GLN  61 -38.184  11.503 -18.102
  476    HA   GLN  61           HA       GLN  61 -37.559  13.083 -16.685
  477    HB2  GLN  61           2HB      GLN  61 -39.247  15.020 -18.274
  478    HB3  GLN  61           3HB      GLN  61 -37.878  15.418 -17.245
  479    HG2  GLN  61           2HG      GLN  61 -36.297  14.676 -18.792
  480    HG3  GLN  61           3HG      GLN  61 -37.352  13.469 -19.505
  481   HE21  GLN  61          1HE2      GLN  61 -37.257  13.970 -21.654
  482   HE22  GLN  61          2HE2      GLN  61 -37.874  15.481 -22.289
  483    H    ARG  62           H        ARG  62 -40.173  11.511 -16.137
  484    HA   ARG  62           HA       ARG  62 -41.451  13.251 -14.148
  485    HB2  ARG  62           2HB      ARG  62 -41.592  10.320 -14.932
  486    HB3  ARG  62           3HB      ARG  62 -42.088  10.770 -13.312
  487    HG2  ARG  62           2HG      ARG  62 -44.052  10.813 -14.432
  488    HG3  ARG  62           3HG      ARG  62 -43.617  12.521 -14.345
  489    HD2  ARG  62           2HD      ARG  62 -43.153  10.730 -16.746
  490    HD3  ARG  62           3HD      ARG  62 -44.642  11.634 -16.523
  491    HE   ARG  62           HE       ARG  62 -42.140  12.625 -17.540
  492   HH11  ARG  62          1HH2      ARG  62 -44.953  13.804 -15.799
  493   HH12  ARG  62          2HH2      ARG  62 -44.696  15.431 -16.365
  494   HH21  ARG  62          1HH1      ARG  62 -41.911  14.592 -18.231
  495   HH22  ARG  62          2HH1      ARG  62 -42.980  15.887 -17.721
  496    HA   PRO  63           HA       PRO  63 -38.608  12.633 -10.765
  497    HB2  PRO  63           2HB      PRO  63 -40.997  11.963  -9.052
  498    HB3  PRO  63           3HB      PRO  63 -39.657  13.109  -8.732
  499    HG2  PRO  63           2HG      PRO  63 -42.069  14.041  -9.529
  500    HG3  PRO  63           3HG      PRO  63 -40.574  14.715 -10.256
  501    HD2  PRO  63           2HD      PRO  63 -42.399  12.567 -11.391
  502    HD3  PRO  63           3HD      PRO  63 -41.748  14.032 -12.189
  503    H    CYS  64           H        CYS  64 -37.372  10.912 -10.237
  504    HA   CYS  64           HA       CYS  64 -38.133   8.147 -10.708
  505    HB2  CYS  64           2HB      CYS  64 -35.868   9.368 -10.926
  506    HB3  CYS  64           3HB      CYS  64 -35.723   9.133  -9.169
  507    HG   CYS  64           HG       CYS  64 -34.407   7.259 -10.494
  508    H    THR  65           H        THR  65 -38.224  10.249  -7.901
  509    HA   THR  65           HA       THR  65 -38.367   8.534  -5.755
  510    HB   THR  65           HB       THR  65 -40.068  11.034  -5.967
  511    HG1  THR  65           HG1      THR  65 -38.250  12.202  -5.445
  512   HG21  THR  65          1HG2      THR  65 -39.289  11.251  -3.591
  513   HG22  THR  65          2HG2      THR  65 -40.232   9.779  -3.870
  514   HG23  THR  65          3HG2      THR  65 -38.463   9.679  -3.770
  515    H    CYS  66           H        CYS  66 -39.472   6.756  -6.072
  516    HA   CYS  66           HA       CYS  66 -41.792   6.114  -7.196
  517    HB2  CYS  66           2HB      CYS  66 -40.933   5.001  -4.487
  518    HB3  CYS  66           3HB      CYS  66 -41.939   4.172  -5.686
  519    HG   CYS  66           HG       CYS  66 -40.111   4.189  -7.614
  520    H    ASP  67           H        ASP  67 -41.827   7.988  -4.291
  521    HA   ASP  67           HA       ASP  67 -44.477   7.577  -3.316
  522    HB2  ASP  67           2HB      ASP  67 -42.661   8.998  -2.253
  523    HB3  ASP  67           3HB      ASP  67 -42.947  10.205  -3.499
  524    H    PHE  68           H        PHE  68 -43.258   9.516  -6.033
  525    HA   PHE  68           HA       PHE  68 -45.574  10.937  -6.803
  526    HB2  PHE  68           2HB      PHE  68 -43.203  11.248  -7.563
  527    HB3  PHE  68           3HB      PHE  68 -43.328   9.766  -8.501
  528    HD1  PHE  68           HD1      PHE  68 -44.467  13.281  -8.203
  529    HD2  PHE  68           HD2      PHE  68 -44.503   9.722 -10.633
  530    HE1  PHE  68           HE1      PHE  68 -45.339  14.602 -10.124
  531    HE2  PHE  68           HE2      PHE  68 -45.412  11.034 -12.539
  532    HZ   PHE  68           HZ       PHE  68 -45.813  13.479 -12.294
  533    H    LEU  69           H        LEU  69 -44.868   7.529  -7.138
  534    HA   LEU  69           HA       LEU  69 -47.379   7.115  -8.655
  535    HB2  LEU  69           2HB      LEU  69 -46.336   5.275  -9.910
  536    HB3  LEU  69           3HB      LEU  69 -45.724   6.874 -10.269
  537    HG   LEU  69           HG       LEU  69 -43.690   6.367  -8.825
  538   HD11  LEU  69          1HD1      LEU  69 -44.518   4.425  -7.535
  539   HD12  LEU  69          2HD1      LEU  69 -44.761   3.522  -9.044
  540   HD13  LEU  69          3HD1      LEU  69 -43.123   3.975  -8.517
  541   HD21  LEU  69          3HD2      LEU  69 -44.206   4.596 -11.247
  542   HD22  LEU  69          1HD2      LEU  69 -43.661   6.288 -11.284
  543   HD23  LEU  69          2HD2      LEU  69 -42.615   5.042 -10.591
  544    H    HIS  70           H        HIS  70 -46.777   7.070  -5.707
  545    HA   HIS  70           HA       HIS  70 -46.985   4.341  -4.868
  546    HB2  HIS  70           2HB      HIS  70 -47.268   5.101  -2.745
  547    HB3  HIS  70           3HB      HIS  70 -46.413   6.442  -3.463
  548    HD2  HIS  70           HD2      HIS  70 -48.534   8.365  -4.540
  549    HE1  HIS  70           HE1      HIS  70 -50.807   7.804  -0.978
  550    HE2  HIS  70           HE2      HIS  70 -50.460   9.302  -3.011
  551    H    GLY  71           H        GLY  71 -48.715   3.094  -4.138
  552    HA2  GLY  71           HA2      GLY  71 -51.435   3.742  -5.227
  553    HA3  GLY  71           HA3      GLY  71 -50.625   2.210  -5.544
  554    HA   PRO  72           HA       PRO  72 -53.420   2.189  -1.797
  555    HB2  PRO  72           2HB      PRO  72 -55.063   0.057  -2.448
  556    HB3  PRO  72           3HB      PRO  72 -55.303   1.743  -2.987
  557    HG2  PRO  72           2HG      PRO  72 -53.937  -0.513  -4.482
  558    HG3  PRO  72           3HG      PRO  72 -55.203   0.606  -5.082
  559    HD2  PRO  72           2HD      PRO  72 -52.601   1.079  -5.618
  560    HD3  PRO  72           3HD      PRO  72 -53.684   2.428  -5.174
  561    H    ARG  73           H        ARG  73 -51.054  -0.030  -2.806
  562    HA   ARG  73           HA       ARG  73 -51.151  -1.366  -0.112
  563    HB2  ARG  73           2HB      ARG  73 -49.971  -2.364  -2.749
  564    HB3  ARG  73           3HB      ARG  73 -49.647  -3.110  -1.193
  565    HG2  ARG  73           2HG      ARG  73 -52.408  -2.840  -2.430
  566    HG3  ARG  73           3HG      ARG  73 -51.419  -4.295  -2.440
  567    HD2  ARG  73           2HD      ARG  73 -51.574  -4.534  -0.042
  568    HD3  ARG  73           3HD      ARG  73 -52.359  -2.970   0.148
  569    HE   ARG  73           HE       ARG  73 -53.588  -5.460  -0.808
  570   HH11  ARG  73          1HH1      ARG  73 -54.085  -1.970  -0.445
  571   HH12  ARG  73          2HH1      ARG  73 -55.811  -2.153  -0.555
  572   HH21  ARG  73          1HH2      ARG  73 -55.790  -5.556  -0.957
  573   HH22  ARG  73          2HH2      ARG  73 -56.742  -4.105  -0.855
  574    H    THR  74           H        THR  74 -49.545   1.093  -1.790
  575    HA   THR  74           HA       THR  74 -46.871   0.448  -0.877
  576    HB   THR  74           HB       THR  74 -47.738   3.228  -1.647
  577    HG1  THR  74           HG1      THR  74 -46.774   1.547  -3.629
  578   HG21  THR  74          1HG2      THR  74 -45.178   1.598  -1.978
  579   HG22  THR  74          2HG2      THR  74 -45.432   3.211  -2.686
  580   HG23  THR  74          3HG2      THR  74 -45.417   3.008  -0.930
  581    H    GLN  75           H        GLN  75 -45.786   1.068   0.886
  582    HA   GLN  75           HA       GLN  75 -47.300   2.409   3.051
  583    HB2  GLN  75           2HB      GLN  75 -44.470   1.332   3.171
  584    HB3  GLN  75           3HB      GLN  75 -45.532   1.789   4.500
  585    HG2  GLN  75           2HG      GLN  75 -45.846  -0.626   2.684
  586    HG3  GLN  75           3HG      GLN  75 -45.327  -0.593   4.366
  587   HE21  GLN  75          2HE2      GLN  75 -48.158  -0.741   2.265
  588   HE22  GLN  75          1HE2      GLN  75 -49.309  -0.664   3.589
  589    H    ARG  76           H        ARG  76 -46.893   4.419   3.794
  590    HA   ARG  76           HA       ARG  76 -45.438   6.238   2.055
  591    HB2  ARG  76           2HB      ARG  76 -46.539   6.851   4.782
  592    HB3  ARG  76           3HB      ARG  76 -46.110   8.005   3.519
  593    HG2  ARG  76           2HG      ARG  76 -48.430   6.036   3.533
  594    HG3  ARG  76           3HG      ARG  76 -48.514   7.794   3.525
  595    HD2  ARG  76           2HD      ARG  76 -47.538   6.004   1.247
  596    HD3  ARG  76           3HD      ARG  76 -49.094   6.805   1.321
  597    HE   ARG  76           HE       ARG  76 -46.568   7.961   0.476
  598   HH11  ARG  76          1HH2      ARG  76 -49.659   8.920   1.839
  599   HH12  ARG  76          2HH2      ARG  76 -49.557  10.506   1.126
  600   HH21  ARG  76          2HH1      ARG  76 -46.522   9.910  -0.412
  601   HH22  ARG  76          1HH1      ARG  76 -47.805  11.067  -0.111
  602    H    ARG  77           H        ARG  77 -44.671   4.772   5.198
  603    HA   ARG  77           HA       ARG  77 -42.119   5.976   5.569
  604    HB2  ARG  77           2HB      ARG  77 -41.553   4.075   6.911
  605    HB3  ARG  77           3HB      ARG  77 -43.226   4.579   7.228
  606    HG2  ARG  77           2HG      ARG  77 -43.998   2.680   5.770
  607    HG3  ARG  77           3HG      ARG  77 -42.316   2.126   5.660
  608    HD2  ARG  77           2HD      ARG  77 -42.241   1.912   8.127
  609    HD3  ARG  77           3HD      ARG  77 -43.925   2.437   8.230
  610    HE   ARG  77           HE       ARG  77 -42.909  -0.188   7.421
  611   HH11  ARG  77          2HH1      ARG  77 -45.769   1.856   7.404
  612   HH12  ARG  77          1HH1      ARG  77 -46.789   0.531   6.888
  613   HH21  ARG  77          1HH2      ARG  77 -44.350  -1.855   7.070
  614   HH22  ARG  77          2HH2      ARG  77 -46.052  -1.505   6.937
  615    H    ALA  78           H        ALA  78 -42.990   3.307   3.423
  616    HA   ALA  78           HA       ALA  78 -40.293   2.631   2.602
  617    HB1  ALA  78           3HB      ALA  78 -41.469   1.492   0.727
  618    HB2  ALA  78           1HB      ALA  78 -42.125   1.033   2.294
  619    HB3  ALA  78           2HB      ALA  78 -42.987   2.147   1.206
  620    H    ALA  79           H        ALA  79 -42.909   4.623   1.156
  621    HA   ALA  79           HA       ALA  79 -41.356   5.527  -1.091
  622    HB1  ALA  79           3HB      ALA  79 -43.790   6.793   0.246
  623    HB2  ALA  79           1HB      ALA  79 -43.247   7.018  -1.425
  624    HB3  ALA  79           2HB      ALA  79 -43.861   5.439  -0.916
  625    H    ALA  80           H        ALA  80 -41.816   6.873   2.156
  626    HA   ALA  80           HA       ALA  80 -40.524   9.370   1.726
  627    HB1  ALA  80           3HB      ALA  80 -40.533   9.474   4.203
  628    HB2  ALA  80           1HB      ALA  80 -42.105   8.974   3.546
  629    HB3  ALA  80           2HB      ALA  80 -41.017   7.763   4.263
  630    H    GLN  81           H        GLN  81 -39.257   6.339   3.325
  631    HA   GLN  81           HA       GLN  81 -36.549   7.084   3.551
  632    HB2  GLN  81           2HB      GLN  81 -37.891   4.430   2.978
  633    HB3  GLN  81           3HB      GLN  81 -36.137   4.576   3.149
  634    HG2  GLN  81           2HG      GLN  81 -36.310   5.425   5.401
  635    HG3  GLN  81           3HG      GLN  81 -38.067   5.548   5.293
  636   HE21  GLN  81          2HE2      GLN  81 -39.277   3.496   4.947
  637   HE22  GLN  81          1HE2      GLN  81 -38.631   2.018   5.682
  638    H    ILE  82           H        ILE  82 -38.228   5.831   0.585
  639    HA   ILE  82           HA       ILE  82 -35.847   5.945  -1.038
  640    HB   ILE  82           HB       ILE  82 -38.803   5.978  -1.638
  641   HG12  ILE  82          2HG1      ILE  82 -36.597   3.993  -2.368
  642   HG13  ILE  82          3HG1      ILE  82 -37.454   3.937  -0.825
  643   HG21  ILE  82          1HG2      ILE  82 -38.160   5.779  -4.075
  644   HG22  ILE  82          2HG2      ILE  82 -37.860   7.373  -3.372
  645   HG23  ILE  82          3HG2      ILE  82 -36.502   6.253  -3.613
  646   HD11  ILE  82          3HD1      ILE  82 -38.517   2.413  -2.267
  647   HD12  ILE  82          1HD1      ILE  82 -39.612   3.796  -2.018
  648   HD13  ILE  82          2HD1      ILE  82 -38.719   3.621  -3.553
  649    H    ALA  83           H        ALA  83 -38.476   8.379  -0.567
  650    HA   ALA  83           HA       ALA  83 -37.364  10.430  -2.114
  651    HB1  ALA  83           3HB      ALA  83 -38.839  10.766   0.521
  652    HB2  ALA  83           1HB      ALA  83 -38.715  11.936  -0.796
  653    HB3  ALA  83           2HB      ALA  83 -39.621  10.421  -1.037
  654    H    GLN  84           H        GLN  84 -36.429   9.471   1.173
  655    HA   GLN  84           HA       GLN  84 -34.593  11.710   1.581
  656    HB2  GLN  84           2HB      GLN  84 -34.397   9.017   2.965
  657    HB3  GLN  84           3HB      GLN  84 -33.750  10.565   3.467
  658    HG2  GLN  84           2HG      GLN  84 -36.541   9.541   3.650
  659    HG3  GLN  84           3HG      GLN  84 -35.552  10.188   4.897
  660   HE21  GLN  84          1HE2      GLN  84 -38.003  10.876   2.618
  661   HE22  GLN  84          2HE2      GLN  84 -38.086  12.624   2.895
  662    H    ALA  85           H        ALA  85 -34.292   8.361   0.245
  663    HA   ALA  85           HA       ALA  85 -31.400   8.390   0.147
  664    HB1  ALA  85           3HB      ALA  85 -33.432   6.714  -1.398
  665    HB2  ALA  85           1HB      ALA  85 -31.698   6.380  -1.236
  666    HB3  ALA  85           2HB      ALA  85 -32.746   6.312   0.194
  667    H    LEU  86           H        LEU  86 -33.983   9.402  -2.065
  668    HA   LEU  86           HA       LEU  86 -32.120  10.070  -4.197
  669    HB2  LEU  86           2HB      LEU  86 -35.019  10.902  -3.980
  670    HB3  LEU  86           3HB      LEU  86 -33.994  10.881  -5.402
  671    HG   LEU  86           HG       LEU  86 -35.448   8.646  -4.034
  672   HD11  LEU  86          1HD1      LEU  86 -35.951   8.019  -6.327
  673   HD12  LEU  86          2HD1      LEU  86 -36.161   9.773  -6.160
  674   HD13  LEU  86          3HD1      LEU  86 -34.718   9.137  -6.956
  675   HD21  LEU  86          3HD2      LEU  86 -32.880   8.163  -5.640
  676   HD22  LEU  86          1HD2      LEU  86 -33.208   7.615  -3.982
  677   HD23  LEU  86          2HD2      LEU  86 -34.112   6.923  -5.316
  678    H    LEU  87           H        LEU  87 -33.757  11.902  -1.611
  679    HA   LEU  87           HA       LEU  87 -32.823  14.512  -2.182
  680    HB2  LEU  87           2HB      LEU  87 -34.553  14.316  -0.689
  681    HB3  LEU  87           3HB      LEU  87 -33.896  12.891   0.078
  682    HG   LEU  87           HG       LEU  87 -32.605  15.433   0.625
  683   HD11  LEU  87          1HD1      LEU  87 -34.139  15.746   2.563
  684   HD12  LEU  87          2HD1      LEU  87 -34.991  15.833   1.014
  685   HD13  LEU  87          3HD1      LEU  87 -35.085  14.351   1.989
  686   HD21  LEU  87          3HD2      LEU  87 -32.971  12.988   2.365
  687   HD22  LEU  87          1HD2      LEU  87 -31.471  13.493   1.559
  688   HD23  LEU  87          2HD2      LEU  87 -32.149  14.482   2.839
  689    H    GLY  88           H        GLY  88 -31.228  11.715  -0.723
  690    HA2  GLY  88           HA2      GLY  88 -28.882  11.443  -1.260
  691    HA3  GLY  88           HA3      GLY  88 -28.607  13.161  -0.986
  692    H    ALA  89           H        ALA  89 -30.624  11.513   1.359
  693    HA   ALA  89           HA       ALA  89 -28.902  12.093   3.548
  694    HB1  ALA  89           3HB      ALA  89 -31.206  10.105   3.312
  695    HB2  ALA  89           1HB      ALA  89 -30.478  10.669   4.830
  696    HB3  ALA  89           2HB      ALA  89 -31.325  11.818   3.781
  697    H    GLU  90           H        GLU  90 -29.554   8.972   1.903
  698    HA   GLU  90           HA       GLU  90 -26.803   8.146   2.040
  699    HB2  GLU  90           2HB      GLU  90 -27.185   6.031   3.271
  700    HB3  GLU  90           3HB      GLU  90 -27.317   7.451   4.293
  701    HG2  GLU  90           2HG      GLU  90 -29.801   7.295   4.211
  702    HG3  GLU  90           3HG      GLU  90 -29.675   5.873   3.175
  703    H    GLU  91           H        GLU  91 -26.350   6.352   0.702
  704    HA   GLU  91           HA       GLU  91 -28.306   5.571  -1.383
  705    HB2  GLU  91           2HB      GLU  91 -26.004   5.814  -1.979
  706    HB3  GLU  91           3HB      GLU  91 -25.444   4.788  -0.665
  707    HG2  GLU  91           2HG      GLU  91 -27.365   3.565  -2.622
  708    HG3  GLU  91           3HG      GLU  91 -25.758   3.970  -3.228
  709    H    ARG  92           H        ARG  92 -29.939   4.256  -0.768
  710    HA   ARG  92           HA       ARG  92 -29.381   1.810   0.802
  711    HB2  ARG  92           2HB      ARG  92 -29.999   3.646   2.408
  712    HB3  ARG  92           3HB      ARG  92 -31.518   3.860   1.553
  713    HG2  ARG  92           2HG      ARG  92 -31.928   2.570   3.543
  714    HG3  ARG  92           3HG      ARG  92 -32.172   1.527   2.147
  715    HD2  ARG  92           2HD      ARG  92 -31.024   0.320   3.913
  716    HD3  ARG  92           3HD      ARG  92 -29.951   0.486   2.518
  717    HE   ARG  92           HE       ARG  92 -29.469   2.680   4.299
  718   HH11  ARG  92          1HH1      ARG  92 -28.860  -0.786   4.297
  719   HH12  ARG  92          2HH1      ARG  92 -27.495  -0.598   5.365
  720   HH21  ARG  92          2HH2      ARG  92 -27.876   2.841   5.562
  721   HH22  ARG  92          1HH2      ARG  92 -26.915   1.456   6.100
  722    H    LYS  93           H        LYS  93 -30.525   0.129   0.187
  723    HA   LYS  93           HA       LYS  93 -32.593   0.279  -1.926
  724    HB2  LYS  93           2HB      LYS  93 -30.777  -1.347  -2.061
  725    HB3  LYS  93           3HB      LYS  93 -31.336  -2.089  -0.540
  726    HG2  LYS  93           2HG      LYS  93 -33.589  -2.407  -1.849
  727    HG3  LYS  93           3HG      LYS  93 -32.610  -2.048  -3.277
  728    HD2  LYS  93           2HD      LYS  93 -32.062  -4.250  -1.252
  729    HD3  LYS  93           3HD      LYS  93 -32.803  -4.480  -2.840
  730    HE2  LYS  93           2HE      LYS  93 -30.726  -3.527  -3.897
  731    HE3  LYS  93           3HE      LYS  93 -29.976  -3.450  -2.293
  732    HZ1  LYS  93           HZ1      LYS  93 -30.290  -5.901  -2.161
  733    HZ2  LYS  93           HZ2      LYS  93 -30.897  -5.894  -3.696
  734    HZ3  LYS  93           HZ3      LYS  93 -29.341  -5.481  -3.432
  735    H    VAL  94           H        VAL  94 -34.691   0.112  -1.591
  736    HA   VAL  94           HA       VAL  94 -35.797  -0.669   1.071
  737    HB   VAL  94           HB       VAL  94 -36.911   1.679  -0.475
  738   HG11  VAL  94          1HG1      VAL  94 -38.313   0.695   1.323
  739   HG12  VAL  94          2HG1      VAL  94 -37.002   0.960   2.491
  740   HG13  VAL  94          3HG1      VAL  94 -37.821   2.334   1.719
  741   HG21  VAL  94          3HG2      VAL  94 -35.761   3.256   1.071
  742   HG22  VAL  94          1HG2      VAL  94 -34.790   1.907   1.703
  743   HG23  VAL  94          2HG2      VAL  94 -34.627   2.434   0.008
  744    H    GLU  95           H        GLU  95 -37.860  -1.515   1.007
  745    HA   GLU  95           HA       GLU  95 -38.720  -2.678  -1.565
  746    HB2  GLU  95           2HB      GLU  95 -40.263  -3.963  -0.202
  747    HB3  GLU  95           3HB      GLU  95 -38.618  -4.069   0.457
  748    HG2  GLU  95           2HG      GLU  95 -39.198  -2.377   2.190
  749    HG3  GLU  95           3HG      GLU  95 -40.836  -2.272   1.556
  750    H    ILE  96           H        ILE  96 -40.934  -2.327  -2.343
  751    HA   ILE  96           HA       ILE  96 -42.603  -0.328  -1.222
  752    HB   ILE  96           HB       ILE  96 -42.477   0.960  -3.651
  753   HG12  ILE  96          2HG1      ILE  96 -40.223   1.711  -4.138
  754   HG13  ILE  96          3HG1      ILE  96 -39.548   0.599  -2.935
  755   HG21  ILE  96          1HG2      ILE  96 -42.686   1.969  -1.394
  756   HG22  ILE  96          2HG2      ILE  96 -40.904   1.962  -1.309
  757   HG23  ILE  96          3HG2      ILE  96 -41.737   2.882  -2.571
  758   HD11  ILE  96          3HD1      ILE  96 -39.312  -0.242  -5.252
  759   HD12  ILE  96          1HD1      ILE  96 -40.279  -1.307  -4.237
  760   HD13  ILE  96          2HD1      ILE  96 -41.096  -0.251  -5.395
  761    H    ALA  97           H        ALA  97 -44.612  -0.182  -2.228
  762    HA   ALA  97           HA       ALA  97 -45.187  -2.414  -4.084
  763    HB1  ALA  97           3HB      ALA  97 -47.257  -0.609  -2.850
  764    HB2  ALA  97           1HB      ALA  97 -47.477  -2.209  -3.528
  765    HB3  ALA  97           2HB      ALA  97 -46.609  -2.023  -1.994
  766    H    PHE  98           H        PHE  98 -46.162  -2.194  -6.071
  767    HA   PHE  98           HA       PHE  98 -46.364   0.555  -7.252
  768    HB2  PHE  98           2HB      PHE  98 -45.616  -2.019  -8.679
  769    HB3  PHE  98           3HB      PHE  98 -45.814  -0.443  -9.428
  770    HD1  PHE  98           HD1      PHE  98 -44.344   1.471  -7.944
  771    HD2  PHE  98           HD2      PHE  98 -43.371  -2.679  -8.613
  772    HE1  PHE  98           HE1      PHE  98 -41.930   1.989  -7.668
  773    HE2  PHE  98           HE2      PHE  98 -40.974  -2.156  -8.355
  774    HZ   PHE  98           HZ       PHE  98 -40.246   0.185  -7.873
  775    H    TYR  99           H        TYR  99 -48.053   0.882  -8.759
  776    HA   TYR  99           HA       TYR  99 -50.067  -1.278  -8.957
  777    HB2  TYR  99           2HB      TYR  99 -51.900   0.072  -8.674
  778    HB3  TYR  99           3HB      TYR  99 -50.832   0.543  -7.372
  779    HD1  TYR  99           HD1      TYR  99 -49.475   2.748  -7.624
  780    HD2  TYR  99           HD2      TYR  99 -52.720   1.635 -10.247
  781    HE1  TYR  99           HE1      TYR  99 -49.724   5.116  -8.331
  782    HE2  TYR  99           HE2      TYR  99 -52.956   4.009 -10.957
  783    HH   TYR  99           HH       TYR  99 -50.870   6.610  -9.639
  784    H    ARG 100           H        ARG 100 -50.868  -1.668 -10.914
  785    HA   ARG 100           HA       ARG 100 -49.605  -0.408 -13.236
  786    HB2  ARG 100           2HB      ARG 100 -51.387  -2.821 -12.773
  787    HB3  ARG 100           3HB      ARG 100 -51.129  -2.206 -14.413
  788    HG2  ARG 100           2HG      ARG 100 -48.740  -2.378 -14.210
  789    HG3  ARG 100           3HG      ARG 100 -48.847  -2.912 -12.523
  790    HD2  ARG 100           2HD      ARG 100 -49.824  -5.002 -13.145
  791    HD3  ARG 100           3HD      ARG 100 -50.164  -4.437 -14.798
  792    HE   ARG 100           HE       ARG 100 -47.402  -4.161 -14.440
  793   HH11  ARG 100          1HH1      ARG 100 -49.518  -6.950 -14.278
  794   HH12  ARG 100          2HH1      ARG 100 -48.371  -7.985 -15.082
  795   HH21  ARG 100          1HH2      ARG 100 -46.193  -5.433 -15.795
  796   HH22  ARG 100          2HH2      ARG 100 -46.457  -7.160 -15.822
  797    H    LYS 101           H        LYS 101 -50.683   0.255 -15.074
  798    HA   LYS 101           HA       LYS 101 -52.650   2.260 -14.976
  799    HB2  LYS 101           2HB      LYS 101 -51.225   2.080 -16.808
  800    HB3  LYS 101           3HB      LYS 101 -51.638   0.411 -17.140
  801    HG2  LYS 101           2HG      LYS 101 -53.811   2.504 -17.408
  802    HG3  LYS 101           3HG      LYS 101 -52.547   2.417 -18.639
  803    HD2  LYS 101           2HD      LYS 101 -52.991   0.114 -19.115
  804    HD3  LYS 101           3HD      LYS 101 -54.122  -0.035 -17.781
  805    HE2  LYS 101           2HE      LYS 101 -55.635   1.612 -18.848
  806    HE3  LYS 101           3HE      LYS 101 -54.558   1.671 -20.253
  807    HZ1  LYS 101           HZ1      LYS 101 -56.433   0.051 -20.477
  808    HZ2  LYS 101           HZ2      LYS 101 -54.975  -0.673 -20.624
  809    HZ3  LYS 101           HZ3      LYS 101 -55.817  -0.834 -19.236
  810    H    ASP 102           H        ASP 102 -53.241  -1.222 -15.292
  811    HA   ASP 102           HA       ASP 102 -56.125  -0.872 -15.638
  812    HB2  ASP 102           2HB      ASP 102 -54.413  -3.344 -15.248
  813    HB3  ASP 102           3HB      ASP 102 -56.151  -3.368 -15.545
  814    H    GLY 103           H        GLY 103 -54.201  -0.687 -12.888
  815    HA2  GLY 103           HA2      GLY 103 -55.076  -0.108 -10.794
  816    HA3  GLY 103           HA3      GLY 103 -56.531  -1.054 -11.091
  817    H    SER 104           H        SER 104 -53.887  -3.000 -11.915
  818    HA   SER 104           HA       SER 104 -54.211  -4.674  -9.548
  819    HB2  SER 104           2HB      SER 104 -52.186  -4.892 -11.807
  820    HB3  SER 104           3HB      SER 104 -52.562  -6.136 -10.599
  821    HG   SER 104           HG       SER 104 -53.712  -6.483 -12.554
  822    H    CYS 105           H        CYS 105 -53.064  -4.576  -7.665
  823    HA   CYS 105           HA       CYS 105 -50.598  -2.891  -7.579
  824    HB2  CYS 105           2HB      CYS 105 -52.722  -1.760  -6.855
  825    HB3  CYS 105           3HB      CYS 105 -52.848  -2.947  -5.540
  826    HG   CYS 105           HG       CYS 105 -51.950  -0.660  -4.636
  827    H    PHE 106           H        PHE 106 -48.882  -3.602  -6.465
  828    HA   PHE 106           HA       PHE 106 -49.054  -5.987  -4.700
  829    HB2  PHE 106           2HB      PHE 106 -47.312  -7.108  -6.187
  830    HB3  PHE 106           3HB      PHE 106 -48.961  -7.072  -6.773
  831    HD1  PHE 106           HD2      PHE 106 -45.551  -5.677  -7.303
  832    HD2  PHE 106           HD1      PHE 106 -49.610  -5.814  -8.753
  833    HE1  PHE 106           HE2      PHE 106 -44.841  -4.590  -9.419
  834    HE2  PHE 106           HE1      PHE 106 -48.897  -4.720 -10.857
  835    HZ   PHE 106           HZ       PHE 106 -46.508  -4.103 -11.200
  836    H    LEU 107           H        LEU 107 -47.465  -6.182  -3.223
  837    HA   LEU 107           HA       LEU 107 -45.071  -4.404  -3.302
  838    HB2  LEU 107           2HB      LEU 107 -46.611  -4.224  -1.323
  839    HB3  LEU 107           3HB      LEU 107 -46.349  -5.915  -0.988
  840    HG   LEU 107           HG       LEU 107 -45.141  -4.492   0.528
  841   HD11  LEU 107          1HD1      LEU 107 -43.993  -6.691  -0.246
  842   HD12  LEU 107          2HD1      LEU 107 -42.904  -5.625  -1.167
  843   HD13  LEU 107          3HD1      LEU 107 -42.998  -5.459   0.570
  844   HD21  LEU 107          3HD2      LEU 107 -43.258  -3.111  -0.060
  845   HD22  LEU 107          1HD2      LEU 107 -43.532  -3.468  -1.775
  846   HD23  LEU 107          2HD2      LEU 107 -44.746  -2.546  -0.824
  847    H    CYS 108           H        CYS 108 -43.176  -5.338  -3.699
  848    HA   CYS 108           HA       CYS 108 -42.641  -8.148  -2.935
  849    HB2  CYS 108           2HB      CYS 108 -42.239  -6.953  -5.704
  850    HB3  CYS 108           3HB      CYS 108 -41.340  -8.376  -5.140
  851    HG   CYS 108           HG       CYS 108 -44.599  -8.185  -4.744
  852    H    LEU 109           H        LEU 109 -40.103  -8.486  -3.134
  853    HA   LEU 109           HA       LEU 109 -38.936  -6.324  -1.532
  854    HB2  LEU 109           2HB      LEU 109 -38.779  -8.713  -0.913
  855    HB3  LEU 109           3HB      LEU 109 -37.833  -9.033  -2.362
  856    HG   LEU 109           HG       LEU 109 -35.977  -7.659  -1.502
  857   HD11  LEU 109          1HD1      LEU 109 -36.044  -6.790   0.833
  858   HD12  LEU 109          2HD1      LEU 109 -37.141  -5.927  -0.243
  859   HD13  LEU 109          3HD1      LEU 109 -37.786  -7.137   0.893
  860   HD21  LEU 109          3HD2      LEU 109 -37.037  -9.580   0.604
  861   HD22  LEU 109          1HD2      LEU 109 -36.129 -10.035  -0.856
  862   HD23  LEU 109          2HD2      LEU 109 -35.350  -9.057   0.398
  863    H    VAL 110           H        VAL 110 -39.331  -4.998  -3.588
  864    HA   VAL 110           HA       VAL 110 -37.868  -5.285  -5.947
  865    HB   VAL 110           HB       VAL 110 -38.765  -2.687  -4.716
  866   HG11  VAL 110          1HG1      VAL 110 -39.027  -1.920  -7.069
  867   HG12  VAL 110          2HG1      VAL 110 -37.354  -2.286  -6.695
  868   HG13  VAL 110          3HG1      VAL 110 -38.326  -3.457  -7.622
  869   HG21  VAL 110          3HG2      VAL 110 -40.851  -2.997  -6.077
  870   HG22  VAL 110          1HG2      VAL 110 -40.284  -4.612  -6.551
  871   HG23  VAL 110          2HG2      VAL 110 -40.693  -4.241  -4.863
  872    H    ASP 111           H        ASP 111 -35.993  -4.222  -6.850
  873    HA   ASP 111           HA       ASP 111 -33.926  -4.013  -4.690
  874    HB2  ASP 111           2HB      ASP 111 -34.007  -5.844  -6.562
  875    HB3  ASP 111           3HB      ASP 111 -33.236  -4.606  -7.551
  876    H    VAL 112           H        VAL 112 -34.759  -1.764  -4.414
  877    HA   VAL 112           HA       VAL 112 -34.270   0.165  -6.517
  878    HB   VAL 112           HB       VAL 112 -35.072   0.627  -3.615
  879   HG11  VAL 112          1HG1      VAL 112 -36.178   2.626  -4.414
  880   HG12  VAL 112          2HG1      VAL 112 -34.500   2.713  -4.955
  881   HG13  VAL 112          3HG1      VAL 112 -35.789   2.248  -6.094
  882   HG21  VAL 112          3HG2      VAL 112 -36.620  -1.001  -4.595
  883   HG22  VAL 112          1HG2      VAL 112 -37.395   0.575  -4.476
  884   HG23  VAL 112          2HG2      VAL 112 -36.790  -0.006  -6.052
  885    H    VAL 113           H        VAL 113 -31.957  -0.493  -6.641
  886    HA   VAL 113           HA       VAL 113 -30.240   0.977  -4.679
  887    HB   VAL 113           HB       VAL 113 -30.094  -1.469  -4.634
  888   HG11  VAL 113          1HG1      VAL 113 -28.669  -1.289  -7.319
  889   HG12  VAL 113          2HG1      VAL 113 -28.897  -2.727  -6.310
  890   HG13  VAL 113          3HG1      VAL 113 -30.297  -1.962  -7.071
  891   HG21  VAL 113          3HG2      VAL 113 -27.505  -0.088  -5.424
  892   HG22  VAL 113          1HG2      VAL 113 -28.257  -0.076  -3.808
  893   HG23  VAL 113          2HG2      VAL 113 -27.667  -1.592  -4.499
  894    HA   PRO 114           HA       PRO 114 -29.173   3.443  -8.244
  895    HB2  PRO 114           2HB      PRO 114 -27.633   5.317  -7.142
  896    HB3  PRO 114           3HB      PRO 114 -29.272   5.080  -6.516
  897    HG2  PRO 114           2HG      PRO 114 -26.730   3.906  -5.385
  898    HG3  PRO 114           3HG      PRO 114 -27.984   4.877  -4.536
  899    HD2  PRO 114           2HD      PRO 114 -28.032   2.146  -4.528
  900    HD3  PRO 114           3HD      PRO 114 -29.537   3.109  -4.603
  901    H    VAL 115           H        VAL 115 -26.917   4.720  -9.080
  902    HA   VAL 115           HA       VAL 115 -24.668   2.767  -9.006
  903    HB   VAL 115           HB       VAL 115 -24.177   3.279 -11.375
  904   HG11  VAL 115          1HG1      VAL 115 -26.795   1.817 -10.864
  905   HG12  VAL 115          2HG1      VAL 115 -25.730   1.625 -12.271
  906   HG13  VAL 115          3HG1      VAL 115 -25.164   1.143 -10.663
  907   HG21  VAL 115          3HG2      VAL 115 -25.611   5.256 -11.626
  908   HG22  VAL 115          1HG2      VAL 115 -25.891   4.038 -12.876
  909   HG23  VAL 115          2HG2      VAL 115 -27.052   4.226 -11.533
  910    H    LYS 116           H        LYS 116 -22.828   3.472  -8.543
  911    HA   LYS 116           HA       LYS 116 -22.151   6.376  -8.564
  912    HB2  LYS 116           2HB      LYS 116 -20.695   5.931  -6.577
  913    HB3  LYS 116           3HB      LYS 116 -22.410   5.586  -6.247
  914    HG2  LYS 116           2HG      LYS 116 -21.861   3.173  -6.766
  915    HG3  LYS 116           3HG      LYS 116 -20.164   3.665  -6.831
  916    HD2  LYS 116           2HD      LYS 116 -20.463   2.715  -4.708
  917    HD3  LYS 116           3HD      LYS 116 -20.399   4.456  -4.437
  918    HE2  LYS 116           2HE      LYS 116 -22.883   4.522  -4.269
  919    HE3  LYS 116           3HE      LYS 116 -22.942   2.785  -4.607
  920    HZ1  LYS 116           HZ1      LYS 116 -21.582   2.463  -2.564
  921    HZ2  LYS 116           HZ2      LYS 116 -21.728   4.054  -2.212
  922    HZ3  LYS 116           HZ3      LYS 116 -23.051   3.075  -2.245
  923    H    ASN 117           H        ASN 117 -19.902   6.810  -8.486
  924    HA   ASN 117           HA       ASN 117 -18.440   5.264 -10.596
  925    HB2  ASN 117           2HB      ASN 117 -17.321   7.198 -11.202
  926    HB3  ASN 117           3HB      ASN 117 -18.943   7.771 -10.888
  927   HD21  ASN 117          2HD2      ASN 117 -19.267   8.894  -8.648
  928   HD22  ASN 117          1HD2      ASN 117 -17.842   9.731  -8.053
  929    H    GLU 118           H        GLU 118 -15.890   5.601 -10.232
  930    HA   GLU 118           HA       GLU 118 -15.193   3.850  -8.116
  931    HB2  GLU 118           2HB      GLU 118 -12.904   4.188  -8.817
  932    HB3  GLU 118           3HB      GLU 118 -13.964   4.015 -10.214
  933    HG2  GLU 118           2HG      GLU 118 -13.936   6.496 -10.529
  934    HG3  GLU 118           3HG      GLU 118 -12.853   6.651  -9.145
  935    H    ASP 119           H        ASP 119 -15.429   7.346  -7.993
  936    HA   ASP 119           HA       ASP 119 -13.906   7.699  -5.564
  937    HB2  ASP 119           2HB      ASP 119 -14.578   9.452  -7.316
  938    HB3  ASP 119           3HB      ASP 119 -16.171   9.452  -6.558
  939    H    GLY 120           H        GLY 120 -17.076   6.338  -6.115
  940    HA2  GLY 120           HA2      GLY 120 -18.318   5.252  -4.447
  941    HA3  GLY 120           HA3      GLY 120 -17.641   6.289  -3.195
  942    H    ALA 121           H        ALA 121 -18.490   8.291  -5.742
  943    HA   ALA 121           HA       ALA 121 -21.020   9.107  -4.437
  944    HB1  ALA 121           3HB      ALA 121 -19.338  10.515  -6.540
  945    HB2  ALA 121           1HB      ALA 121 -20.759  11.173  -5.708
  946    HB3  ALA 121           2HB      ALA 121 -19.286  10.808  -4.788
  947    H    VAL 122           H        VAL 122 -22.884   8.551  -5.137
  948    HA   VAL 122           HA       VAL 122 -23.643   7.213  -7.470
  949    HB   VAL 122           HB       VAL 122 -24.877   7.070  -5.474
  950   HG11  VAL 122          1HG1      VAL 122 -24.631   9.364  -4.525
  951   HG12  VAL 122          2HG1      VAL 122 -25.811   9.951  -5.718
  952   HG13  VAL 122          3HG1      VAL 122 -26.285   8.752  -4.509
  953   HG21  VAL 122          3HG2      VAL 122 -26.616   8.428  -7.557
  954   HG22  VAL 122          1HG2      VAL 122 -26.054   6.753  -7.617
  955   HG23  VAL 122          2HG2      VAL 122 -27.125   7.279  -6.306
  956    H    ILE 123           H        ILE 123 -23.034   8.027  -9.371
  957    HA   ILE 123           HA       ILE 123 -23.565  10.833  -9.981
  958    HB   ILE 123           HB       ILE 123 -22.363  10.715 -11.891
  959   HG12  ILE 123          2HG1      ILE 123 -23.166   8.840 -13.104
  960   HG13  ILE 123          3HG1      ILE 123 -21.423   8.796 -13.022
  961   HG21  ILE 123          1HG2      ILE 123 -20.187   9.945 -11.231
  962   HG22  ILE 123          2HG2      ILE 123 -21.039  10.576  -9.809
  963   HG23  ILE 123          3HG2      ILE 123 -20.893   8.823 -10.050
  964   HD11  ILE 123          3HD1      ILE 123 -23.347   7.000 -11.512
  965   HD12  ILE 123          1HD1      ILE 123 -22.260   6.558 -12.820
  966   HD13  ILE 123          2HD1      ILE 123 -21.583   7.007 -11.246
  967    H    MET 124           H        MET 124 -25.009   7.672 -10.580
  968    HA   MET 124           HA       MET 124 -27.271   9.096 -11.899
  969    HB2  MET 124           2HB      MET 124 -25.748   6.749 -13.073
  970    HB3  MET 124           3HB      MET 124 -27.465   6.990 -13.410
  971    HG2  MET 124           2HG      MET 124 -25.165   8.816 -14.042
  972    HG3  MET 124           3HG      MET 124 -26.140   7.913 -15.180
  973    HE1  MET 124           3HE      MET 124 -25.425  10.876 -15.748
  974    HE2  MET 124           1HE      MET 124 -26.341  12.123 -14.865
  975    HE3  MET 124           2HE      MET 124 -25.182  11.079 -14.004
  976    H    PHE 125           H        PHE 125 -29.186   8.199 -11.748
  977    HA   PHE 125           HA       PHE 125 -29.657   6.406  -9.388
  978    HB2  PHE 125           2HB      PHE 125 -31.037   8.867 -10.482
  979    HB3  PHE 125           3HB      PHE 125 -31.996   7.652  -9.677
  980    HD1  PHE 125           HD1      PHE 125 -29.126   7.439  -7.706
  981    HD2  PHE 125           HD2      PHE 125 -32.314  10.173  -8.716
  982    HE1  PHE 125           HE1      PHE 125 -28.761   8.662  -5.594
  983    HE2  PHE 125           HE2      PHE 125 -31.892  11.415  -6.606
  984    HZ   PHE 125           HZ       PHE 125 -30.089  10.678  -5.068
  985    H    ILE 126           H        ILE 126 -29.194   4.654 -10.776
  986    HA   ILE 126           HA       ILE 126 -31.469   3.943 -12.579
  987    HB   ILE 126           HB       ILE 126 -28.809   2.532 -12.245
  988   HG12  ILE 126          2HG1      ILE 126 -29.832   4.493 -14.342
  989   HG13  ILE 126          3HG1      ILE 126 -28.484   4.744 -13.249
  990   HG21  ILE 126          1HG2      ILE 126 -30.831   2.138 -14.485
  991   HG22  ILE 126          2HG2      ILE 126 -29.465   1.107 -14.035
  992   HG23  ILE 126          3HG2      ILE 126 -30.915   1.168 -13.032
  993   HD11  ILE 126          3HD1      ILE 126 -28.604   2.750 -15.511
  994   HD12  ILE 126          1HD1      ILE 126 -27.607   4.219 -15.382
  995   HD13  ILE 126          2HD1      ILE 126 -27.308   2.818 -14.298
  996    H    LEU 127           H        LEU 127 -32.684   4.055 -10.515
  997    HA   LEU 127           HA       LEU 127 -32.250   1.862  -8.641
  998    HB2  LEU 127           2HB      LEU 127 -34.681   3.651  -8.805
  999    HB3  LEU 127           3HB      LEU 127 -34.139   2.633  -7.498
 1000    HG   LEU 127           HG       LEU 127 -33.302   4.449  -6.592
 1001   HD11  LEU 127          1HD1      LEU 127 -31.232   3.536  -7.081
 1002   HD12  LEU 127          2HD1      LEU 127 -31.091   4.608  -8.515
 1003   HD13  LEU 127          3HD1      LEU 127 -31.275   5.286  -6.878
 1004   HD21  LEU 127          3HD2      LEU 127 -34.582   5.912  -8.039
 1005   HD22  LEU 127          1HD2      LEU 127 -33.001   6.623  -7.709
 1006   HD23  LEU 127          2HD2      LEU 127 -33.305   5.823  -9.276
 1007    H    ASN 128           H        ASN 128 -32.242   0.148 -10.009
 1008    HA   ASN 128           HA       ASN 128 -34.107  -0.705 -11.848
 1009    HB2  ASN 128           2HB      ASN 128 -32.667  -2.586  -9.926
 1010    HB3  ASN 128           3HB      ASN 128 -33.239  -2.962 -11.544
 1011   HD21  ASN 128          2HD2      ASN 128 -30.645  -1.584  -9.658
 1012   HD22  ASN 128          1HD2      ASN 128 -29.630  -1.173 -11.025
 1013    H    PHE 129           H        PHE 129 -36.376  -0.805 -11.591
 1014    HA   PHE 129           HA       PHE 129 -37.412  -1.563  -8.982
 1015    HB2  PHE 129           2HB      PHE 129 -38.935  -0.818 -11.477
 1016    HB3  PHE 129           3HB      PHE 129 -39.530  -0.995  -9.820
 1017    HD1  PHE 129           HD2      PHE 129 -37.496   0.581  -8.259
 1018    HD2  PHE 129           HD1      PHE 129 -39.458   1.405 -12.012
 1019    HE1  PHE 129           HE2      PHE 129 -37.226   3.015  -7.876
 1020    HE2  PHE 129           HE1      PHE 129 -39.204   3.837 -11.608
 1021    HZ   PHE 129           HZ       PHE 129 -38.071   4.646  -9.545
 1022    H    GLU 130           H        GLU 130 -36.109  -3.654  -9.705
 1023    HA   GLU 130           HA       GLU 130 -37.777  -5.576 -11.166
 1024    HB2  GLU 130           2HB      GLU 130 -35.973  -7.185 -10.537
 1025    HB3  GLU 130           3HB      GLU 130 -35.536  -5.799 -11.577
 1026    HG2  GLU 130           2HG      GLU 130 -34.484  -4.625  -9.827
 1027    HG3  GLU 130           3HG      GLU 130 -35.164  -5.679  -8.599
 1028    H    VAL 131           H        VAL 131 -39.454  -6.143 -10.320
 1029    HA   VAL 131           HA       VAL 131 -40.278  -6.728  -7.636
 1030    HB   VAL 131           HB       VAL 131 -41.190  -7.611 -10.395
 1031   HG11  VAL 131          1HG1      VAL 131 -42.561  -8.288  -7.784
 1032   HG12  VAL 131          2HG1      VAL 131 -43.281  -8.463  -9.394
 1033   HG13  VAL 131          3HG1      VAL 131 -41.892  -9.453  -8.947
 1034   HG21  VAL 131          3HG2      VAL 131 -42.480  -5.822  -8.287
 1035   HG22  VAL 131          1HG2      VAL 131 -41.558  -5.243  -9.688
 1036   HG23  VAL 131          2HG2      VAL 131 -43.071  -6.127  -9.935
 1037    H    VAL 132           H        VAL 132 -39.422  -8.253  -6.280
 1038    HA   VAL 132           HA       VAL 132 -38.932 -10.927  -7.404
 1039    HB   VAL 132           HB       VAL 132 -36.774  -9.953  -7.681
 1040   HG11  VAL 132          1HG1      VAL 132 -36.716  -9.417  -4.694
 1041   HG12  VAL 132          2HG1      VAL 132 -35.351  -9.247  -5.818
 1042   HG13  VAL 132          3HG1      VAL 132 -36.762  -8.201  -5.995
 1043   HG21  VAL 132          3HG2      VAL 132 -36.653 -11.895  -5.346
 1044   HG22  VAL 132          1HG2      VAL 132 -36.932 -12.348  -7.047
 1045   HG23  VAL 132          2HG2      VAL 132 -35.409 -11.587  -6.569
 1046    H    MET 133           H        MET 133 -39.235 -12.597  -6.041
 1047    HA   MET 133           HA       MET 133 -39.543 -12.163  -3.134
 1048    HB2  MET 133           2HB      MET 133 -41.590 -13.609  -4.872
 1049    HB3  MET 133           3HB      MET 133 -41.509 -13.717  -3.109
 1050    HG2  MET 133           2HG      MET 133 -41.749 -11.221  -2.995
 1051    HG3  MET 133           3HG      MET 133 -42.056 -11.212  -4.731
 1052    HE1  MET 133           3HE      MET 133 -43.923 -13.677  -5.332
 1053    HE2  MET 133           1HE      MET 133 -45.515 -12.928  -5.096
 1054    HE3  MET 133           2HE      MET 133 -44.216 -12.011  -5.888
 1055    H    GLU 134           H        GLU 134 -39.202 -14.072  -1.895
 1056    HA   GLU 134           HA       GLU 134 -37.240 -15.903  -3.025
 1057    HB2  GLU 134           2HB      GLU 134 -37.038 -16.792  -0.796
 1058    HB3  GLU 134           3HB      GLU 134 -36.988 -15.032  -0.769
 1059    HG2  GLU 134           2HG      GLU 134 -39.376 -14.983  -0.027
 1060    HG3  GLU 134           3HG      GLU 134 -39.404 -16.748  -0.034
 1061    H    LYS 135           H        LYS 135 -37.319 -18.216  -2.900
 1062    HA   LYS 135           HA       LYS 135 -39.946 -19.560  -2.926
 1063    HB2  LYS 135           2HB      LYS 135 -39.531 -18.768  -5.272
 1064    HB3  LYS 135           3HB      LYS 135 -38.005 -19.644  -5.273
 1065    HG2  LYS 135           2HG      LYS 135 -39.582 -20.964  -6.461
 1066    HG3  LYS 135           3HG      LYS 135 -39.289 -21.796  -4.934
 1067    HD2  LYS 135           2HD      LYS 135 -41.424 -20.877  -4.033
 1068    HD3  LYS 135           3HD      LYS 135 -41.683 -19.993  -5.555
 1069    HE2  LYS 135           2HE      LYS 135 -41.704 -22.150  -6.790
 1070    HE3  LYS 135           3HE      LYS 135 -41.438 -23.025  -5.276
 1071    HZ1  LYS 135           HZ1      LYS 135 -43.576 -22.164  -4.481
 1072    HZ2  LYS 135           HZ2      LYS 135 -43.822 -21.353  -5.880
 1073    HZ3  LYS 135           HZ3      LYS 135 -43.791 -22.984  -5.873
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1   6.907   0.582 -28.999
    2    H2   MET   1           2H       MET   1   7.692  -0.848 -29.076
    3    H3   MET   1           3H       MET   1   8.056   0.335 -30.144
    4    HA   MET   1           HA       MET   1   9.777   0.169 -28.467
    5    HB2  MET   1           2HB      MET   1   8.092   2.708 -28.299
    6    HB3  MET   1           3HB      MET   1   9.694   2.535 -27.581
    7    HG2  MET   1           2HG      MET   1  10.625   1.982 -29.829
    8    HG3  MET   1           3HG      MET   1   9.052   2.335 -30.547
    9    HE1  MET   1           3HE      MET   1   8.015   4.958 -29.024
   10    HE2  MET   1           1HE      MET   1   8.691   6.195 -30.101
   11    HE3  MET   1           2HE      MET   1   7.996   4.712 -30.788
   12    HA   PRO   2           HA       PRO   2   8.451  -0.996 -24.391
   13    HB2  PRO   2           2HB      PRO   2  10.675  -0.493 -22.890
   14    HB3  PRO   2           3HB      PRO   2  10.601  -1.803 -24.108
   15    HG2  PRO   2           2HG      PRO   2  11.724   0.999 -24.461
   16    HG3  PRO   2           3HG      PRO   2  12.508  -0.563 -24.865
   17    HD2  PRO   2           2HD      PRO   2  11.212   0.902 -26.743
   18    HD3  PRO   2           3HD      PRO   2  11.114  -0.884 -26.744
   19    H    VAL   3           H        VAL   3   7.902  -0.160 -22.311
   20    HA   VAL   3           HA       VAL   3   7.904   2.805 -21.958
   21    HB   VAL   3           HB       VAL   3   5.466   1.019 -21.578
   22   HG11  VAL   3          1HG1      VAL   3   4.270   3.175 -21.234
   23   HG12  VAL   3          2HG1      VAL   3   5.473   2.887 -19.983
   24   HG13  VAL   3          3HG1      VAL   3   5.820   4.041 -21.295
   25   HG21  VAL   3          3HG2      VAL   3   6.035   3.138 -23.700
   26   HG22  VAL   3          1HG2      VAL   3   5.831   1.393 -23.979
   27   HG23  VAL   3          2HG2      VAL   3   4.463   2.355 -23.425
   28    H    ARG   4           H        ARG   4   8.228   3.476 -19.897
   29    HA   ARG   4           HA       ARG   4   9.207   1.457 -17.997
   30    HB2  ARG   4           2HB      ARG   4  10.333   3.272 -16.916
   31    HB3  ARG   4           3HB      ARG   4  10.599   3.332 -18.659
   32    HG2  ARG   4           2HG      ARG   4   8.926   5.164 -18.863
   33    HG3  ARG   4           3HG      ARG   4   8.635   5.097 -17.114
   34    HD2  ARG   4           2HD      ARG   4  11.006   5.664 -16.696
   35    HD3  ARG   4           3HD      ARG   4  11.300   5.728 -18.447
   36    HE   ARG   4           HE       ARG   4   9.140   7.481 -17.838
   37   HH11  ARG   4          1HH1      ARG   4  12.597   7.359 -17.276
   38   HH12  ARG   4          2HH1      ARG   4  12.737   9.095 -17.191
   39   HH21  ARG   4          1HH2      ARG   4   9.390   9.687 -17.720
   40   HH22  ARG   4          2HH2      ARG   4  10.963  10.371 -17.436
   41    H    ARG   5           H        ARG   5   6.310   1.906 -18.290
   42    HA   ARG   5           HA       ARG   5   5.570   1.688 -15.474
   43    HB2  ARG   5           2HB      ARG   5   3.747   3.410 -15.585
   44    HB3  ARG   5           3HB      ARG   5   5.381   4.021 -15.539
   45    HG2  ARG   5           2HG      ARG   5   4.246   5.424 -17.002
   46    HG3  ARG   5           3HG      ARG   5   5.289   4.455 -18.007
   47    HD2  ARG   5           2HD      ARG   5   3.178   4.738 -19.128
   48    HD3  ARG   5           3HD      ARG   5   3.333   3.053 -18.682
   49    HE   ARG   5           HE       ARG   5   1.410   3.244 -17.425
   50   HH11  ARG   5          1HH2      ARG   5   2.583   6.538 -17.810
   51   HH12  ARG   5          2HH2      ARG   5   1.139   7.208 -17.106
   52   HH21  ARG   5          1HH1      ARG   5  -0.395   4.165 -16.669
   53   HH22  ARG   5          2HH1      ARG   5  -0.493   5.895 -16.432
   54    H    GLY   6           H        GLY   6   3.368   1.019 -15.121
   55    HA2  GLY   6           HA2      GLY   6   1.760  -0.002 -17.335
   56    HA3  GLY   6           HA3      GLY   6   2.542  -1.268 -16.383
   57    H    HIS   7           H        HIS   7  -0.316  -0.458 -16.733
   58    HA   HIS   7           HA       HIS   7  -1.181  -0.130 -13.902
   59    HB2  HIS   7           2HB      HIS   7  -2.763   1.663 -14.677
   60    HB3  HIS   7           3HB      HIS   7  -1.066   2.116 -14.725
   61    HD2  HIS   7           HD2      HIS   7  -4.033   1.377 -17.077
   62    HE1  HIS   7           HE1      HIS   7  -0.895   2.921 -19.518
   63    HE2  HIS   7           HE2      HIS   7  -3.342   2.224 -19.474
   64    H    VAL   8           H        VAL   8  -3.488  -0.471 -13.586
   65    HA   VAL   8           HA       VAL   8  -4.580  -2.725 -15.104
   66    HB   VAL   8           HB       VAL   8  -5.889  -1.108 -12.877
   67   HG11  VAL   8          1HG1      VAL   8  -7.506  -2.500 -14.122
   68   HG12  VAL   8          2HG1      VAL   8  -6.443  -3.916 -13.955
   69   HG13  VAL   8          3HG1      VAL   8  -7.215  -3.188 -12.531
   70   HG21  VAL   8          3HG2      VAL   8  -5.180  -2.969 -11.378
   71   HG22  VAL   8          1HG2      VAL   8  -4.223  -3.662 -12.706
   72   HG23  VAL   8          2HG2      VAL   8  -3.798  -2.082 -12.011
   73    H    ALA   9           H        ALA   9  -6.320  -2.652 -16.497
   74    HA   ALA   9           HA       ALA   9  -6.894  -0.318 -18.032
   75    HB1  ALA   9           3HB      ALA   9  -7.162  -2.632 -18.837
   76    HB2  ALA   9           1HB      ALA   9  -8.485  -2.894 -17.675
   77    HB3  ALA   9           2HB      ALA   9  -8.679  -1.731 -19.001
   78    HA   PRO  10           HA       PRO  10  -9.935   2.001 -15.843
   79    HB2  PRO  10           2HB      PRO  10 -11.714   1.789 -18.258
   80    HB3  PRO  10           3HB      PRO  10 -11.295   3.233 -17.293
   81    HG2  PRO  10           2HG      PRO  10 -10.045   2.744 -19.659
   82    HG3  PRO  10           3HG      PRO  10  -9.119   3.340 -18.245
   83    HD2  PRO  10           2HD      PRO  10  -9.250   0.528 -19.342
   84    HD3  PRO  10           3HD      PRO  10  -7.884   1.436 -18.648
   85    H    GLN  11           H        GLN  11 -10.837   1.044 -14.192
   86    HA   GLN  11           HA       GLN  11 -12.060  -1.501 -14.320
   87    HB2  GLN  11           2HB      GLN  11 -12.235  -1.444 -11.996
   88    HB3  GLN  11           3HB      GLN  11 -10.753  -0.598 -12.403
   89    HG2  GLN  11           2HG      GLN  11 -13.406   0.666 -11.563
   90    HG3  GLN  11           3HG      GLN  11 -11.975   0.473 -10.564
   91   HE21  GLN  11          1HE2      GLN  11 -13.594   2.905 -11.773
   92   HE22  GLN  11          2HE2      GLN  11 -12.241   3.980 -12.102
   93    H    ASN  12           H        ASN  12 -13.534   1.650 -14.534
   94    HA   ASN  12           HA       ASN  12 -16.223   0.934 -13.777
   95    HB2  ASN  12           2HB      ASN  12 -14.971   3.212 -15.387
   96    HB3  ASN  12           3HB      ASN  12 -16.714   3.036 -15.223
   97   HD21  ASN  12          2HD2      ASN  12 -16.172   5.303 -14.318
   98   HD22  ASN  12          1HD2      ASN  12 -15.940   5.352 -12.580
   99    H    THR  13           H        THR  13 -14.621   1.183 -16.994
  100    HA   THR  13           HA       THR  13 -16.945   0.145 -18.407
  101    HB   THR  13           HB       THR  13 -15.106   1.747 -19.220
  102    HG1  THR  13           HG1      THR  13 -15.542   1.081 -21.325
  103   HG21  THR  13          1HG2      THR  13 -13.207   0.166 -18.811
  104   HG22  THR  13          2HG2      THR  13 -13.800  -0.843 -20.132
  105   HG23  THR  13          3HG2      THR  13 -13.266   0.827 -20.453
  106    H    PHE  14           H        PHE  14 -13.863  -1.243 -17.261
  107    HA   PHE  14           HA       PHE  14 -14.118  -3.858 -18.332
  108    HB2  PHE  14           2HB      PHE  14 -12.152  -2.870 -17.159
  109    HB3  PHE  14           3HB      PHE  14 -13.028  -2.951 -15.642
  110    HD1  PHE  14           HD1      PHE  14 -11.441  -4.983 -18.326
  111    HD2  PHE  14           HD2      PHE  14 -13.264  -5.036 -14.414
  112    HE1  PHE  14           HE1      PHE  14 -10.639  -7.310 -17.980
  113    HE2  PHE  14           HE2      PHE  14 -12.462  -7.364 -14.074
  114    HZ   PHE  14           HZ       PHE  14 -11.149  -8.503 -15.855
  115    H    LEU  15           H        LEU  15 -15.496  -2.393 -15.388
  116    HA   LEU  15           HA       LEU  15 -16.991  -4.789 -14.656
  117    HB2  LEU  15           2HB      LEU  15 -16.383  -3.247 -12.909
  118    HB3  LEU  15           3HB      LEU  15 -17.215  -1.913 -13.720
  119    HG   LEU  15           HG       LEU  15 -19.380  -2.982 -13.385
  120   HD11  LEU  15          1HD1      LEU  15 -18.716  -5.382 -13.393
  121   HD12  LEU  15          2HD1      LEU  15 -17.908  -5.166 -11.838
  122   HD13  LEU  15          3HD1      LEU  15 -19.679  -4.976 -11.988
  123   HD21  LEU  15          3HD2      LEU  15 -19.541  -2.762 -10.952
  124   HD22  LEU  15          1HD2      LEU  15 -17.771  -2.872 -10.809
  125   HD23  LEU  15          2HD2      LEU  15 -18.518  -1.488 -11.640
  126    H    ASP  16           H        ASP  16 -17.959  -1.732 -16.340
  127    HA   ASP  16           HA       ASP  16 -20.639  -2.182 -16.800
  128    HB2  ASP  16           2HB      ASP  16 -19.128  -0.256 -17.541
  129    HB3  ASP  16           3HB      ASP  16 -18.750  -1.217 -18.970
  130    H    THR  17           H        THR  17 -17.947  -3.712 -18.537
  131    HA   THR  17           HA       THR  17 -19.529  -5.196 -20.449
  132    HB   THR  17           HB       THR  17 -16.801  -5.892 -19.272
  133    HG1  THR  17           HG1      THR  17 -16.810  -3.884 -20.302
  134   HG21  THR  17          1HG2      THR  17 -18.165  -6.820 -21.836
  135   HG22  THR  17          2HG2      THR  17 -16.455  -7.093 -21.429
  136   HG23  THR  17          3HG2      THR  17 -17.721  -7.835 -20.443
  137    H    ILE  18           H        ILE  18 -18.547  -5.941 -17.123
  138    HA   ILE  18           HA       ILE  18 -19.602  -8.666 -17.158
  139    HB   ILE  18           HB       ILE  18 -18.913  -6.883 -14.818
  140   HG12  ILE  18          2HG1      ILE  18 -16.916  -7.133 -16.158
  141   HG13  ILE  18          3HG1      ILE  18 -16.777  -7.927 -14.610
  142   HG21  ILE  18          1HG2      ILE  18 -18.623  -9.036 -13.558
  143   HG22  ILE  18          2HG2      ILE  18 -20.281  -8.685 -14.038
  144   HG23  ILE  18          3HG2      ILE  18 -19.344  -9.883 -14.949
  145   HD11  ILE  18          3HD1      ILE  18 -15.786  -9.254 -16.478
  146   HD12  ILE  18          1HD1      ILE  18 -17.132 -10.139 -15.738
  147   HD13  ILE  18          2HD1      ILE  18 -17.362  -9.302 -17.292
  148    H    ILE  19           H        ILE  19 -20.809  -5.415 -16.292
  149    HA   ILE  19           HA       ILE  19 -23.247  -6.279 -15.151
  150    HB   ILE  19           HB       ILE  19 -22.907  -3.854 -16.936
  151   HG12  ILE  19          2HG1      ILE  19 -21.316  -3.503 -15.194
  152   HG13  ILE  19          3HG1      ILE  19 -22.703  -2.513 -14.834
  153   HG21  ILE  19          1HG2      ILE  19 -24.871  -3.004 -15.648
  154   HG22  ILE  19          2HG2      ILE  19 -25.242  -4.457 -16.584
  155   HG23  ILE  19          3HG2      ILE  19 -24.985  -4.582 -14.835
  156   HD11  ILE  19          3HD1      ILE  19 -21.802  -3.503 -12.813
  157   HD12  ILE  19          1HD1      ILE  19 -23.410  -4.191 -13.107
  158   HD13  ILE  19          2HD1      ILE  19 -21.941  -5.135 -13.479
  159    H    ARG  20           H        ARG  20 -22.482  -5.439 -18.601
  160    HA   ARG  20           HA       ARG  20 -24.905  -6.455 -19.728
  161    HB2  ARG  20           2HB      ARG  20 -22.111  -5.735 -20.682
  162    HB3  ARG  20           3HB      ARG  20 -23.124  -6.720 -21.724
  163    HG2  ARG  20           2HG      ARG  20 -23.684  -4.680 -22.475
  164    HG3  ARG  20           3HG      ARG  20 -24.999  -4.962 -21.341
  165    HD2  ARG  20           2HD      ARG  20 -22.517  -3.459 -20.440
  166    HD3  ARG  20           3HD      ARG  20 -23.682  -2.655 -21.495
  167    HE   ARG  20           HE       ARG  20 -25.142  -3.892 -19.387
  168   HH11  ARG  20          2HH1      ARG  20 -22.990  -1.129 -19.666
  169   HH12  ARG  20          1HH1      ARG  20 -24.045  -0.141 -18.700
  170   HH21  ARG  20          1HH2      ARG  20 -26.385  -2.647 -18.296
  171   HH22  ARG  20          2HH2      ARG  20 -25.941  -0.995 -17.861
  172    H    LYS  21           H        LYS  21 -22.061  -8.205 -18.692
  173    HA   LYS  21           HA       LYS  21 -22.724 -10.714 -19.996
  174    HB2  LYS  21           2HB      LYS  21 -20.483  -9.961 -18.816
  175    HB3  LYS  21           3HB      LYS  21 -21.283 -10.545 -17.346
  176    HG2  LYS  21           2HG      LYS  21 -19.941 -12.317 -18.085
  177    HG3  LYS  21           3HG      LYS  21 -21.590 -12.783 -18.513
  178    HD2  LYS  21           2HD      LYS  21 -21.155 -12.042 -20.871
  179    HD3  LYS  21           3HD      LYS  21 -19.507 -11.570 -20.396
  180    HE2  LYS  21           2HE      LYS  21 -19.034 -13.916 -19.727
  181    HE3  LYS  21           3HE      LYS  21 -20.676 -14.384 -20.190
  182    HZ1  LYS  21           HZ1      LYS  21 -19.085 -14.865 -21.959
  183    HZ2  LYS  21           HZ2      LYS  21 -20.141 -13.739 -22.481
  184    HZ3  LYS  21           HZ3      LYS  21 -18.624 -13.304 -22.053
  185    H    PHE  22           H        PHE  22 -23.527  -9.409 -16.774
  186    HA   PHE  22           HA       PHE  22 -25.398 -11.684 -16.384
  187    HB2  PHE  22           2HB      PHE  22 -25.000 -11.634 -14.075
  188    HB3  PHE  22           3HB      PHE  22 -23.502 -11.764 -14.954
  189    HD1  PHE  22           HD2      PHE  22 -24.931  -8.300 -14.474
  190    HD2  PHE  22           HD1      PHE  22 -22.324 -11.365 -12.898
  191    HE1  PHE  22           HE2      PHE  22 -23.973  -6.684 -12.900
  192    HE2  PHE  22           HE1      PHE  22 -21.338  -9.709 -11.345
  193    HZ   PHE  22           HZ       PHE  22 -22.161  -7.359 -11.339
  194    H    GLU  23           H        GLU  23 -25.926  -8.885 -17.547
  195    HA   GLU  23           HA       GLU  23 -27.356  -7.301 -15.871
  196    HB2  GLU  23           2HB      GLU  23 -26.520  -6.634 -18.041
  197    HB3  GLU  23           3HB      GLU  23 -27.658  -7.672 -18.869
  198    HG2  GLU  23           2HG      GLU  23 -29.514  -6.256 -18.235
  199    HG3  GLU  23           3HG      GLU  23 -28.501  -5.356 -17.089
  200    H    GLY  24           H        GLY  24 -28.781 -10.159 -17.386
  201    HA2  GLY  24           HA2      GLY  24 -30.820 -11.195 -16.991
  202    HA3  GLY  24           HA3      GLY  24 -30.829 -10.311 -15.460
  203    H    GLN  25           H        GLN  25 -31.295  -9.487 -18.909
  204    HA   GLN  25           HA       GLN  25 -32.757  -7.155 -18.513
  205    HB2  GLN  25           2HB      GLN  25 -32.568  -8.991 -20.924
  206    HB3  GLN  25           3HB      GLN  25 -33.341  -7.400 -20.969
  207    HG2  GLN  25           2HG      GLN  25 -31.251  -6.331 -20.186
  208    HG3  GLN  25           3HG      GLN  25 -30.429  -7.891 -20.211
  209   HE21  GLN  25          2HE2      GLN  25 -29.403  -5.766 -21.665
  210   HE22  GLN  25          1HE2      GLN  25 -29.622  -6.112 -23.389
  211    H    SER  26           H        SER  26 -34.172 -10.198 -17.952
  212    HA   SER  26           HA       SER  26 -36.946  -9.485 -18.503
  213    HB2  SER  26           2HB      SER  26 -35.815 -11.434 -16.457
  214    HB3  SER  26           3HB      SER  26 -37.480 -11.379 -17.057
  215    HG   SER  26           HG       SER  26 -36.699 -11.933 -19.130
  216    H    ARG  27           H        ARG  27 -34.649  -8.555 -16.094
  217    HA   ARG  27           HA       ARG  27 -36.560  -7.576 -14.085
  218    HB2  ARG  27           2HB      ARG  27 -33.561  -7.141 -14.414
  219    HB3  ARG  27           3HB      ARG  27 -34.492  -6.721 -12.999
  220    HG2  ARG  27           2HG      ARG  27 -33.994  -9.545 -14.026
  221    HG3  ARG  27           3HG      ARG  27 -33.214  -8.778 -12.657
  222    HD2  ARG  27           2HD      ARG  27 -35.331  -8.747 -11.422
  223    HD3  ARG  27           3HD      ARG  27 -36.196  -9.391 -12.834
  224    HE   ARG  27           HE       ARG  27 -34.041 -11.134 -12.172
  225   HH11  ARG  27          1HH1      ARG  27 -37.162 -10.271 -10.747
  226   HH12  ARG  27          2HH1      ARG  27 -37.395 -11.880 -10.151
  227   HH21  ARG  27          1HH2      ARG  27 -34.401 -13.114 -11.276
  228   HH22  ARG  27          2HH2      ARG  27 -35.854 -13.417 -10.373
  229    H    LYS  28           H        LYS  28 -36.687  -5.298 -13.499
  230    HA   LYS  28           HA       LYS  28 -36.998  -3.630 -15.970
  231    HB2  LYS  28           2HB      LYS  28 -38.701  -3.552 -13.457
  232    HB3  LYS  28           3HB      LYS  28 -38.971  -2.714 -14.952
  233    HG2  LYS  28           2HG      LYS  28 -40.381  -4.442 -15.350
  234    HG3  LYS  28           3HG      LYS  28 -38.943  -5.209 -15.988
  235    HD2  LYS  28           2HD      LYS  28 -38.754  -6.546 -13.929
  236    HD3  LYS  28           3HD      LYS  28 -39.955  -5.523 -13.124
  237    HE2  LYS  28           2HE      LYS  28 -41.095  -7.499 -13.747
  238    HE3  LYS  28           3HE      LYS  28 -41.670  -6.222 -14.801
  239    HZ1  LYS  28           HZ1      LYS  28 -41.142  -8.338 -15.986
  240    HZ2  LYS  28           HZ2      LYS  28 -40.307  -7.074 -16.586
  241    HZ3  LYS  28           HZ3      LYS  28 -39.553  -8.158 -15.634
  242    H    PHE  29           H        PHE  29 -36.732  -1.338 -15.919
  243    HA   PHE  29           HA       PHE  29 -35.628  -0.014 -13.605
  244    HB2  PHE  29           2HB      PHE  29 -33.313   0.162 -14.288
  245    HB3  PHE  29           3HB      PHE  29 -33.730  -1.516 -14.126
  246    HD1  PHE  29           HD2      PHE  29 -33.996  -2.984 -16.148
  247    HD2  PHE  29           HD1      PHE  29 -32.544   1.073 -16.394
  248    HE1  PHE  29           HE2      PHE  29 -32.998  -3.476 -18.365
  249    HE2  PHE  29           HE1      PHE  29 -31.532   0.566 -18.609
  250    HZ   PHE  29           HZ       PHE  29 -31.746  -1.708 -19.588
  251    H    ILE  30           H        ILE  30 -34.671   1.987 -13.953
  252    HA   ILE  30           HA       ILE  30 -35.314   3.474 -16.421
  253    HB   ILE  30           HB       ILE  30 -35.938   5.429 -14.912
  254   HG12  ILE  30          2HG1      ILE  30 -36.964   4.995 -12.765
  255   HG13  ILE  30          3HG1      ILE  30 -36.485   3.301 -12.804
  256   HG21  ILE  30          1HG2      ILE  30 -37.806   3.050 -14.952
  257   HG22  ILE  30          2HG2      ILE  30 -38.250   4.773 -14.879
  258   HG23  ILE  30          3HG2      ILE  30 -37.446   4.119 -16.323
  259   HD11  ILE  30          3HD1      ILE  30 -34.133   3.898 -12.528
  260   HD12  ILE  30          1HD1      ILE  30 -34.513   5.631 -12.774
  261   HD13  ILE  30          2HD1      ILE  30 -35.088   4.779 -11.335
  262    H    ILE  31           H        ILE  31 -34.270   5.645 -16.386
  263    HA   ILE  31           HA       ILE  31 -31.570   5.611 -15.139
  264    HB   ILE  31           HB       ILE  31 -32.203   6.787 -17.853
  265   HG12  ILE  31          2HG1      ILE  31 -32.672   4.349 -18.039
  266   HG13  ILE  31          3HG1      ILE  31 -31.311   4.889 -19.028
  267   HG21  ILE  31          1HG2      ILE  31 -29.596   6.053 -16.463
  268   HG22  ILE  31          2HG2      ILE  31 -29.736   6.704 -18.113
  269   HG23  ILE  31          3HG2      ILE  31 -30.244   7.674 -16.723
  270   HD11  ILE  31          3HD1      ILE  31 -29.690   3.950 -17.579
  271   HD12  ILE  31          1HD1      ILE  31 -30.875   3.717 -16.282
  272   HD13  ILE  31          2HD1      ILE  31 -30.954   2.716 -17.757
  273    H    ALA  32           H        ALA  32 -31.499   7.146 -13.767
  274    HA   ALA  32           HA       ALA  32 -32.910   9.719 -14.295
  275    HB1  ALA  32           3HB      ALA  32 -34.223   8.731 -12.606
  276    HB2  ALA  32           1HB      ALA  32 -32.853   8.183 -11.670
  277    HB3  ALA  32           2HB      ALA  32 -33.171   9.910 -11.771
  278    H    ASN  33           H        ASN  33 -32.024  11.601 -13.617
  279    HA   ASN  33           HA       ASN  33 -29.102  11.687 -13.555
  280    HB2  ASN  33           2HB      ASN  33 -30.551  13.139 -14.913
  281    HB3  ASN  33           3HB      ASN  33 -31.303  13.796 -13.467
  282   HD21  ASN  33          2HD2      ASN  33 -30.317  15.465 -15.254
  283   HD22  ASN  33          1HD2      ASN  33 -28.796  16.175 -14.713
  284    H    ALA  34           H        ALA  34 -28.041  11.345 -11.660
  285    HA   ALA  34           HA       ALA  34 -29.294  12.079  -9.076
  286    HB1  ALA  34           3HB      ALA  34 -26.601  10.773  -9.504
  287    HB2  ALA  34           1HB      ALA  34 -27.559  10.828  -8.024
  288    HB3  ALA  34           2HB      ALA  34 -28.124   9.866  -9.397
  289    H    ARG  35           H        ARG  35 -27.816  13.859 -11.303
  290    HA   ARG  35           HA       ARG  35 -26.234  15.542  -9.396
  291    HB2  ARG  35           2HB      ARG  35 -26.276  15.875 -12.394
  292    HB3  ARG  35           3HB      ARG  35 -25.098  16.461 -11.232
  293    HG2  ARG  35           2HG      ARG  35 -25.492  13.617 -12.225
  294    HG3  ARG  35           3HG      ARG  35 -24.116  14.667 -12.471
  295    HD2  ARG  35           2HD      ARG  35 -24.938  13.270  -9.899
  296    HD3  ARG  35           3HD      ARG  35 -23.530  12.960 -10.893
  297    HE   ARG  35           HE       ARG  35 -22.644  15.181 -10.255
  298   HH11  ARG  35          2HH2      ARG  35 -25.111  13.891  -8.060
  299   HH12  ARG  35          1HH2      ARG  35 -24.403  14.715  -6.705
  300   HH21  ARG  35          1HH1      ARG  35 -21.890  16.228  -8.473
  301   HH22  ARG  35          2HH1      ARG  35 -22.677  16.024  -6.936
  302    H    VAL  36           H        VAL  36 -29.350  15.426 -10.451
  303    HA   VAL  36           HA       VAL  36 -29.703  18.383 -10.337
  304    HB   VAL  36           HB       VAL  36 -30.118  17.197 -12.541
  305   HG11  VAL  36          1HG1      VAL  36 -32.196  16.087 -12.946
  306   HG12  VAL  36          2HG1      VAL  36 -31.415  15.244 -11.594
  307   HG13  VAL  36          3HG1      VAL  36 -32.760  16.362 -11.291
  308   HG21  VAL  36          3HG2      VAL  36 -32.035  18.554 -13.095
  309   HG22  VAL  36          1HG2      VAL  36 -32.411  18.803 -11.375
  310   HG23  VAL  36          2HG2      VAL  36 -30.906  19.457 -12.070
  311    H    GLU  37           H        GLU  37 -31.191  19.250  -8.979
  312    HA   GLU  37           HA       GLU  37 -31.872  17.845  -6.623
  313    HB2  GLU  37           2HB      GLU  37 -31.531  20.304  -6.910
  314    HB3  GLU  37           3HB      GLU  37 -33.097  20.410  -7.725
  315    HG2  GLU  37           2HG      GLU  37 -34.239  19.675  -5.669
  316    HG3  GLU  37           3HG      GLU  37 -32.685  19.404  -4.873
  317    H    ASN  38           H        ASN  38 -33.712  18.196  -9.587
  318    HA   ASN  38           HA       ASN  38 -36.244  17.242  -8.515
  319    HB2  ASN  38           2HB      ASN  38 -35.156  17.682 -11.338
  320    HB3  ASN  38           3HB      ASN  38 -36.791  17.120 -11.008
  321   HD21  ASN  38          1HD2      ASN  38 -38.254  18.542  -9.739
  322   HD22  ASN  38          2HD2      ASN  38 -37.968  20.273  -9.816
  323    H    CYS  39           H        CYS  39 -33.380  15.523  -9.136
  324    HA   CYS  39           HA       CYS  39 -32.823  13.438  -9.781
  325    HB2  CYS  39           2HB      CYS  39 -33.610  11.737  -8.279
  326    HB3  CYS  39           3HB      CYS  39 -33.430  13.260  -7.410
  327    HG   CYS  39           HG       CYS  39 -36.115  13.853  -7.920
  328    H    ALA  40           H        ALA  40 -34.436  14.453 -11.874
  329    HA   ALA  40           HA       ALA  40 -36.547  12.595 -12.365
  330    HB1  ALA  40           3HB      ALA  40 -37.046  13.945 -14.336
  331    HB2  ALA  40           1HB      ALA  40 -36.847  14.925 -12.896
  332    HB3  ALA  40           2HB      ALA  40 -35.536  14.851 -14.120
  333    H    VAL  41           H        VAL  41 -37.062  11.432 -14.182
  334    HA   VAL  41           HA       VAL  41 -35.103   9.472 -14.935
  335    HB   VAL  41           HB       VAL  41 -38.064   9.800 -15.557
  336   HG11  VAL  41          1HG1      VAL  41 -37.060   8.295 -17.229
  337   HG12  VAL  41          2HG1      VAL  41 -36.225   7.408 -15.938
  338   HG13  VAL  41          3HG1      VAL  41 -37.998   7.354 -16.070
  339   HG21  VAL  41          3HG2      VAL  41 -37.592   9.471 -13.146
  340   HG22  VAL  41          1HG2      VAL  41 -38.388   8.071 -13.849
  341   HG23  VAL  41          2HG2      VAL  41 -36.635   8.024 -13.526
  342    H    ILE  42           H        ILE  42 -33.668  10.485 -16.235
  343    HA   ILE  42           HA       ILE  42 -34.310  12.018 -18.608
  344    HB   ILE  42           HB       ILE  42 -31.876  11.827 -19.047
  345   HG12  ILE  42          2HG1      ILE  42 -31.753  10.199 -16.461
  346   HG13  ILE  42          3HG1      ILE  42 -31.545   9.513 -18.082
  347   HG21  ILE  42          1HG2      ILE  42 -31.208  13.219 -17.187
  348   HG22  ILE  42          2HG2      ILE  42 -32.914  13.550 -17.500
  349   HG23  ILE  42          3HG2      ILE  42 -32.452  12.509 -16.132
  350   HD11  ILE  42          3HD1      ILE  42 -29.407   9.814 -17.094
  351   HD12  ILE  42          1HD1      ILE  42 -29.572  11.018 -18.390
  352   HD13  ILE  42          2HD1      ILE  42 -29.744  11.499 -16.673
  353    H    TYR  43           H        TYR  43 -33.980   8.625 -17.942
  354    HA   TYR  43           HA       TYR  43 -35.081   8.011 -20.572
  355    HB2  TYR  43           2HB      TYR  43 -32.497   8.060 -20.908
  356    HB3  TYR  43           3HB      TYR  43 -32.479   6.591 -19.982
  357    HD1  TYR  43           HD1      TYR  43 -33.853   8.174 -23.058
  358    HD2  TYR  43           HD2      TYR  43 -33.058   4.476 -20.977
  359    HE1  TYR  43           HE1      TYR  43 -34.418   6.885 -25.119
  360    HE2  TYR  43           HE2      TYR  43 -33.621   3.197 -23.032
  361    HH   TYR  43           HH       TYR  43 -34.284   3.304 -25.223
  362    H    CYS  44           H        CYS  44 -35.780   5.714 -20.814
  363    HA   CYS  44           HA       CYS  44 -35.974   4.276 -18.262
  364    HB2  CYS  44           2HB      CYS  44 -38.477   4.144 -18.482
  365    HB3  CYS  44           3HB      CYS  44 -37.852   5.759 -18.103
  366    HG   CYS  44           HG       CYS  44 -39.865   5.970 -19.744
  367    H    ASN  45           H        ASN  45 -36.489   2.039 -18.393
  368    HA   ASN  45           HA       ASN  45 -36.029   0.944 -21.111
  369    HB2  ASN  45           2HB      ASN  45 -34.706   0.220 -19.068
  370    HB3  ASN  45           3HB      ASN  45 -36.151  -0.641 -18.532
  371   HD21  ASN  45          2HD2      ASN  45 -33.782  -0.350 -21.234
  372   HD22  ASN  45          1HD2      ASN  45 -34.047  -1.990 -21.805
  373    H    ASP  46           H        ASP  46 -37.252  -0.798 -21.957
  374    HA   ASP  46           HA       ASP  46 -40.123  -0.580 -21.811
  375    HB2  ASP  46           2HB      ASP  46 -38.229  -2.681 -22.929
  376    HB3  ASP  46           3HB      ASP  46 -39.984  -2.864 -22.978
  377    H    GLY  47           H        GLY  47 -37.772  -2.482 -19.953
  378    HA2  GLY  47           HA2      GLY  47 -39.410  -4.253 -18.539
  379    HA3  GLY  47           HA3      GLY  47 -38.019  -3.388 -17.869
  380    H    PHE  48           H        PHE  48 -38.734  -0.804 -17.506
  381    HA   PHE  48           HA       PHE  48 -40.615  -0.714 -15.405
  382    HB2  PHE  48           2HB      PHE  48 -39.597   1.279 -15.250
  383    HB3  PHE  48           3HB      PHE  48 -39.022   1.212 -16.906
  384    HD1  PHE  48           HD2      PHE  48 -41.905   2.259 -14.764
  385    HD2  PHE  48           HD1      PHE  48 -40.130   2.442 -18.692
  386    HE1  PHE  48           HE2      PHE  48 -43.743   3.722 -15.537
  387    HE2  PHE  48           HE1      PHE  48 -41.967   3.902 -19.457
  388    HZ   PHE  48           HZ       PHE  48 -43.793   4.531 -17.892
  389    H    CYS  49           H        CYS  49 -41.095  -0.339 -18.889
  390    HA   CYS  49           HA       CYS  49 -43.787   0.676 -18.787
  391    HB2  CYS  49           2HB      CYS  49 -42.114   0.734 -20.747
  392    HB3  CYS  49           3HB      CYS  49 -42.644  -0.927 -21.094
  393    HG   CYS  49           HG       CYS  49 -45.236  -0.331 -21.149
  394    H    GLU  50           H        GLU  50 -42.447  -2.643 -18.861
  395    HA   GLU  50           HA       GLU  50 -45.104  -3.917 -18.887
  396    HB2  GLU  50           2HB      GLU  50 -42.360  -5.080 -18.275
  397    HB3  GLU  50           3HB      GLU  50 -43.845  -5.992 -18.564
  398    HG2  GLU  50           2HG      GLU  50 -43.988  -4.966 -20.855
  399    HG3  GLU  50           3HG      GLU  50 -42.411  -4.230 -20.590
  400    H    LEU  51           H        LEU  51 -42.839  -2.842 -16.432
  401    HA   LEU  51           HA       LEU  51 -43.873  -4.285 -14.191
  402    HB2  LEU  51           2HB      LEU  51 -41.710  -3.192 -14.274
  403    HB3  LEU  51           3HB      LEU  51 -42.446  -1.625 -14.492
  404    HG   LEU  51           HG       LEU  51 -43.507  -1.805 -12.229
  405   HD11  LEU  51          1HD1      LEU  51 -41.507  -4.082 -11.920
  406   HD12  LEU  51          2HD1      LEU  51 -42.452  -3.335 -10.619
  407   HD13  LEU  51          3HD1      LEU  51 -43.283  -4.240 -11.894
  408   HD21  LEU  51          3HD2      LEU  51 -41.404  -1.178 -11.080
  409   HD22  LEU  51          1HD2      LEU  51 -40.484  -1.761 -12.490
  410   HD23  LEU  51          2HD2      LEU  51 -41.600  -0.386 -12.650
  411    H    CYS  52           H        CYS  52 -44.457  -0.885 -15.197
  412    HA   CYS  52           HA       CYS  52 -46.799  -0.707 -13.397
  413    HB2  CYS  52           2HB      CYS  52 -45.402   1.354 -15.154
  414    HB3  CYS  52           3HB      CYS  52 -46.691   1.679 -13.980
  415    HG   CYS  52           HG       CYS  52 -44.417   2.456 -12.961
  416    H    GLY  53           H        GLY  53 -46.257  -1.224 -16.822
  417    HA2  GLY  53           HA2      GLY  53 -47.799  -1.536 -18.542
  418    HA3  GLY  53           HA3      GLY  53 -49.128  -1.329 -17.405
  419    H    TYR  54           H        TYR  54 -46.673   1.200 -17.570
  420    HA   TYR  54           HA       TYR  54 -48.721   3.133 -18.478
  421    HB2  TYR  54           2HB      TYR  54 -45.920   3.516 -17.382
  422    HB3  TYR  54           3HB      TYR  54 -47.071   4.801 -17.724
  423    HD1  TYR  54           HD1      TYR  54 -49.227   2.516 -16.269
  424    HD2  TYR  54           HD2      TYR  54 -45.851   5.023 -15.299
  425    HE1  TYR  54           HE1      TYR  54 -49.922   2.526 -13.892
  426    HE2  TYR  54           HE2      TYR  54 -46.574   5.054 -12.916
  427    HH   TYR  54           HH       TYR  54 -49.427   3.232 -11.766
  428    H    SER  55           H        SER  55 -46.068   4.682 -19.301
  429    HA   SER  55           HA       SER  55 -45.228   3.546 -21.837
  430    HB2  SER  55           2HB      SER  55 -47.340   4.570 -22.568
  431    HB3  SER  55           3HB      SER  55 -46.907   6.094 -21.768
  432    HG   SER  55           HG       SER  55 -46.452   5.966 -24.090
  433    H    ARG  56           H        ARG  56 -43.329   4.668 -22.583
  434    HA   ARG  56           HA       ARG  56 -41.681   6.024 -20.667
  435    HB2  ARG  56           2HB      ARG  56 -40.334   6.747 -22.640
  436    HB3  ARG  56           3HB      ARG  56 -40.574   5.021 -22.476
  437    HG2  ARG  56           2HG      ARG  56 -42.525   6.393 -24.289
  438    HG3  ARG  56           3HG      ARG  56 -40.847   6.456 -24.806
  439    HD2  ARG  56           2HD      ARG  56 -42.334   3.896 -24.105
  440    HD3  ARG  56           3HD      ARG  56 -42.084   4.515 -25.745
  441    HE   ARG  56           HE       ARG  56 -39.527   4.417 -24.798
  442   HH11  ARG  56          2HH1      ARG  56 -41.994   1.922 -24.956
  443   HH12  ARG  56          1HH1      ARG  56 -40.800   0.636 -24.927
  444   HH21  ARG  56          2HH2      ARG  56 -38.091   2.720 -24.776
  445   HH22  ARG  56          1HH2      ARG  56 -38.681   1.075 -24.841
  446    H    ALA  57           H        ALA  57 -43.986   7.366 -22.984
  447    HA   ALA  57           HA       ALA  57 -43.333  10.123 -22.636
  448    HB1  ALA  57           3HB      ALA  57 -45.961   8.769 -23.391
  449    HB2  ALA  57           1HB      ALA  57 -45.547  10.475 -23.673
  450    HB3  ALA  57           2HB      ALA  57 -44.647   9.196 -24.512
  451    H    GLU  58           H        GLU  58 -45.008   7.934 -20.477
  452    HA   GLU  58           HA       GLU  58 -46.232  10.091 -18.887
  453    HB2  GLU  58           2HB      GLU  58 -46.239   7.071 -18.538
  454    HB3  GLU  58           3HB      GLU  58 -47.042   8.230 -17.485
  455    HG2  GLU  58           2HG      GLU  58 -48.375   9.072 -19.412
  456    HG3  GLU  58           3HG      GLU  58 -47.626   7.866 -20.455
  457    H    VAL  59           H        VAL  59 -43.179   8.381 -18.952
  458    HA   VAL  59           HA       VAL  59 -42.572   9.352 -16.176
  459    HB   VAL  59           HB       VAL  59 -40.630   7.800 -16.238
  460   HG11  VAL  59          1HG1      VAL  59 -42.728   7.335 -15.010
  461   HG12  VAL  59          2HG1      VAL  59 -43.377   6.511 -16.443
  462   HG13  VAL  59          3HG1      VAL  59 -41.943   5.866 -15.600
  463   HG21  VAL  59          3HG2      VAL  59 -42.040   6.500 -18.566
  464   HG22  VAL  59          1HG2      VAL  59 -40.519   7.428 -18.679
  465   HG23  VAL  59          2HG2      VAL  59 -40.584   5.932 -17.725
  466    H    MET  60           H        MET  60 -41.752   9.876 -19.495
  467    HA   MET  60           HA       MET  60 -39.190  10.647 -19.535
  468    HB2  MET  60           2HB      MET  60 -41.651  11.526 -21.002
  469    HB3  MET  60           3HB      MET  60 -40.280  12.616 -21.129
  470    HG2  MET  60           2HG      MET  60 -40.167   9.676 -21.826
  471    HG3  MET  60           3HG      MET  60 -40.380  10.999 -22.962
  472    HE1  MET  60           3HE      MET  60 -37.896   9.167 -20.501
  473    HE2  MET  60           1HE      MET  60 -38.022   8.495 -22.143
  474    HE3  MET  60           2HE      MET  60 -36.501   9.238 -21.603
  475    H    GLN  61           H        GLN  61 -38.104  11.691 -18.119
  476    HA   GLN  61           HA       GLN  61 -37.104  13.402 -17.111
  477    HB2  GLN  61           2HB      GLN  61 -38.915  15.214 -18.702
  478    HB3  GLN  61           3HB      GLN  61 -37.351  15.626 -17.991
  479    HG2  GLN  61           2HG      GLN  61 -36.137  14.541 -19.667
  480    HG3  GLN  61           3HG      GLN  61 -37.358  13.310 -19.945
  481   HE21  GLN  61          2HE2      GLN  61 -37.917  13.377 -22.046
  482   HE22  GLN  61          1HE2      GLN  61 -38.426  14.835 -22.874
  483    H    ARG  62           H        ARG  62 -39.472  12.149 -15.869
  484    HA   ARG  62           HA       ARG  62 -40.332  14.326 -14.008
  485    HB2  ARG  62           2HB      ARG  62 -41.284  11.485 -14.503
  486    HB3  ARG  62           3HB      ARG  62 -41.964  12.605 -13.317
  487    HG2  ARG  62           2HG      ARG  62 -42.558  14.187 -15.193
  488    HG3  ARG  62           3HG      ARG  62 -41.893  13.027 -16.361
  489    HD2  ARG  62           2HD      ARG  62 -44.290  12.737 -16.230
  490    HD3  ARG  62           3HD      ARG  62 -43.425  11.313 -15.589
  491    HE   ARG  62           HE       ARG  62 -43.827  13.063 -13.448
  492   HH11  ARG  62          1HH2      ARG  62 -45.663  10.776 -15.352
  493   HH12  ARG  62          2HH2      ARG  62 -46.948  10.643 -14.172
  494   HH21  ARG  62          1HH1      ARG  62 -45.544  12.884 -11.965
  495   HH22  ARG  62          2HH1      ARG  62 -46.838  11.765 -12.274
  496    HA   PRO  63           HA       PRO  63 -37.776  12.981 -10.653
  497    HB2  PRO  63           2HB      PRO  63 -40.309  12.810  -9.026
  498    HB3  PRO  63           3HB      PRO  63 -38.728  13.522  -8.573
  499    HG2  PRO  63           2HG      PRO  63 -40.741  15.132  -9.385
  500    HG3  PRO  63           3HG      PRO  63 -39.088  15.399 -10.033
  501    HD2  PRO  63           2HD      PRO  63 -41.418  13.988 -11.348
  502    HD3  PRO  63           3HD      PRO  63 -40.255  15.158 -12.045
  503    H    CYS  64           H        CYS  64 -36.887  11.078 -10.093
  504    HA   CYS  64           HA       CYS  64 -38.024   8.534 -10.758
  505    HB2  CYS  64           2HB      CYS  64 -35.668   9.127 -10.854
  506    HB3  CYS  64           3HB      CYS  64 -35.616   9.388  -9.117
  507    HG   CYS  64           HG       CYS  64 -36.357   6.590 -10.754
  508    H    THR  65           H        THR  65 -38.363  10.444  -7.844
  509    HA   THR  65           HA       THR  65 -38.664   8.525  -5.886
  510    HB   THR  65           HB       THR  65 -40.288  11.071  -5.835
  511    HG1  THR  65           HG1      THR  65 -38.437  12.119  -5.156
  512   HG21  THR  65          1HG2      THR  65 -38.651   9.532  -3.773
  513   HG22  THR  65          2HG2      THR  65 -39.601  11.010  -3.464
  514   HG23  THR  65          3HG2      THR  65 -40.426   9.507  -3.901
  515    H    CYS  66           H        CYS  66 -39.777   6.842  -6.399
  516    HA   CYS  66           HA       CYS  66 -42.134   6.446  -7.660
  517    HB2  CYS  66           2HB      CYS  66 -42.261   4.268  -6.553
  518    HB3  CYS  66           3HB      CYS  66 -40.571   4.667  -6.911
  519    HG   CYS  66           HG       CYS  66 -40.048   5.671  -4.499
  520    H    ASP  67           H        ASP  67 -42.082   7.950  -4.572
  521    HA   ASP  67           HA       ASP  67 -44.688   7.449  -3.572
  522    HB2  ASP  67           2HB      ASP  67 -42.864   8.855  -2.475
  523    HB3  ASP  67           3HB      ASP  67 -43.243  10.129  -3.623
  524    H    PHE  68           H        PHE  68 -43.607   9.606  -6.239
  525    HA   PHE  68           HA       PHE  68 -46.143  10.887  -6.678
  526    HB2  PHE  68           2HB      PHE  68 -43.731  10.422  -8.476
  527    HB3  PHE  68           3HB      PHE  68 -45.113  11.397  -8.942
  528    HD1  PHE  68           HD2      PHE  68 -45.852  13.255  -7.120
  529    HD2  PHE  68           HD1      PHE  68 -41.890  11.631  -7.616
  530    HE1  PHE  68           HE2      PHE  68 -44.885  15.273  -6.041
  531    HE2  PHE  68           HE1      PHE  68 -40.927  13.645  -6.528
  532    HZ   PHE  68           HZ       PHE  68 -42.423  15.469  -5.740
  533    H    LEU  69           H        LEU  69 -45.211   7.660  -7.342
  534    HA   LEU  69           HA       LEU  69 -47.710   7.244  -8.861
  535    HB2  LEU  69           2HB      LEU  69 -46.654   5.492 -10.230
  536    HB3  LEU  69           3HB      LEU  69 -46.109   7.125 -10.533
  537    HG   LEU  69           HG       LEU  69 -44.018   6.622  -9.165
  538   HD11  LEU  69          1HD1      LEU  69 -43.345   4.257  -9.006
  539   HD12  LEU  69          2HD1      LEU  69 -44.743   4.571  -7.976
  540   HD13  LEU  69          3HD1      LEU  69 -44.966   3.745  -9.529
  541   HD21  LEU  69          3HD2      LEU  69 -44.069   6.679 -11.633
  542   HD22  LEU  69          1HD2      LEU  69 -42.931   5.470 -11.025
  543   HD23  LEU  69          2HD2      LEU  69 -44.508   4.955 -11.662
  544    H    HIS  70           H        HIS  70 -47.050   7.073  -5.932
  545    HA   HIS  70           HA       HIS  70 -47.131   4.315  -5.202
  546    HB2  HIS  70           2HB      HIS  70 -47.508   4.979  -3.047
  547    HB3  HIS  70           3HB      HIS  70 -46.670   6.363  -3.703
  548    HD2  HIS  70           HD2      HIS  70 -48.815   8.264  -4.777
  549    HE1  HIS  70           HE1      HIS  70 -51.168   7.536  -1.299
  550    HE2  HIS  70           HE2      HIS  70 -50.808   9.101  -3.276
  551    H    GLY  71           H        GLY  71 -48.813   2.952  -4.493
  552    HA2  GLY  71           HA2      GLY  71 -51.519   3.516  -5.655
  553    HA3  GLY  71           HA3      GLY  71 -50.715   1.955  -5.775
  554    HA   PRO  72           HA       PRO  72 -53.653   2.343  -2.111
  555    HB2  PRO  72           2HB      PRO  72 -54.749  -0.173  -3.377
  556    HB3  PRO  72           3HB      PRO  72 -55.632   1.147  -2.546
  557    HG2  PRO  72           2HG      PRO  72 -55.602   1.048  -5.243
  558    HG3  PRO  72           3HG      PRO  72 -55.326   2.619  -4.416
  559    HD2  PRO  72           2HD      PRO  72 -53.265   0.720  -5.572
  560    HD3  PRO  72           3HD      PRO  72 -53.400   2.490  -5.753
  561    H    ARG  73           H        ARG  73 -51.421  -0.095  -3.071
  562    HA   ARG  73           HA       ARG  73 -51.445  -1.324  -0.331
  563    HB2  ARG  73           2HB      ARG  73 -50.531  -2.485  -2.992
  564    HB3  ARG  73           3HB      ARG  73 -50.159  -3.207  -1.421
  565    HG2  ARG  73           2HG      ARG  73 -52.592  -3.314  -0.888
  566    HG3  ARG  73           3HG      ARG  73 -52.960  -2.728  -2.519
  567    HD2  ARG  73           2HD      ARG  73 -51.864  -4.702  -3.494
  568    HD3  ARG  73           3HD      ARG  73 -51.414  -5.279  -1.883
  569    HE   ARG  73           HE       ARG  73 -54.069  -5.070  -1.562
  570   HH11  ARG  73          1HH2      ARG  73 -52.430  -6.584  -4.314
  571   HH12  ARG  73          2HH2      ARG  73 -53.674  -7.793  -4.443
  572   HH21  ARG  73          1HH1      ARG  73 -55.611  -6.598  -1.886
  573   HH22  ARG  73          2HH1      ARG  73 -55.429  -7.771  -3.154
  574    H    THR  74           H        THR  74 -49.801   1.079  -1.931
  575    HA   THR  74           HA       THR  74 -47.101   0.295  -1.109
  576    HB   THR  74           HB       THR  74 -47.895   3.074  -1.971
  577    HG1  THR  74           HG1      THR  74 -46.955   1.335  -3.895
  578   HG21  THR  74          1HG2      THR  74 -45.368   1.376  -2.194
  579   HG22  THR  74          2HG2      THR  74 -45.583   2.932  -3.031
  580   HG23  THR  74          3HG2      THR  74 -45.580   2.871  -1.266
  581    H    GLN  75           H        GLN  75 -45.896   0.994   0.565
  582    HA   GLN  75           HA       GLN  75 -47.262   2.472   2.735
  583    HB2  GLN  75           2HB      GLN  75 -44.525   1.184   2.656
  584    HB3  GLN  75           3HB      GLN  75 -45.249   2.005   4.033
  585    HG2  GLN  75           2HG      GLN  75 -47.121   0.340   4.030
  586    HG3  GLN  75           3HG      GLN  75 -46.292  -0.546   2.743
  587   HE21  GLN  75          2HE2      GLN  75 -44.726  -2.084   3.409
  588   HE22  GLN  75          1HE2      GLN  75 -44.100  -2.149   5.049
  589    H    ARG  76           H        ARG  76 -46.845   4.466   3.320
  590    HA   ARG  76           HA       ARG  76 -45.337   6.236   1.540
  591    HB2  ARG  76           2HB      ARG  76 -46.532   6.953   4.208
  592    HB3  ARG  76           3HB      ARG  76 -46.049   8.057   2.919
  593    HG2  ARG  76           2HG      ARG  76 -48.387   6.109   2.913
  594    HG3  ARG  76           3HG      ARG  76 -48.462   7.863   2.891
  595    HD2  ARG  76           2HD      ARG  76 -47.332   6.120   0.643
  596    HD3  ARG  76           3HD      ARG  76 -48.967   6.750   0.685
  597    HE   ARG  76           HE       ARG  76 -46.575   8.189  -0.130
  598   HH11  ARG  76          2HH1      ARG  76 -49.770   8.788   1.222
  599   HH12  ARG  76          1HH1      ARG  76 -49.816  10.392   0.543
  600   HH21  ARG  76          1HH2      ARG  76 -46.711  10.126  -0.945
  601   HH22  ARG  76          2HH2      ARG  76 -48.108  11.152  -0.662
  602    H    ARG  77           H        ARG  77 -44.740   4.917   4.795
  603    HA   ARG  77           HA       ARG  77 -42.179   6.066   5.217
  604    HB2  ARG  77           2HB      ARG  77 -41.694   4.231   6.650
  605    HB3  ARG  77           3HB      ARG  77 -43.336   4.858   6.902
  606    HG2  ARG  77           2HG      ARG  77 -44.304   2.924   5.792
  607    HG3  ARG  77           3HG      ARG  77 -42.692   2.306   5.374
  608    HD2  ARG  77           2HD      ARG  77 -43.425   1.087   7.253
  609    HD3  ARG  77           3HD      ARG  77 -42.156   2.161   7.807
  610    HE   ARG  77           HE       ARG  77 -43.698   3.390   9.076
  611   HH11  ARG  77          1HH1      ARG  77 -45.505   0.963   7.249
  612   HH12  ARG  77          2HH1      ARG  77 -46.943   1.240   8.197
  613   HH21  ARG  77          1HH2      ARG  77 -45.574   3.661  10.205
  614   HH22  ARG  77          2HH2      ARG  77 -46.978   2.713   9.812
  615    H    ALA  78           H        ALA  78 -43.010   3.321   3.176
  616    HA   ALA  78           HA       ALA  78 -40.295   2.566   2.480
  617    HB1  ALA  78           3HB      ALA  78 -42.171   1.005   2.170
  618    HB2  ALA  78           1HB      ALA  78 -42.913   2.074   0.952
  619    HB3  ALA  78           2HB      ALA  78 -41.383   1.341   0.639
  620    H    ALA  79           H        ALA  79 -42.811   4.532   0.826
  621    HA   ALA  79           HA       ALA  79 -41.139   5.315  -1.370
  622    HB1  ALA  79           3HB      ALA  79 -42.958   6.741  -1.938
  623    HB2  ALA  79           1HB      ALA  79 -43.671   5.284  -1.242
  624    HB3  ALA  79           2HB      ALA  79 -43.565   6.777  -0.268
  625    H    ALA  80           H        ALA  80 -41.706   6.812   1.789
  626    HA   ALA  80           HA       ALA  80 -40.329   9.252   1.334
  627    HB1  ALA  80           3HB      ALA  80 -41.993   8.957   3.099
  628    HB2  ALA  80           1HB      ALA  80 -40.961   7.751   3.905
  629    HB3  ALA  80           2HB      ALA  80 -40.438   9.448   3.802
  630    H    GLN  81           H        GLN  81 -39.186   6.214   3.003
  631    HA   GLN  81           HA       GLN  81 -36.468   6.955   3.347
  632    HB2  GLN  81           2HB      GLN  81 -38.036   4.446   3.267
  633    HB3  GLN  81           3HB      GLN  81 -36.414   4.264   2.645
  634    HG2  GLN  81           2HG      GLN  81 -36.455   3.798   5.023
  635    HG3  GLN  81           3HG      GLN  81 -35.403   5.160   4.645
  636   HE21  GLN  81          2HE2      GLN  81 -39.024   4.974   5.263
  637   HE22  GLN  81          1HE2      GLN  81 -38.927   6.108   6.603
  638    H    ILE  82           H        ILE  82 -38.081   5.656   0.403
  639    HA   ILE  82           HA       ILE  82 -35.681   5.727  -1.206
  640    HB   ILE  82           HB       ILE  82 -38.633   5.789  -1.835
  641   HG12  ILE  82          2HG1      ILE  82 -36.415   3.807  -2.516
  642   HG13  ILE  82          3HG1      ILE  82 -37.318   3.768  -0.997
  643   HG21  ILE  82          1HG2      ILE  82 -37.701   7.187  -3.564
  644   HG22  ILE  82          2HG2      ILE  82 -36.331   6.078  -3.803
  645   HG23  ILE  82          3HG2      ILE  82 -37.976   5.588  -4.272
  646   HD11  ILE  82          3HD1      ILE  82 -38.316   2.218  -2.464
  647   HD12  ILE  82          1HD1      ILE  82 -39.436   3.578  -2.217
  648   HD13  ILE  82          2HD1      ILE  82 -38.518   3.428  -3.746
  649    H    ALA  83           H        ALA  83 -38.237   8.228  -0.777
  650    HA   ALA  83           HA       ALA  83 -37.062  10.254  -2.310
  651    HB1  ALA  83           3HB      ALA  83 -39.312  10.252  -1.128
  652    HB2  ALA  83           1HB      ALA  83 -38.445  10.713   0.355
  653    HB3  ALA  83           2HB      ALA  83 -38.389  11.781  -1.048
  654    H    GLN  84           H        GLN  84 -36.189   9.237   0.984
  655    HA   GLN  84           HA       GLN  84 -34.297  11.363   1.509
  656    HB2  GLN  84           2HB      GLN  84 -34.120   8.598   2.708
  657    HB3  GLN  84           3HB      GLN  84 -33.435  10.097   3.288
  658    HG2  GLN  84           2HG      GLN  84 -36.274   9.165   3.452
  659    HG3  GLN  84           3HG      GLN  84 -35.227   9.678   4.722
  660   HE21  GLN  84          1HE2      GLN  84 -37.671  10.664   2.534
  661   HE22  GLN  84          2HE2      GLN  84 -37.642  12.386   2.941
  662    H    ALA  85           H        ALA  85 -34.022   8.128  -0.019
  663    HA   ALA  85           HA       ALA  85 -31.144   8.337  -0.400
  664    HB1  ALA  85           3HB      ALA  85 -32.323   6.171  -0.301
  665    HB2  ALA  85           1HB      ALA  85 -33.190   6.566  -1.801
  666    HB3  ALA  85           2HB      ALA  85 -31.429   6.366  -1.821
  667    H    LEU  86           H        LEU  86 -33.932   9.446  -2.291
  668    HA   LEU  86           HA       LEU  86 -32.252  10.039  -4.605
  669    HB2  LEU  86           2HB      LEU  86 -35.113  10.915  -4.235
  670    HB3  LEU  86           3HB      LEU  86 -34.168  10.794  -5.710
  671    HG   LEU  86           HG       LEU  86 -35.576   8.688  -4.142
  672   HD11  LEU  86          1HD1      LEU  86 -35.034   8.993  -7.105
  673   HD12  LEU  86          2HD1      LEU  86 -36.267   7.962  -6.344
  674   HD13  LEU  86          3HD1      LEU  86 -36.398   9.733  -6.259
  675   HD21  LEU  86          3HD2      LEU  86 -34.364   6.866  -5.443
  676   HD22  LEU  86          1HD2      LEU  86 -33.126   8.065  -5.880
  677   HD23  LEU  86          2HD2      LEU  86 -33.373   7.582  -4.188
  678    H    LEU  87           H        LEU  87 -33.633  11.991  -1.962
  679    HA   LEU  87           HA       LEU  87 -32.471  14.465  -3.027
  680    HB2  LEU  87           2HB      LEU  87 -32.768  15.412  -0.794
  681    HB3  LEU  87           3HB      LEU  87 -34.238  14.805  -1.554
  682    HG   LEU  87           HG       LEU  87 -33.503  12.693   0.047
  683   HD11  LEU  87          1HD1      LEU  87 -31.676  13.974   1.116
  684   HD12  LEU  87          2HD1      LEU  87 -32.852  15.211   1.607
  685   HD13  LEU  87          3HD1      LEU  87 -32.982  13.563   2.251
  686   HD21  LEU  87          3HD2      LEU  87 -35.189  15.110   0.843
  687   HD22  LEU  87          1HD2      LEU  87 -35.759  13.721  -0.102
  688   HD23  LEU  87          2HD2      LEU  87 -35.282  13.500   1.586
  689    H    GLY  88           H        GLY  88 -31.271  11.804  -1.016
  690    HA2  GLY  88           HA2      GLY  88 -28.984  11.203  -1.425
  691    HA3  GLY  88           HA3      GLY  88 -28.522  12.899  -1.531
  692    H    ALA  89           H        ALA  89 -30.687  11.939   1.080
  693    HA   ALA  89           HA       ALA  89 -28.941  12.759   3.173
  694    HB1  ALA  89           3HB      ALA  89 -31.232  10.752   3.223
  695    HB2  ALA  89           1HB      ALA  89 -30.489  11.499   4.650
  696    HB3  ALA  89           2HB      ALA  89 -31.355  12.509   3.484
  697    H    GLU  90           H        GLU  90 -29.622   9.457   1.974
  698    HA   GLU  90           HA       GLU  90 -26.905   8.632   1.959
  699    HB2  GLU  90           2HB      GLU  90 -27.120   6.724   3.542
  700    HB3  GLU  90           3HB      GLU  90 -27.043   8.293   4.326
  701    HG2  GLU  90           2HG      GLU  90 -29.548   8.253   4.596
  702    HG3  GLU  90           3HG      GLU  90 -29.557   6.621   3.915
  703    H    GLU  91           H        GLU  91 -26.656   6.585   0.845
  704    HA   GLU  91           HA       GLU  91 -28.982   5.906  -0.863
  705    HB2  GLU  91           2HB      GLU  91 -26.015   5.200  -0.969
  706    HB3  GLU  91           3HB      GLU  91 -27.241   4.409  -1.948
  707    HG2  GLU  91           2HG      GLU  91 -26.523   6.069  -3.377
  708    HG3  GLU  91           3HG      GLU  91 -28.017   6.729  -2.710
  709    H    ARG  92           H        ARG  92 -30.158   4.212  -0.626
  710    HA   ARG  92           HA       ARG  92 -29.182   1.712   0.521
  711    HB2  ARG  92           2HB      ARG  92 -30.144   3.321   2.470
  712    HB3  ARG  92           3HB      ARG  92 -31.690   2.767   1.863
  713    HG2  ARG  92           2HG      ARG  92 -31.131   1.299   3.648
  714    HG3  ARG  92           3HG      ARG  92 -30.848   0.373   2.189
  715    HD2  ARG  92           2HD      ARG  92 -28.905  -0.145   3.244
  716    HD3  ARG  92           3HD      ARG  92 -28.326   1.342   2.506
  717    HE   ARG  92           HE       ARG  92 -29.012   0.843   5.340
  718   HH11  ARG  92          2HH2      ARG  92 -27.937   3.396   3.078
  719   HH12  ARG  92          1HH2      ARG  92 -27.738   4.482   4.462
  720   HH21  ARG  92          1HH1      ARG  92 -28.610   2.387   6.899
  721   HH22  ARG  92          2HH1      ARG  92 -28.084   3.985   6.368
  722    H    LYS  93           H        LYS  93 -30.422  -0.087   0.060
  723    HA   LYS  93           HA       LYS  93 -32.453   0.092  -2.063
  724    HB2  LYS  93           2HB      LYS  93 -30.712  -1.742  -1.846
  725    HB3  LYS  93           3HB      LYS  93 -31.607  -2.323  -0.434
  726    HG2  LYS  93           2HG      LYS  93 -33.648  -2.392  -2.095
  727    HG3  LYS  93           3HG      LYS  93 -32.412  -2.260  -3.345
  728    HD2  LYS  93           2HD      LYS  93 -32.516  -4.415  -1.192
  729    HD3  LYS  93           3HD      LYS  93 -33.066  -4.614  -2.858
  730    HE2  LYS  93           2HE      LYS  93 -30.748  -3.977  -3.630
  731    HE3  LYS  93           3HE      LYS  93 -30.221  -4.003  -1.937
  732    HZ1  LYS  93           HZ1      LYS  93 -29.740  -6.122  -2.931
  733    HZ2  LYS  93           HZ2      LYS  93 -31.007  -6.391  -1.924
  734    HZ3  LYS  93           HZ3      LYS  93 -31.239  -6.260  -3.557
  735    H    VAL  94           H        VAL  94 -34.608  -0.108  -1.794
  736    HA   VAL  94           HA       VAL  94 -35.778  -0.759   0.875
  737    HB   VAL  94           HB       VAL  94 -36.868   1.555  -0.726
  738   HG11  VAL  94          1HG1      VAL  94 -36.988   0.904   2.252
  739   HG12  VAL  94          2HG1      VAL  94 -37.797   2.265   1.445
  740   HG13  VAL  94          3HG1      VAL  94 -38.289   0.619   1.079
  741   HG21  VAL  94          3HG2      VAL  94 -34.585   2.312  -0.247
  742   HG22  VAL  94          1HG2      VAL  94 -35.730   3.175   0.762
  743   HG23  VAL  94          2HG2      VAL  94 -34.774   1.850   1.466
  744    H    GLU  95           H        GLU  95 -37.804  -1.626   0.808
  745    HA   GLU  95           HA       GLU  95 -38.683  -2.803  -1.756
  746    HB2  GLU  95           2HB      GLU  95 -40.228  -4.061  -0.372
  747    HB3  GLU  95           3HB      GLU  95 -38.572  -4.192   0.261
  748    HG2  GLU  95           2HG      GLU  95 -39.098  -2.490   2.000
  749    HG3  GLU  95           3HG      GLU  95 -40.740  -2.345   1.389
  750    H    ILE  96           H        ILE  96 -40.890  -2.447  -2.524
  751    HA   ILE  96           HA       ILE  96 -42.571  -0.467  -1.372
  752    HB   ILE  96           HB       ILE  96 -42.441   0.839  -3.803
  753   HG12  ILE  96          2HG1      ILE  96 -40.170   1.648  -4.181
  754   HG13  ILE  96          3HG1      ILE  96 -39.536   0.508  -2.985
  755   HG21  ILE  96          1HG2      ILE  96 -40.935   1.846  -1.416
  756   HG22  ILE  96          2HG2      ILE  96 -41.782   2.758  -2.664
  757   HG23  ILE  96          3HG2      ILE  96 -42.718   1.802  -1.520
  758   HD11  ILE  96          3HD1      ILE  96 -40.818  -0.168  -5.638
  759   HD12  ILE  96          1HD1      ILE  96 -39.100  -0.351  -5.178
  760   HD13  ILE  96          2HD1      ILE  96 -40.330  -1.361  -4.427
  761    H    ALA  97           H        ALA  97 -44.593  -0.332  -2.347
  762    HA   ALA  97           HA       ALA  97 -45.183  -2.587  -4.164
  763    HB1  ALA  97           3HB      ALA  97 -47.287  -0.832  -2.932
  764    HB2  ALA  97           1HB      ALA  97 -47.430  -2.483  -3.494
  765    HB3  ALA  97           2HB      ALA  97 -46.533  -2.149  -2.004
  766    H    PHE  98           H        PHE  98 -46.252  -2.437  -6.098
  767    HA   PHE  98           HA       PHE  98 -46.567   0.276  -7.331
  768    HB2  PHE  98           2HB      PHE  98 -45.660  -2.305  -8.656
  769    HB3  PHE  98           3HB      PHE  98 -46.075  -0.831  -9.518
  770    HD1  PHE  98           HD1      PHE  98 -44.856   1.384  -8.540
  771    HD2  PHE  98           HD2      PHE  98 -43.342  -2.656  -8.302
  772    HE1  PHE  98           HE1      PHE  98 -42.549   2.256  -8.254
  773    HE2  PHE  98           HE2      PHE  98 -41.045  -1.771  -8.074
  774    HZ   PHE  98           HZ       PHE  98 -40.658   0.690  -8.010
  775    H    TYR  99           H        TYR  99 -48.160   0.395  -9.032
  776    HA   TYR  99           HA       TYR  99 -50.183  -1.740  -9.003
  777    HB2  TYR  99           2HB      TYR  99 -52.029  -0.378  -8.877
  778    HB3  TYR  99           3HB      TYR  99 -50.993   0.145  -7.562
  779    HD1  TYR  99           HD1      TYR  99 -49.622   2.340  -7.906
  780    HD2  TYR  99           HD2      TYR  99 -52.861   1.120 -10.486
  781    HE1  TYR  99           HE1      TYR  99 -49.921   4.692  -8.661
  782    HE2  TYR  99           HE2      TYR  99 -53.138   3.468 -11.250
  783    HH   TYR  99           HH       TYR  99 -52.417   5.634 -11.053
  784    H    ARG 100           H        ARG 100 -50.902  -2.363 -10.878
  785    HA   ARG 100           HA       ARG 100 -49.751  -1.440 -13.374
  786    HB2  ARG 100           2HB      ARG 100 -51.879  -3.454 -12.562
  787    HB3  ARG 100           3HB      ARG 100 -51.598  -3.105 -14.261
  788    HG2  ARG 100           2HG      ARG 100 -49.275  -3.866 -12.470
  789    HG3  ARG 100           3HG      ARG 100 -50.343  -5.103 -13.155
  790    HD2  ARG 100           2HD      ARG 100 -49.864  -4.320 -15.438
  791    HD3  ARG 100           3HD      ARG 100 -48.910  -2.980 -14.804
  792    HE   ARG 100           HE       ARG 100 -47.125  -4.352 -14.407
  793   HH11  ARG 100          1HH2      ARG 100 -49.851  -6.533 -14.854
  794   HH12  ARG 100          2HH2      ARG 100 -48.813  -7.903 -15.130
  795   HH21  ARG 100          1HH1      ARG 100 -45.954  -6.045 -15.220
  796   HH22  ARG 100          2HH1      ARG 100 -46.626  -7.655 -15.195
  797    H    LYS 101           H        LYS 101 -50.725  -0.432 -15.088
  798    HA   LYS 101           HA       LYS 101 -52.770   1.516 -14.831
  799    HB2  LYS 101           2HB      LYS 101 -51.195   1.548 -16.596
  800    HB3  LYS 101           3HB      LYS 101 -51.625  -0.053 -17.170
  801    HG2  LYS 101           2HG      LYS 101 -53.728   2.124 -17.225
  802    HG3  LYS 101           3HG      LYS 101 -52.409   2.168 -18.400
  803    HD2  LYS 101           2HD      LYS 101 -52.908  -0.086 -19.170
  804    HD3  LYS 101           3HD      LYS 101 -54.218  -0.252 -17.996
  805    HE2  LYS 101           2HE      LYS 101 -55.414   1.655 -19.022
  806    HE3  LYS 101           3HE      LYS 101 -54.103   1.862 -20.193
  807    HZ1  LYS 101           HZ1      LYS 101 -55.826  -0.554 -19.971
  808    HZ2  LYS 101           HZ2      LYS 101 -55.936   0.580 -21.137
  809    HZ3  LYS 101           HZ3      LYS 101 -54.611  -0.366 -21.051
  810    H    ASP 102           H        ASP 102 -53.095  -1.932 -15.449
  811    HA   ASP 102           HA       ASP 102 -55.936  -1.895 -15.983
  812    HB2  ASP 102           2HB      ASP 102 -54.249  -3.590 -16.781
  813    HB3  ASP 102           3HB      ASP 102 -54.158  -4.208 -15.132
  814    H    GLY 103           H        GLY 103 -54.290  -1.444 -13.039
  815    HA2  GLY 103           HA2      GLY 103 -55.382  -0.850 -11.075
  816    HA3  GLY 103           HA3      GLY 103 -56.786  -1.817 -11.503
  817    H    SER 104           H        SER 104 -53.847  -3.606 -11.790
  818    HA   SER 104           HA       SER 104 -54.439  -5.134  -9.315
  819    HB2  SER 104           2HB      SER 104 -52.372  -5.637 -11.483
  820    HB3  SER 104           3HB      SER 104 -52.751  -6.712 -10.125
  821    HG   SER 104           HG       SER 104 -53.879  -7.310 -12.039
  822    H    CYS 105           H        CYS 105 -53.199  -5.126  -7.467
  823    HA   CYS 105           HA       CYS 105 -50.863  -3.248  -7.370
  824    HB2  CYS 105           2HB      CYS 105 -52.992  -3.776  -5.258
  825    HB3  CYS 105           3HB      CYS 105 -51.664  -2.606  -5.149
  826    HG   CYS 105           HG       CYS 105 -52.410  -1.162  -7.209
  827    H    PHE 106           H        PHE 106 -48.973  -3.950  -6.440
  828    HA   PHE 106           HA       PHE 106 -48.974  -6.308  -4.641
  829    HB2  PHE 106           2HB      PHE 106 -47.220  -7.413  -6.093
  830    HB3  PHE 106           3HB      PHE 106 -48.868  -7.456  -6.679
  831    HD1  PHE 106           HD1      PHE 106 -45.532  -5.848  -7.211
  832    HD2  PHE 106           HD2      PHE 106 -49.514  -6.444  -8.757
  833    HE1  PHE 106           HE1      PHE 106 -44.847  -4.843  -9.377
  834    HE2  PHE 106           HE2      PHE 106 -48.816  -5.476 -10.925
  835    HZ   PHE 106           HZ       PHE 106 -46.486  -4.652 -11.239
  836    H    LEU 107           H        LEU 107 -47.351  -6.418  -3.214
  837    HA   LEU 107           HA       LEU 107 -45.062  -4.512  -3.353
  838    HB2  LEU 107           2HB      LEU 107 -46.523  -4.412  -1.330
  839    HB3  LEU 107           3HB      LEU 107 -46.202  -6.101  -1.020
  840    HG   LEU 107           HG       LEU 107 -44.992  -4.629   0.466
  841   HD11  LEU 107          1HD1      LEU 107 -42.812  -5.559   0.433
  842   HD12  LEU 107          2HD1      LEU 107 -43.832  -6.819  -0.303
  843   HD13  LEU 107          3HD1      LEU 107 -42.801  -5.774  -1.301
  844   HD21  LEU 107          3HD2      LEU 107 -43.458  -3.603  -1.894
  845   HD22  LEU 107          1HD2      LEU 107 -44.652  -2.689  -0.916
  846   HD23  LEU 107          2HD2      LEU 107 -43.137  -3.232  -0.191
  847    H    CYS 108           H        CYS 108 -43.150  -5.332  -3.880
  848    HA   CYS 108           HA       CYS 108 -42.520  -8.185  -3.300
  849    HB2  CYS 108           2HB      CYS 108 -41.800  -6.719  -5.873
  850    HB3  CYS 108           3HB      CYS 108 -41.349  -8.382  -5.435
  851    HG   CYS 108           HG       CYS 108 -43.951  -9.107  -5.022
  852    H    LEU 109           H        LEU 109 -40.023  -8.497  -3.381
  853    HA   LEU 109           HA       LEU 109 -38.854  -6.435  -1.617
  854    HB2  LEU 109           2HB      LEU 109 -37.724  -9.081  -2.605
  855    HB3  LEU 109           3HB      LEU 109 -37.057  -8.071  -1.326
  856    HG   LEU 109           HG       LEU 109 -39.732  -9.541  -1.235
  857   HD11  LEU 109          1HD1      LEU 109 -37.118 -10.037   0.242
  858   HD12  LEU 109          2HD1      LEU 109 -38.634 -10.943   0.446
  859   HD13  LEU 109          3HD1      LEU 109 -37.764 -11.015  -1.095
  860   HD21  LEU 109          3HD2      LEU 109 -38.325  -7.881   0.903
  861   HD22  LEU 109          1HD2      LEU 109 -39.876  -7.497   0.120
  862   HD23  LEU 109          2HD2      LEU 109 -39.748  -8.911   1.169
  863    H    VAL 110           H        VAL 110 -39.218  -5.032  -3.635
  864    HA   VAL 110           HA       VAL 110 -37.802  -5.309  -5.987
  865    HB   VAL 110           HB       VAL 110 -38.739  -2.756  -4.696
  866   HG11  VAL 110          1HG1      VAL 110 -37.272  -2.215  -6.616
  867   HG12  VAL 110          2HG1      VAL 110 -38.196  -3.341  -7.629
  868   HG13  VAL 110          3HG1      VAL 110 -38.950  -1.866  -7.013
  869   HG21  VAL 110          3HG2      VAL 110 -40.766  -3.070  -6.147
  870   HG22  VAL 110          1HG2      VAL 110 -40.114  -4.626  -6.698
  871   HG23  VAL 110          2HG2      VAL 110 -40.595  -4.382  -5.007
  872    H    ASP 111           H        ASP 111 -35.944  -4.233  -6.942
  873    HA   ASP 111           HA       ASP 111 -33.807  -4.129  -4.840
  874    HB2  ASP 111           2HB      ASP 111 -33.949  -5.901  -6.732
  875    HB3  ASP 111           3HB      ASP 111 -33.244  -4.646  -7.746
  876    H    VAL 112           H        VAL 112 -34.594  -1.870  -4.479
  877    HA   VAL 112           HA       VAL 112 -34.050   0.098  -6.528
  878    HB   VAL 112           HB       VAL 112 -34.868   0.512  -3.624
  879   HG11  VAL 112          1HG1      VAL 112 -34.239   2.639  -4.793
  880   HG12  VAL 112          2HG1      VAL 112 -35.368   2.216  -6.103
  881   HG13  VAL 112          3HG1      VAL 112 -35.969   2.545  -4.473
  882   HG21  VAL 112          3HG2      VAL 112 -36.424  -1.043  -4.673
  883   HG22  VAL 112          1HG2      VAL 112 -37.176   0.550  -4.590
  884   HG23  VAL 112          2HG2      VAL 112 -36.493  -0.045  -6.133
  885    H    VAL 113           H        VAL 113 -31.745  -0.596  -6.679
  886    HA   VAL 113           HA       VAL 113 -30.002   0.852  -4.731
  887    HB   VAL 113           HB       VAL 113 -29.202  -1.292  -6.741
  888   HG11  VAL 113          1HG1      VAL 113 -27.313   0.189  -6.133
  889   HG12  VAL 113          2HG1      VAL 113 -27.674  -0.040  -4.407
  890   HG13  VAL 113          3HG1      VAL 113 -27.116  -1.401  -5.404
  891   HG21  VAL 113          3HG2      VAL 113 -30.631  -2.252  -4.984
  892   HG22  VAL 113          1HG2      VAL 113 -28.955  -2.759  -4.771
  893   HG23  VAL 113          2HG2      VAL 113 -29.620  -1.475  -3.735
  894    HA   PRO 114           HA       PRO 114 -29.366   3.628  -8.315
  895    HB2  PRO 114           2HB      PRO 114 -27.919   5.559  -7.235
  896    HB3  PRO 114           3HB      PRO 114 -29.578   5.245  -6.681
  897    HG2  PRO 114           2HG      PRO 114 -26.992   4.299  -5.385
  898    HG3  PRO 114           3HG      PRO 114 -28.388   5.129  -4.613
  899    HD2  PRO 114           2HD      PRO 114 -28.083   2.387  -4.633
  900    HD3  PRO 114           3HD      PRO 114 -29.672   3.203  -4.615
  901    H    VAL 115           H        VAL 115 -26.961   4.936  -9.095
  902    HA   VAL 115           HA       VAL 115 -24.817   2.870  -8.942
  903    HB   VAL 115           HB       VAL 115 -24.179   3.324 -11.278
  904   HG11  VAL 115          1HG1      VAL 115 -26.875   1.984 -10.871
  905   HG12  VAL 115          2HG1      VAL 115 -25.765   1.733 -12.235
  906   HG13  VAL 115          3HG1      VAL 115 -25.285   1.245 -10.601
  907   HG21  VAL 115          3HG2      VAL 115 -25.788   4.144 -12.872
  908   HG22  VAL 115          1HG2      VAL 115 -26.986   4.422 -11.582
  909   HG23  VAL 115          2HG2      VAL 115 -25.483   5.363 -11.627
  910    H    LYS 116           H        LYS 116 -22.946   3.415  -8.505
  911    HA   LYS 116           HA       LYS 116 -22.187   6.260  -8.148
  912    HB2  LYS 116           2HB      LYS 116 -21.314   3.815  -6.563
  913    HB3  LYS 116           3HB      LYS 116 -20.731   5.434  -6.280
  914    HG2  LYS 116           2HG      LYS 116 -22.627   6.107  -5.218
  915    HG3  LYS 116           3HG      LYS 116 -23.697   5.106  -6.178
  916    HD2  LYS 116           2HD      LYS 116 -23.171   3.145  -4.896
  917    HD3  LYS 116           3HD      LYS 116 -21.806   3.927  -4.085
  918    HE2  LYS 116           2HE      LYS 116 -24.627   5.028  -3.860
  919    HE3  LYS 116           3HE      LYS 116 -24.099   3.706  -2.814
  920    HZ1  LYS 116           HZ1      LYS 116 -23.753   6.245  -2.139
  921    HZ2  LYS 116           HZ2      LYS 116 -22.683   5.081  -1.678
  922    HZ3  LYS 116           HZ3      LYS 116 -22.336   6.038  -2.941
  923    H    ASN 117           H        ASN 117 -19.979   6.707  -8.081
  924    HA   ASN 117           HA       ASN 117 -18.405   5.327 -10.232
  925    HB2  ASN 117           2HB      ASN 117 -17.254   7.295 -10.636
  926    HB3  ASN 117           3HB      ASN 117 -18.891   7.835 -10.373
  927   HD21  ASN 117          2HD2      ASN 117 -19.338   8.778  -8.057
  928   HD22  ASN 117          1HD2      ASN 117 -17.951   9.585  -7.340
  929    H    GLU 118           H        GLU 118 -15.862   5.695  -9.743
  930    HA   GLU 118           HA       GLU 118 -15.190   3.775  -7.768
  931    HB2  GLU 118           2HB      GLU 118 -12.880   4.269  -8.354
  932    HB3  GLU 118           3HB      GLU 118 -13.900   4.118  -9.782
  933    HG2  GLU 118           2HG      GLU 118 -13.972   6.587 -10.016
  934    HG3  GLU 118           3HG      GLU 118 -12.990   6.763  -8.562
  935    H    ASP 119           H        ASP 119 -15.475   7.261  -7.373
  936    HA   ASP 119           HA       ASP 119 -14.095   7.398  -4.831
  937    HB2  ASP 119           2HB      ASP 119 -14.645   9.301  -6.468
  938    HB3  ASP 119           3HB      ASP 119 -16.283   9.251  -5.817
  939    H    GLY 120           H        GLY 120 -17.172   6.119  -5.726
  940    HA2  GLY 120           HA2      GLY 120 -18.591   4.887  -4.321
  941    HA3  GLY 120           HA3      GLY 120 -18.017   5.766  -2.904
  942    H    ALA 121           H        ALA 121 -18.640   8.089  -5.230
  943    HA   ALA 121           HA       ALA 121 -21.213   8.760  -3.979
  944    HB1  ALA 121           3HB      ALA 121 -20.865  10.973  -4.966
  945    HB2  ALA 121           1HB      ALA 121 -19.374  10.448  -4.152
  946    HB3  ALA 121           2HB      ALA 121 -19.503  10.367  -5.925
  947    H    VAL 122           H        VAL 122 -23.130   9.048  -4.898
  948    HA   VAL 122           HA       VAL 122 -23.733   7.394  -7.193
  949    HB   VAL 122           HB       VAL 122 -25.131   7.291  -5.292
  950   HG11  VAL 122          1HG1      VAL 122 -26.031  10.162  -5.710
  951   HG12  VAL 122          2HG1      VAL 122 -26.664   8.995  -4.547
  952   HG13  VAL 122          3HG1      VAL 122 -25.007   9.584  -4.376
  953   HG21  VAL 122          3HG2      VAL 122 -26.127   6.874  -7.498
  954   HG22  VAL 122          1HG2      VAL 122 -27.312   7.471  -6.320
  955   HG23  VAL 122          2HG2      VAL 122 -26.688   8.554  -7.571
  956    H    ILE 123           H        ILE 123 -22.999   8.135  -9.073
  957    HA   ILE 123           HA       ILE 123 -23.417  10.951  -9.797
  958    HB   ILE 123           HB       ILE 123 -22.012  10.762 -11.534
  959   HG12  ILE 123          2HG1      ILE 123 -22.768   8.919 -12.830
  960   HG13  ILE 123          3HG1      ILE 123 -21.044   8.807 -12.568
  961   HG21  ILE 123          1HG2      ILE 123 -20.937  10.573  -9.303
  962   HG22  ILE 123          2HG2      ILE 123 -20.816   8.821  -9.546
  963   HG23  ILE 123          3HG2      ILE 123 -19.954   9.935 -10.633
  964   HD11  ILE 123          3HD1      ILE 123 -21.937   6.604 -12.464
  965   HD12  ILE 123          1HD1      ILE 123 -21.503   7.034 -10.801
  966   HD13  ILE 123          2HD1      ILE 123 -23.201   7.068 -11.340
  967    H    MET 124           H        MET 124 -24.875   7.794 -10.471
  968    HA   MET 124           HA       MET 124 -26.997   9.278 -11.924
  969    HB2  MET 124           2HB      MET 124 -25.471   6.903 -13.047
  970    HB3  MET 124           3HB      MET 124 -27.160   7.197 -13.476
  971    HG2  MET 124           2HG      MET 124 -24.779   8.968 -13.949
  972    HG3  MET 124           3HG      MET 124 -25.722   8.121 -15.157
  973    HE1  MET 124           3HE      MET 124 -25.823  12.331 -14.709
  974    HE2  MET 124           1HE      MET 124 -24.714  11.203 -13.891
  975    HE3  MET 124           2HE      MET 124 -24.936  11.101 -15.647
  976    H    PHE 125           H        PHE 125 -28.976   8.370 -11.891
  977    HA   PHE 125           HA       PHE 125 -29.473   6.640  -9.499
  978    HB2  PHE 125           2HB      PHE 125 -30.834   9.061 -10.691
  979    HB3  PHE 125           3HB      PHE 125 -31.804   7.890  -9.843
  980    HD1  PHE 125           HD2      PHE 125 -29.565   7.343  -7.578
  981    HD2  PHE 125           HD1      PHE 125 -31.577  10.781  -9.227
  982    HE1  PHE 125           HE2      PHE 125 -29.219   8.559  -5.460
  983    HE2  PHE 125           HE1      PHE 125 -31.197  12.004  -7.101
  984    HZ   PHE 125           HZ       PHE 125 -29.984  10.902  -5.230
  985    H    ILE 126           H        ILE 126 -29.031   4.760 -10.842
  986    HA   ILE 126           HA       ILE 126 -31.314   4.115 -12.683
  987    HB   ILE 126           HB       ILE 126 -28.740   2.603 -12.336
  988   HG12  ILE 126          2HG1      ILE 126 -29.699   4.569 -14.474
  989   HG13  ILE 126          3HG1      ILE 126 -28.365   4.832 -13.362
  990   HG21  ILE 126          1HG2      ILE 126 -30.679   2.291 -14.642
  991   HG22  ILE 126          2HG2      ILE 126 -29.486   1.147 -14.009
  992   HG23  ILE 126          3HG2      ILE 126 -31.027   1.442 -13.171
  993   HD11  ILE 126          3HD1      ILE 126 -27.203   2.856 -14.336
  994   HD12  ILE 126          1HD1      ILE 126 -28.480   2.782 -15.574
  995   HD13  ILE 126          2HD1      ILE 126 -27.452   4.232 -15.459
  996    H    LEU 127           H        LEU 127 -32.569   4.303 -10.721
  997    HA   LEU 127           HA       LEU 127 -32.437   2.105  -8.813
  998    HB2  LEU 127           2HB      LEU 127 -34.578   4.210  -9.188
  999    HB3  LEU 127           3HB      LEU 127 -34.500   3.025  -7.909
 1000    HG   LEU 127           HG       LEU 127 -33.632   5.066  -7.017
 1001   HD11  LEU 127          1HD1      LEU 127 -31.569   4.619  -6.205
 1002   HD12  LEU 127          2HD1      LEU 127 -32.462   3.088  -6.318
 1003   HD13  LEU 127          3HD1      LEU 127 -31.262   3.497  -7.569
 1004   HD21  LEU 127          3HD2      LEU 127 -32.999   6.072  -9.269
 1005   HD22  LEU 127          1HD2      LEU 127 -32.108   6.505  -7.799
 1006   HD23  LEU 127          2HD2      LEU 127 -31.410   5.330  -8.921
 1007    H    ASN 128           H        ASN 128 -32.307   0.492 -10.059
 1008    HA   ASN 128           HA       ASN 128 -34.119  -0.605 -11.960
 1009    HB2  ASN 128           2HB      ASN 128 -32.276  -1.898  -9.910
 1010    HB3  ASN 128           3HB      ASN 128 -33.223  -2.845 -11.039
 1011   HD21  ASN 128          2HD2      ASN 128 -30.700  -0.189 -11.103
 1012   HD22  ASN 128          1HD2      ASN 128 -29.992  -0.864 -12.553
 1013    H    PHE 129           H        PHE 129 -36.363  -0.366 -11.436
 1014    HA   PHE 129           HA       PHE 129 -37.279  -1.320  -8.835
 1015    HB2  PHE 129           2HB      PHE 129 -38.878  -0.175 -11.123
 1016    HB3  PHE 129           3HB      PHE 129 -39.436  -0.635  -9.508
 1017    HD1  PHE 129           HD2      PHE 129 -38.205   0.516  -7.473
 1018    HD2  PHE 129           HD1      PHE 129 -38.346   2.118 -11.470
 1019    HE1  PHE 129           HE2      PHE 129 -37.763   2.788  -6.575
 1020    HE2  PHE 129           HE1      PHE 129 -37.904   4.390 -10.566
 1021    HZ   PHE 129           HZ       PHE 129 -37.604   4.730  -8.127
 1022    H    GLU 130           H        GLU 130 -36.123  -3.397  -9.754
 1023    HA   GLU 130           HA       GLU 130 -37.913  -5.103 -11.332
 1024    HB2  GLU 130           2HB      GLU 130 -36.214  -6.853 -10.890
 1025    HB3  GLU 130           3HB      GLU 130 -35.635  -5.396 -11.736
 1026    HG2  GLU 130           2HG      GLU 130 -34.550  -4.563  -9.796
 1027    HG3  GLU 130           3HG      GLU 130 -35.276  -5.770  -8.754
 1028    H    VAL 131           H        VAL 131 -39.380  -6.378 -10.652
 1029    HA   VAL 131           HA       VAL 131 -40.111  -6.769  -7.841
 1030    HB   VAL 131           HB       VAL 131 -41.106  -7.663 -10.522
 1031   HG11  VAL 131          1HG1      VAL 131 -41.906  -8.997  -7.925
 1032   HG12  VAL 131          2HG1      VAL 131 -42.968  -8.948  -9.350
 1033   HG13  VAL 131          3HG1      VAL 131 -41.400  -9.751  -9.443
 1034   HG21  VAL 131          3HG2      VAL 131 -43.163  -6.594  -9.796
 1035   HG22  VAL 131          1HG2      VAL 131 -42.514  -6.364  -8.159
 1036   HG23  VAL 131          2HG2      VAL 131 -41.799  -5.494  -9.531
 1037    H    VAL 132           H        VAL 132 -39.253  -8.257  -6.477
 1038    HA   VAL 132           HA       VAL 132 -38.603 -10.865  -7.602
 1039    HB   VAL 132           HB       VAL 132 -36.445  -9.875  -7.821
 1040   HG11  VAL 132          1HG1      VAL 132 -36.503  -8.124  -6.128
 1041   HG12  VAL 132          2HG1      VAL 132 -36.475  -9.348  -4.833
 1042   HG13  VAL 132          3HG1      VAL 132 -35.084  -9.153  -5.920
 1043   HG21  VAL 132          3HG2      VAL 132 -36.607 -12.271  -7.194
 1044   HG22  VAL 132          1HG2      VAL 132 -35.105 -11.503  -6.661
 1045   HG23  VAL 132          2HG2      VAL 132 -36.389 -11.819  -5.483
 1046    H    MET 133           H        MET 133 -38.839 -12.578  -6.106
 1047    HA   MET 133           HA       MET 133 -39.627 -11.947  -3.346
 1048    HB2  MET 133           2HB      MET 133 -41.750 -13.136  -3.492
 1049    HB3  MET 133           3HB      MET 133 -41.729 -11.746  -4.575
 1050    HG2  MET 133           2HG      MET 133 -41.213 -13.299  -6.490
 1051    HG3  MET 133           3HG      MET 133 -41.319 -14.658  -5.371
 1052    HE1  MET 133           3HE      MET 133 -43.644 -11.380  -5.796
 1053    HE2  MET 133           1HE      MET 133 -43.185 -11.938  -7.422
 1054    HE3  MET 133           2HE      MET 133 -44.869 -12.078  -6.872
 1055    H    GLU 134           H        GLU 134 -39.729 -13.813  -1.970
 1056    HA   GLU 134           HA       GLU 134 -37.919 -16.002  -2.734
 1057    HB2  GLU 134           2HB      GLU 134 -38.188 -16.803  -0.476
 1058    HB3  GLU 134           3HB      GLU 134 -37.749 -15.098  -0.497
 1059    HG2  GLU 134           2HG      GLU 134 -40.127 -14.485  -0.044
 1060    HG3  GLU 134           3HG      GLU 134 -40.554 -16.198  -0.005
 1061    H    LYS 135           H        LYS 135 -38.453 -18.180  -2.959
 1062    HA   LYS 135           HA       LYS 135 -41.308 -18.900  -3.408
 1063    HB2  LYS 135           2HB      LYS 135 -38.897 -19.321  -5.206
 1064    HB3  LYS 135           3HB      LYS 135 -40.415 -20.150  -5.424
 1065    HG2  LYS 135           2HG      LYS 135 -40.203 -17.092  -5.416
 1066    HG3  LYS 135           3HG      LYS 135 -39.924 -18.048  -6.857
 1067    HD2  LYS 135           2HD      LYS 135 -42.528 -18.065  -5.287
 1068    HD3  LYS 135           3HD      LYS 135 -42.208 -17.107  -6.737
 1069    HE2  LYS 135           2HE      LYS 135 -41.780 -19.198  -8.027
 1070    HE3  LYS 135           3HE      LYS 135 -42.161 -20.153  -6.588
 1071    HZ1  LYS 135           HZ1      LYS 135 -44.401 -19.198  -6.626
 1072    HZ2  LYS 135           HZ2      LYS 135 -44.052 -18.317  -7.959
 1073    HZ3  LYS 135           HZ3      LYS 135 -44.089 -19.946  -8.041
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1  -9.044 -17.427 -20.808
    2    H2   MET   1           2H       MET   1  -8.456 -17.001 -19.338
    3    H3   MET   1           3H       MET   1  -9.763 -17.980 -19.447
    4    HA   MET   1           HA       MET   1  -8.477 -19.729 -20.439
    5    HB2  MET   1           2HB      MET   1  -6.865 -18.095 -21.522
    6    HB3  MET   1           3HB      MET   1  -6.041 -17.955 -19.968
    7    HG2  MET   1           2HG      MET   1  -5.580 -20.395 -20.017
    8    HG3  MET   1           3HG      MET   1  -6.426 -20.529 -21.559
    9    HE1  MET   1           3HE      MET   1  -5.428 -18.112 -23.358
   10    HE2  MET   1           1HE      MET   1  -4.016 -18.877 -24.112
   11    HE3  MET   1           2HE      MET   1  -5.503 -19.817 -23.863
   12    HA   PRO   2           HA       PRO   2  -8.429 -20.770 -16.145
   13    HB2  PRO   2           2HB      PRO   2  -7.749 -23.424 -16.206
   14    HB3  PRO   2           3HB      PRO   2  -9.319 -22.789 -16.782
   15    HG2  PRO   2           2HG      PRO   2  -6.848 -23.406 -18.440
   16    HG3  PRO   2           3HG      PRO   2  -8.536 -23.942 -18.730
   17    HD2  PRO   2           2HD      PRO   2  -7.535 -21.792 -20.003
   18    HD3  PRO   2           3HD      PRO   2  -9.213 -21.771 -19.386
   19    H    VAL   3           H        VAL   3  -5.492 -21.179 -18.011
   20    HA   VAL   3           HA       VAL   3  -3.832 -20.798 -15.555
   21    HB   VAL   3           HB       VAL   3  -1.970 -21.895 -16.733
   22   HG11  VAL   3          1HG1      VAL   3  -4.408 -23.694 -16.427
   23   HG12  VAL   3          2HG1      VAL   3  -2.704 -24.187 -16.365
   24   HG13  VAL   3          3HG1      VAL   3  -3.362 -23.131 -15.105
   25   HG21  VAL   3          3HG2      VAL   3  -2.741 -21.662 -19.091
   26   HG22  VAL   3          1HG2      VAL   3  -2.345 -23.333 -18.668
   27   HG23  VAL   3          2HG2      VAL   3  -4.041 -22.832 -18.772
   28    H    ARG   4           H        ARG   4  -1.952 -19.485 -15.795
   29    HA   ARG   4           HA       ARG   4  -1.630 -17.738 -18.123
   30    HB2  ARG   4           2HB      ARG   4  -2.171 -15.659 -17.066
   31    HB3  ARG   4           3HB      ARG   4  -3.557 -16.735 -17.042
   32    HG2  ARG   4           2HG      ARG   4  -2.587 -17.371 -14.604
   33    HG3  ARG   4           3HG      ARG   4  -1.784 -15.812 -14.769
   34    HD2  ARG   4           2HD      ARG   4  -3.848 -15.533 -13.616
   35    HD3  ARG   4           3HD      ARG   4  -3.990 -14.735 -15.179
   36    HE   ARG   4           HE       ARG   4  -5.691 -16.203 -15.764
   37   HH11  ARG   4          1HH2      ARG   4  -4.167 -17.615 -12.925
   38   HH12  ARG   4          2HH2      ARG   4  -5.282 -18.953 -12.907
   39   HH21  ARG   4          1HH1      ARG   4  -6.960 -18.033 -15.743
   40   HH22  ARG   4          2HH1      ARG   4  -6.749 -19.195 -14.464
   41    H    ARG   5           H        ARG   5   0.129 -16.198 -17.868
   42    HA   ARG   5           HA       ARG   5   2.313 -17.106 -16.081
   43    HB2  ARG   5           2HB      ARG   5   3.747 -15.592 -17.277
   44    HB3  ARG   5           3HB      ARG   5   2.870 -16.618 -18.408
   45    HG2  ARG   5           2HG      ARG   5   1.282 -14.734 -18.866
   46    HG3  ARG   5           3HG      ARG   5   2.217 -13.694 -17.783
   47    HD2  ARG   5           2HD      ARG   5   3.309 -15.061 -20.276
   48    HD3  ARG   5           3HD      ARG   5   2.730 -13.388 -20.210
   49    HE   ARG   5           HE       ARG   5   4.655 -13.577 -18.189
   50   HH11  ARG   5          2HH2      ARG   5   4.690 -13.892 -21.677
   51   HH12  ARG   5          1HH2      ARG   5   6.354 -13.388 -21.798
   52   HH21  ARG   5          1HH1      ARG   5   6.776 -12.953 -18.411
   53   HH22  ARG   5          2HH1      ARG   5   7.496 -12.867 -19.992
   54    H    GLY   6           H        GLY   6   3.273 -15.848 -14.484
   55    HA2  GLY   6           HA2      GLY   6   3.322 -14.367 -12.696
   56    HA3  GLY   6           HA3      GLY   6   2.375 -13.239 -13.662
   57    H    HIS   7           H        HIS   7   1.241 -12.641 -11.760
   58    HA   HIS   7           HA       HIS   7  -0.386 -14.535 -10.247
   59    HB2  HIS   7           2HB      HIS   7  -1.071 -12.540  -9.002
   60    HB3  HIS   7           3HB      HIS   7   0.678 -12.623  -9.164
   61    HD2  HIS   7           HD2      HIS   7  -2.294 -10.407  -9.979
   62    HE1  HIS   7           HE1      HIS   7   1.069  -8.493 -11.775
   63    HE2  HIS   7           HE2      HIS   7  -1.389  -8.232 -11.163
   64    H    VAL   8           H        VAL   8  -2.688 -14.210  -9.881
   65    HA   VAL   8           HA       VAL   8  -4.231 -13.602 -12.342
   66    HB   VAL   8           HB       VAL   8  -4.567 -15.773 -11.190
   67   HG11  VAL   8          1HG1      VAL   8  -4.402 -15.054  -8.826
   68   HG12  VAL   8          2HG1      VAL   8  -5.938 -14.175  -8.993
   69   HG13  VAL   8          3HG1      VAL   8  -5.896 -15.939  -9.165
   70   HG21  VAL   8          3HG2      VAL   8  -6.283 -14.789 -12.682
   71   HG22  VAL   8          1HG2      VAL   8  -6.955 -15.833 -11.421
   72   HG23  VAL   8          2HG2      VAL   8  -7.082 -14.075 -11.260
   73    H    ALA   9           H        ALA   9  -5.930 -12.113 -12.361
   74    HA   ALA   9           HA       ALA   9  -5.753  -9.736 -10.744
   75    HB1  ALA   9           3HB      ALA   9  -6.653  -9.789 -13.042
   76    HB2  ALA   9           1HB      ALA   9  -7.997 -10.824 -12.503
   77    HB3  ALA   9           2HB      ALA   9  -7.861  -9.158 -11.911
   78    HA   PRO  10           HA       PRO  10  -8.170 -10.646  -7.100
   79    HB2  PRO  10           2HB      PRO  10  -9.889  -8.289  -7.840
   80    HB3  PRO  10           3HB      PRO  10  -9.176  -8.708  -6.256
   81    HG2  PRO  10           2HG      PRO  10  -8.015  -6.818  -7.826
   82    HG3  PRO  10           3HG      PRO  10  -7.007  -8.019  -6.957
   83    HD2  PRO  10           2HD      PRO  10  -7.785  -7.993  -9.877
   84    HD3  PRO  10           3HD      PRO  10  -6.238  -8.431  -9.104
   85    H    GLN  11           H        GLN  11  -9.329 -12.422  -7.201
   86    HA   GLN  11           HA       GLN  11 -10.908 -13.143  -9.398
   87    HB2  GLN  11           2HB      GLN  11 -11.249 -15.217  -8.364
   88    HB3  GLN  11           3HB      GLN  11  -9.631 -14.687  -7.945
   89    HG2  GLN  11           2HG      GLN  11 -12.095 -14.655  -6.145
   90    HG3  GLN  11           3HG      GLN  11 -10.743 -15.774  -6.064
   91   HE21  GLN  11          2HE2      GLN  11 -11.946 -13.539  -4.177
   92   HE22  GLN  11          1HE2      GLN  11 -10.461 -12.766  -3.622
   93    H    ASN  12           H        ASN  12 -11.985 -11.567  -6.461
   94    HA   ASN  12           HA       ASN  12 -14.775 -12.303  -6.632
   95    HB2  ASN  12           2HB      ASN  12 -13.212 -10.114  -5.178
   96    HB3  ASN  12           3HB      ASN  12 -14.970 -10.180  -5.149
   97   HD21  ASN  12          2HD2      ASN  12 -14.326 -10.313  -2.747
   98   HD22  ASN  12          1HD2      ASN  12 -14.190 -11.950  -2.124
   99    H    THR  13           H        THR  13 -12.991  -9.361  -7.679
  100    HA   THR  13           HA       THR  13 -15.330  -8.206  -8.971
  101    HB   THR  13           HB       THR  13 -13.304  -7.035  -7.921
  102    HG1  THR  13           HG1      THR  13 -13.664  -5.287  -9.293
  103   HG21  THR  13          1HG2      THR  13 -11.608  -8.186  -9.350
  104   HG22  THR  13          2HG2      THR  13 -12.205  -7.283 -10.744
  105   HG23  THR  13          3HG2      THR  13 -11.482  -6.418  -9.359
  106    H    PHE  14           H        PHE  14 -12.512 -10.084 -10.065
  107    HA   PHE  14           HA       PHE  14 -12.943  -9.960 -12.872
  108    HB2  PHE  14           2HB      PHE  14 -10.959 -10.864 -11.664
  109    HB3  PHE  14           3HB      PHE  14 -11.913 -12.239 -11.142
  110    HD1  PHE  14           HD2      PHE  14 -10.355 -10.573 -14.078
  111    HD2  PHE  14           HD1      PHE  14 -12.407 -14.090 -12.650
  112    HE1  PHE  14           HE2      PHE  14  -9.760 -11.774 -16.171
  113    HE2  PHE  14           HE1      PHE  14 -11.811 -15.286 -14.745
  114    HZ   PHE  14           HZ       PHE  14 -10.488 -14.129 -16.507
  115    H    LEU  15           H        LEU  15 -14.329 -12.070 -10.355
  116    HA   LEU  15           HA       LEU  15 -16.102 -13.467 -12.198
  117    HB2  LEU  15           2HB      LEU  15 -15.457 -14.572 -10.165
  118    HB3  LEU  15           3HB      LEU  15 -16.091 -13.253  -9.174
  119    HG   LEU  15           HG       LEU  15 -18.372 -13.751  -9.849
  120   HD11  LEU  15          1HD1      LEU  15 -18.961 -15.759 -11.154
  121   HD12  LEU  15          2HD1      LEU  15 -18.029 -14.646 -12.136
  122   HD13  LEU  15          3HD1      LEU  15 -17.231 -16.077 -11.469
  123   HD21  LEU  15          3HD2      LEU  15 -18.627 -15.921  -8.733
  124   HD22  LEU  15          1HD2      LEU  15 -16.894 -16.256  -8.955
  125   HD23  LEU  15          2HD2      LEU  15 -17.421 -14.920  -7.906
  126    H    ASP  16           H        ASP  16 -16.696 -10.753  -9.888
  127    HA   ASP  16           HA       ASP  16 -19.343 -10.153 -10.356
  128    HB2  ASP  16           2HB      ASP  16 -17.770  -8.968  -8.835
  129    HB3  ASP  16           3HB      ASP  16 -17.102  -8.121 -10.224
  130    H    THR  17           H        THR  17 -16.658  -9.374 -12.506
  131    HA   THR  17           HA       THR  17 -18.182  -7.896 -14.495
  132    HB   THR  17           HB       THR  17 -15.653  -9.549 -14.878
  133    HG1  THR  17           HG1      THR  17 -15.369  -7.899 -13.383
  134   HG21  THR  17          1HG2      THR  17 -15.253  -8.013 -16.796
  135   HG22  THR  17          2HG2      THR  17 -16.670  -9.041 -17.047
  136   HG23  THR  17          3HG2      THR  17 -16.884  -7.338 -16.579
  137    H    ILE  18           H        ILE  18 -17.498 -11.377 -14.126
  138    HA   ILE  18           HA       ILE  18 -18.913 -12.172 -16.547
  139    HB   ILE  18           HB       ILE  18 -18.271 -13.819 -14.089
  140   HG12  ILE  18          2HG1      ILE  18 -16.176 -12.911 -14.910
  141   HG13  ILE  18          3HG1      ILE  18 -16.277 -14.643 -15.091
  142   HG21  ILE  18          1HG2      ILE  18 -19.868 -14.980 -15.432
  143   HG22  ILE  18          2HG2      ILE  18 -18.973 -14.645 -16.925
  144   HG23  ILE  18          3HG2      ILE  18 -18.311 -15.753 -15.700
  145   HD11  ILE  18          3HD1      ILE  18 -16.695 -12.580 -17.324
  146   HD12  ILE  18          1HD1      ILE  18 -15.216 -13.520 -17.048
  147   HD13  ILE  18          2HD1      ILE  18 -16.703 -14.349 -17.539
  148    H    ILE  19           H        ILE  19 -19.765 -11.785 -13.082
  149    HA   ILE  19           HA       ILE  19 -22.388 -12.779 -13.247
  150    HB   ILE  19           HB       ILE  19 -21.468 -10.378 -11.604
  151   HG12  ILE  19          2HG1      ILE  19 -20.133 -12.199 -10.837
  152   HG13  ILE  19          3HG1      ILE  19 -21.409 -11.972  -9.669
  153   HG21  ILE  19          1HG2      ILE  19 -23.858 -10.358 -11.755
  154   HG22  ILE  19          2HG2      ILE  19 -23.959 -12.094 -11.412
  155   HG23  ILE  19          3HG2      ILE  19 -23.426 -10.951 -10.156
  156   HD11  ILE  19          3HD1      ILE  19 -21.175 -14.140 -11.775
  157   HD12  ILE  19          1HD1      ILE  19 -21.096 -14.314 -10.016
  158   HD13  ILE  19          2HD1      ILE  19 -22.651 -13.887 -10.804
  159    H    ARG  20           H        ARG  20 -21.251  -9.405 -13.799
  160    HA   ARG  20           HA       ARG  20 -23.773  -8.390 -14.767
  161    HB2  ARG  20           2HB      ARG  20 -20.894  -7.526 -15.107
  162    HB3  ARG  20           3HB      ARG  20 -22.225  -6.667 -15.900
  163    HG2  ARG  20           2HG      ARG  20 -23.333  -6.211 -13.805
  164    HG3  ARG  20           3HG      ARG  20 -22.183  -7.202 -12.894
  165    HD2  ARG  20           2HD      ARG  20 -21.376  -4.783 -14.545
  166    HD3  ARG  20           3HD      ARG  20 -21.798  -4.705 -12.825
  167    HE   ARG  20           HE       ARG  20 -19.987  -6.552 -12.566
  168   HH11  ARG  20          1HH1      ARG  20 -19.521  -4.072 -15.013
  169   HH12  ARG  20          2HH1      ARG  20 -17.808  -4.000 -14.697
  170   HH21  ARG  20          2HH2      ARG  20 -18.005  -6.131 -12.002
  171   HH22  ARG  20          1HH2      ARG  20 -16.902  -5.312 -13.107
  172    H    LYS  21           H        LYS  21 -21.248 -10.188 -16.399
  173    HA   LYS  21           HA       LYS  21 -22.223  -9.867 -19.091
  174    HB2  LYS  21           2HB      LYS  21 -20.037 -10.922 -18.098
  175    HB3  LYS  21           3HB      LYS  21 -20.988 -12.430 -18.195
  176    HG2  LYS  21           2HG      LYS  21 -21.273 -12.178 -20.573
  177    HG3  LYS  21           3HG      LYS  21 -20.584 -10.529 -20.549
  178    HD2  LYS  21           2HD      LYS  21 -18.441 -11.350 -19.796
  179    HD3  LYS  21           3HD      LYS  21 -19.107 -12.973 -19.560
  180    HE2  LYS  21           2HE      LYS  21 -19.530 -13.151 -22.018
  181    HE3  LYS  21           3HE      LYS  21 -18.885 -11.522 -22.249
  182    HZ1  LYS  21           HZ1      LYS  21 -17.329 -13.842 -21.229
  183    HZ2  LYS  21           HZ2      LYS  21 -17.210 -13.211 -22.727
  184    HZ3  LYS  21           HZ3      LYS  21 -16.730 -12.333 -21.440
  185    H    PHE  22           H        PHE  22 -23.088 -12.329 -16.603
  186    HA   PHE  22           HA       PHE  22 -25.300 -13.195 -18.395
  187    HB2  PHE  22           2HB      PHE  22 -25.419 -15.246 -17.294
  188    HB3  PHE  22           3HB      PHE  22 -23.759 -14.925 -17.718
  189    HD1  PHE  22           HD2      PHE  22 -26.169 -14.894 -14.814
  190    HD2  PHE  22           HD1      PHE  22 -22.065 -15.173 -16.097
  191    HE1  PHE  22           HE2      PHE  22 -25.501 -15.541 -12.522
  192    HE2  PHE  22           HE1      PHE  22 -21.400 -15.850 -13.797
  193    HZ   PHE  22           HZ       PHE  22 -23.119 -16.041 -12.011
  194    H    GLU  23           H        GLU  23 -25.076 -11.042 -15.948
  195    HA   GLU  23           HA       GLU  23 -26.867 -11.534 -14.028
  196    HB2  GLU  23           2HB      GLU  23 -25.369  -9.601 -14.042
  197    HB3  GLU  23           3HB      GLU  23 -26.226  -8.903 -15.396
  198    HG2  GLU  23           2HG      GLU  23 -26.698  -7.722 -13.342
  199    HG3  GLU  23           3HG      GLU  23 -28.158  -8.414 -14.007
  200    H    GLY  24           H        GLY  24 -27.823 -10.635 -17.309
  201    HA2  GLY  24           HA2      GLY  24 -29.904 -10.599 -18.344
  202    HA3  GLY  24           HA3      GLY  24 -30.641 -11.167 -16.842
  203    H    GLN  25           H        GLN  25 -28.816  -8.177 -17.572
  204    HA   GLN  25           HA       GLN  25 -30.386  -6.510 -15.874
  205    HB2  GLN  25           2HB      GLN  25 -28.387  -5.849 -18.076
  206    HB3  GLN  25           3HB      GLN  25 -29.085  -4.658 -16.967
  207    HG2  GLN  25           2HG      GLN  25 -28.166  -5.922 -15.029
  208    HG3  GLN  25           3HG      GLN  25 -27.374  -7.038 -16.147
  209   HE21  GLN  25          2HE2      GLN  25 -25.914  -5.540 -14.220
  210   HE22  GLN  25          1HE2      GLN  25 -24.923  -4.386 -15.103
  211    H    SER  26           H        SER  26 -31.151  -7.633 -18.989
  212    HA   SER  26           HA       SER  26 -32.695  -5.486 -20.063
  213    HB2  SER  26           2HB      SER  26 -33.758  -7.332 -21.383
  214    HB3  SER  26           3HB      SER  26 -31.989  -7.305 -21.450
  215    HG   SER  26           HG       SER  26 -32.842  -9.425 -21.083
  216    H    ARG  27           H        ARG  27 -33.316  -7.304 -17.212
  217    HA   ARG  27           HA       ARG  27 -36.233  -6.965 -17.361
  218    HB2  ARG  27           2HB      ARG  27 -36.350  -7.531 -14.964
  219    HB3  ARG  27           3HB      ARG  27 -35.756  -8.736 -16.061
  220    HG2  ARG  27           2HG      ARG  27 -34.702  -8.593 -13.783
  221    HG3  ARG  27           3HG      ARG  27 -33.640  -8.770 -15.166
  222    HD2  ARG  27           2HD      ARG  27 -32.931  -6.471 -15.040
  223    HD3  ARG  27           3HD      ARG  27 -34.247  -6.068 -13.938
  224    HE   ARG  27           HE       ARG  27 -32.923  -6.694 -12.149
  225   HH11  ARG  27          2HH1      ARG  27 -31.619  -8.634 -14.811
  226   HH12  ARG  27          1HH1      ARG  27 -30.396  -9.295 -13.750
  227   HH21  ARG  27          1HH2      ARG  27 -31.419  -7.521 -11.009
  228   HH22  ARG  27          2HH2      ARG  27 -30.191  -8.616 -11.702
  229    H    LYS  28           H        LYS  28 -37.118  -5.786 -15.070
  230    HA   LYS  28           HA       LYS  28 -37.563  -3.243 -16.168
  231    HB2  LYS  28           2HB      LYS  28 -38.103  -3.993 -13.295
  232    HB3  LYS  28           3HB      LYS  28 -39.057  -2.928 -14.307
  233    HG2  LYS  28           2HG      LYS  28 -39.955  -4.779 -15.562
  234    HG3  LYS  28           3HG      LYS  28 -38.846  -5.939 -14.850
  235    HD2  LYS  28           2HD      LYS  28 -39.863  -5.900 -12.747
  236    HD3  LYS  28           3HD      LYS  28 -40.636  -4.362 -13.070
  237    HE2  LYS  28           2HE      LYS  28 -42.337  -6.082 -13.126
  238    HE3  LYS  28           3HE      LYS  28 -42.125  -5.435 -14.756
  239    HZ1  LYS  28           HZ1      LYS  28 -40.787  -7.404 -15.295
  240    HZ2  LYS  28           HZ2      LYS  28 -40.936  -7.986 -13.771
  241    HZ3  LYS  28           HZ3      LYS  28 -42.241  -7.876 -14.737
  242    H    PHE  29           H        PHE  29 -36.659  -1.274 -15.995
  243    HA   PHE  29           HA       PHE  29 -35.442  -0.240 -13.629
  244    HB2  PHE  29           2HB      PHE  29 -33.171   0.012 -14.279
  245    HB3  PHE  29           3HB      PHE  29 -33.539  -1.680 -14.432
  246    HD1  PHE  29           HD1      PHE  29 -32.938   1.469 -16.386
  247    HD2  PHE  29           HD2      PHE  29 -33.143  -2.832 -16.483
  248    HE1  PHE  29           HE1      PHE  29 -32.001   1.471 -18.682
  249    HE2  PHE  29           HE2      PHE  29 -32.167  -2.819 -18.763
  250    HZ   PHE  29           HZ       PHE  29 -31.580  -0.671 -19.861
  251    H    ILE  30           H        ILE  30 -34.585   1.869 -13.852
  252    HA   ILE  30           HA       ILE  30 -35.264   3.435 -16.273
  253    HB   ILE  30           HB       ILE  30 -35.636   5.382 -14.579
  254   HG12  ILE  30          2HG1      ILE  30 -36.808   4.840 -12.535
  255   HG13  ILE  30          3HG1      ILE  30 -36.541   3.114 -12.755
  256   HG21  ILE  30          1HG2      ILE  30 -37.200   4.519 -16.191
  257   HG22  ILE  30          2HG2      ILE  30 -37.694   3.240 -15.050
  258   HG23  ILE  30          3HG2      ILE  30 -38.023   4.949 -14.673
  259   HD11  ILE  30          3HD1      ILE  30 -34.134   3.384 -12.349
  260   HD12  ILE  30          1HD1      ILE  30 -34.304   5.160 -12.392
  261   HD13  ILE  30          2HD1      ILE  30 -35.027   4.230 -11.074
  262    H    ILE  31           H        ILE  31 -34.149   5.510 -16.324
  263    HA   ILE  31           HA       ILE  31 -31.495   5.510 -14.974
  264    HB   ILE  31           HB       ILE  31 -32.024   6.640 -17.729
  265   HG12  ILE  31          2HG1      ILE  31 -32.415   4.180 -17.860
  266   HG13  ILE  31          3HG1      ILE  31 -31.043   4.752 -18.827
  267   HG21  ILE  31          1HG2      ILE  31 -29.523   6.592 -17.824
  268   HG22  ILE  31          2HG2      ILE  31 -30.169   7.614 -16.531
  269   HG23  ILE  31          3HG2      ILE  31 -29.509   6.031 -16.128
  270   HD11  ILE  31          3HD1      ILE  31 -29.437   3.986 -17.195
  271   HD12  ILE  31          1HD1      ILE  31 -30.740   3.549 -16.072
  272   HD13  ILE  31          2HD1      ILE  31 -30.515   2.650 -17.589
  273    H    ALA  32           H        ALA  32 -31.372   7.151 -13.701
  274    HA   ALA  32           HA       ALA  32 -32.672   9.720 -14.496
  275    HB1  ALA  32           3HB      ALA  32 -33.190  10.100 -12.037
  276    HB2  ALA  32           1HB      ALA  32 -34.142   8.829 -12.848
  277    HB3  ALA  32           2HB      ALA  32 -32.807   8.396 -11.777
  278    H    ASN  33           H        ASN  33 -31.894  11.666 -13.712
  279    HA   ASN  33           HA       ASN  33 -28.955  11.679 -13.352
  280    HB2  ASN  33           2HB      ASN  33 -29.247  14.195 -13.353
  281    HB3  ASN  33           3HB      ASN  33 -29.564  13.339 -14.839
  282   HD21  ASN  33          2HD2      ASN  33 -30.556  15.446 -15.381
  283   HD22  ASN  33          1HD2      ASN  33 -32.250  15.632 -14.956
  284    H    ALA  34           H        ALA  34 -28.211  11.104 -11.417
  285    HA   ALA  34           HA       ALA  34 -29.648  11.550  -8.955
  286    HB1  ALA  34           3HB      ALA  34 -28.145   9.624  -9.350
  287    HB2  ALA  34           1HB      ALA  34 -26.753  10.730  -9.438
  288    HB3  ALA  34           2HB      ALA  34 -27.658  10.551  -7.925
  289    H    ARG  35           H        ARG  35 -27.651  13.616 -10.754
  290    HA   ARG  35           HA       ARG  35 -26.613  15.113  -8.407
  291    HB2  ARG  35           2HB      ARG  35 -25.991  15.592 -11.337
  292    HB3  ARG  35           3HB      ARG  35 -25.120  16.201  -9.939
  293    HG2  ARG  35           2HG      ARG  35 -25.165  13.390 -11.050
  294    HG3  ARG  35           3HG      ARG  35 -23.797  14.466 -10.835
  295    HD2  ARG  35           2HD      ARG  35 -25.309  12.918  -8.705
  296    HD3  ARG  35           3HD      ARG  35 -23.634  12.709  -9.224
  297    HE   ARG  35           HE       ARG  35 -23.735  15.314  -8.268
  298   HH11  ARG  35          1HH1      ARG  35 -24.264  12.117  -6.904
  299   HH12  ARG  35          2HH1      ARG  35 -23.895  12.661  -5.284
  300   HH21  ARG  35          1HH2      ARG  35 -23.244  15.915  -6.177
  301   HH22  ARG  35          2HH2      ARG  35 -23.294  14.740  -4.898
  302    H    VAL  36           H        VAL  36 -29.480  15.281  -9.838
  303    HA   VAL  36           HA       VAL  36 -29.653  18.258  -9.737
  304    HB   VAL  36           HB       VAL  36 -29.963  16.914 -11.981
  305   HG11  VAL  36          1HG1      VAL  36 -32.813  16.812 -10.932
  306   HG12  VAL  36          2HG1      VAL  36 -32.260  16.414 -12.547
  307   HG13  VAL  36          3HG1      VAL  36 -31.757  15.400 -11.176
  308   HG21  VAL  36          3HG2      VAL  36 -31.378  18.632 -12.851
  309   HG22  VAL  36          1HG2      VAL  36 -31.870  19.132 -11.209
  310   HG23  VAL  36          2HG2      VAL  36 -30.180  19.322 -11.748
  311    H    GLU  37           H        GLU  37 -31.264  19.196  -8.530
  312    HA   GLU  37           HA       GLU  37 -32.255  17.801  -6.284
  313    HB2  GLU  37           2HB      GLU  37 -31.827  20.250  -6.520
  314    HB3  GLU  37           3HB      GLU  37 -33.288  20.395  -7.504
  315    HG2  GLU  37           2HG      GLU  37 -34.671  19.687  -5.592
  316    HG3  GLU  37           3HG      GLU  37 -33.224  19.372  -4.629
  317    H    ASN  38           H        ASN  38 -33.733  18.174  -9.441
  318    HA   ASN  38           HA       ASN  38 -36.384  17.276  -8.633
  319    HB2  ASN  38           2HB      ASN  38 -35.533  18.856 -10.618
  320    HB3  ASN  38           3HB      ASN  38 -35.429  17.334 -11.498
  321   HD21  ASN  38          1HD2      ASN  38 -37.665  15.946 -10.945
  322   HD22  ASN  38          2HD2      ASN  38 -39.089  16.924 -11.318
  323    H    CYS  39           H        CYS  39 -33.507  15.537  -9.073
  324    HA   CYS  39           HA       CYS  39 -32.948  13.442  -9.852
  325    HB2  CYS  39           2HB      CYS  39 -33.855  11.750  -8.298
  326    HB3  CYS  39           3HB      CYS  39 -33.314  13.219  -7.481
  327    HG   CYS  39           HG       CYS  39 -36.404  12.523  -8.415
  328    H    ALA  40           H        ALA  40 -34.016  13.982 -12.102
  329    HA   ALA  40           HA       ALA  40 -36.540  12.514 -12.485
  330    HB1  ALA  40           3HB      ALA  40 -36.865  13.900 -14.434
  331    HB2  ALA  40           1HB      ALA  40 -36.500  14.894 -13.022
  332    HB3  ALA  40           2HB      ALA  40 -35.239  14.601 -14.248
  333    H    VAL  41           H        VAL  41 -37.048  11.299 -14.246
  334    HA   VAL  41           HA       VAL  41 -35.135   9.280 -14.994
  335    HB   VAL  41           HB       VAL  41 -38.079   9.659 -15.684
  336   HG11  VAL  41          1HG1      VAL  41 -36.291   7.205 -15.945
  337   HG12  VAL  41          2HG1      VAL  41 -38.053   7.223 -16.179
  338   HG13  VAL  41          3HG1      VAL  41 -37.012   8.107 -17.292
  339   HG21  VAL  41          3HG2      VAL  41 -38.504   7.968 -13.968
  340   HG22  VAL  41          1HG2      VAL  41 -36.768   7.899 -13.567
  341   HG23  VAL  41          2HG2      VAL  41 -37.717   9.369 -13.256
  342    H    ILE  42           H        ILE  42 -33.674  10.282 -16.299
  343    HA   ILE  42           HA       ILE  42 -34.341  11.733 -18.729
  344    HB   ILE  42           HB       ILE  42 -31.935  11.574 -19.197
  345   HG12  ILE  42          2HG1      ILE  42 -31.747   9.912 -16.641
  346   HG13  ILE  42          3HG1      ILE  42 -31.521   9.292 -18.280
  347   HG21  ILE  42          1HG2      ILE  42 -32.429  12.333 -16.283
  348   HG22  ILE  42          2HG2      ILE  42 -31.207  13.001 -17.384
  349   HG23  ILE  42          3HG2      ILE  42 -32.918  13.325 -17.674
  350   HD11  ILE  42          3HD1      ILE  42 -29.768  11.261 -16.802
  351   HD12  ILE  42          1HD1      ILE  42 -29.391   9.607 -17.314
  352   HD13  ILE  42          2HD1      ILE  42 -29.600  10.869 -18.543
  353    H    TYR  43           H        TYR  43 -34.006   8.355 -17.916
  354    HA   TYR  43           HA       TYR  43 -34.947   7.627 -20.590
  355    HB2  TYR  43           2HB      TYR  43 -32.366   7.798 -20.782
  356    HB3  TYR  43           3HB      TYR  43 -32.318   6.350 -19.824
  357    HD1  TYR  43           HD1      TYR  43 -33.596   7.793 -23.006
  358    HD2  TYR  43           HD2      TYR  43 -32.716   4.187 -20.799
  359    HE1  TYR  43           HE1      TYR  43 -33.953   6.434 -25.070
  360    HE2  TYR  43           HE2      TYR  43 -33.076   2.839 -22.856
  361    HH   TYR  43           HH       TYR  43 -33.606   2.866 -25.086
  362    H    CYS  44           H        CYS  44 -35.463   5.304 -20.869
  363    HA   CYS  44           HA       CYS  44 -36.062   3.951 -18.303
  364    HB2  CYS  44           2HB      CYS  44 -38.444   3.766 -19.006
  365    HB3  CYS  44           3HB      CYS  44 -37.940   5.437 -18.695
  366    HG   CYS  44           HG       CYS  44 -37.891   3.928 -21.656
  367    H    ASN  45           H        ASN  45 -36.390   1.729 -18.375
  368    HA   ASN  45           HA       ASN  45 -35.976   0.400 -20.989
  369    HB2  ASN  45           2HB      ASN  45 -34.655  -0.244 -18.937
  370    HB3  ASN  45           3HB      ASN  45 -36.129  -0.956 -18.291
  371   HD21  ASN  45          2HD2      ASN  45 -35.653  -3.197 -18.479
  372   HD22  ASN  45          1HD2      ASN  45 -35.307  -3.940 -20.004
  373    H    ASP  46           H        ASP  46 -37.309  -1.296 -21.692
  374    HA   ASP  46           HA       ASP  46 -40.113  -0.647 -21.682
  375    HB2  ASP  46           2HB      ASP  46 -38.667  -3.174 -22.581
  376    HB3  ASP  46           3HB      ASP  46 -40.351  -2.780 -22.937
  377    H    GLY  47           H        GLY  47 -38.184  -3.007 -19.840
  378    HA2  GLY  47           HA2      GLY  47 -40.187  -4.529 -18.625
  379    HA3  GLY  47           HA3      GLY  47 -38.651  -4.085 -17.873
  380    H    PHE  48           H        PHE  48 -38.902  -1.352 -17.351
  381    HA   PHE  48           HA       PHE  48 -40.798  -1.342 -15.190
  382    HB2  PHE  48           2HB      PHE  48 -39.315   0.081 -14.450
  383    HB3  PHE  48           3HB      PHE  48 -38.601   0.302 -16.026
  384    HD1  PHE  48           HD1      PHE  48 -39.258   2.210 -17.503
  385    HD2  PHE  48           HD2      PHE  48 -40.948   1.671 -13.571
  386    HE1  PHE  48           HE1      PHE  48 -40.011   4.571 -17.473
  387    HE2  PHE  48           HE2      PHE  48 -41.714   4.020 -13.567
  388    HZ   PHE  48           HZ       PHE  48 -41.239   5.483 -15.517
  389    H    CYS  49           H        CYS  49 -40.949  -0.272 -18.515
  390    HA   CYS  49           HA       CYS  49 -43.306   1.386 -18.336
  391    HB2  CYS  49           2HB      CYS  49 -41.639   1.251 -20.271
  392    HB3  CYS  49           3HB      CYS  49 -42.442  -0.263 -20.741
  393    HG   CYS  49           HG       CYS  49 -44.875   0.751 -20.837
  394    H    GLU  50           H        GLU  50 -42.762  -2.139 -18.696
  395    HA   GLU  50           HA       GLU  50 -45.645  -2.768 -18.714
  396    HB2  GLU  50           2HB      GLU  50 -43.234  -4.577 -18.317
  397    HB3  GLU  50           3HB      GLU  50 -44.897  -5.090 -18.608
  398    HG2  GLU  50           2HG      GLU  50 -44.873  -3.904 -20.811
  399    HG3  GLU  50           3HG      GLU  50 -43.172  -3.523 -20.570
  400    H    LEU  51           H        LEU  51 -43.111  -2.443 -16.282
  401    HA   LEU  51           HA       LEU  51 -44.340  -3.718 -14.090
  402    HB2  LEU  51           2HB      LEU  51 -42.047  -2.874 -14.115
  403    HB3  LEU  51           3HB      LEU  51 -42.643  -1.229 -14.181
  404    HG   LEU  51           HG       LEU  51 -43.653  -1.279 -12.060
  405   HD11  LEU  51          1HD1      LEU  51 -42.426  -4.045 -11.713
  406   HD12  LEU  51          2HD1      LEU  51 -43.167  -3.069 -10.432
  407   HD13  LEU  51          3HD1      LEU  51 -44.161  -3.662 -11.768
  408   HD21  LEU  51          3HD2      LEU  51 -41.400  -0.449 -12.276
  409   HD22  LEU  51          1HD2      LEU  51 -41.536  -1.334 -10.750
  410   HD23  LEU  51          2HD2      LEU  51 -40.729  -2.091 -12.142
  411    H    CYS  52           H        CYS  52 -44.558  -0.270 -15.117
  412    HA   CYS  52           HA       CYS  52 -46.896   0.194 -13.387
  413    HB2  CYS  52           2HB      CYS  52 -45.512   1.977 -15.439
  414    HB3  CYS  52           3HB      CYS  52 -46.736   2.484 -14.263
  415    HG   CYS  52           HG       CYS  52 -44.352   3.306 -13.504
  416    H    GLY  53           H        GLY  53 -46.360  -0.644 -16.723
  417    HA2  GLY  53           HA2      GLY  53 -47.849  -1.274 -18.388
  418    HA3  GLY  53           HA3      GLY  53 -49.213  -0.990 -17.301
  419    H    TYR  54           H        TYR  54 -46.715   1.422 -18.171
  420    HA   TYR  54           HA       TYR  54 -48.883   3.246 -19.142
  421    HB2  TYR  54           2HB      TYR  54 -46.053   3.852 -18.241
  422    HB3  TYR  54           3HB      TYR  54 -47.274   5.038 -18.694
  423    HD1  TYR  54           HD1      TYR  54 -49.471   3.216 -16.974
  424    HD2  TYR  54           HD2      TYR  54 -45.763   5.305 -16.261
  425    HE1  TYR  54           HE1      TYR  54 -50.134   3.585 -14.616
  426    HE2  TYR  54           HE2      TYR  54 -46.447   5.695 -13.897
  427    HH   TYR  54           HH       TYR  54 -49.566   4.510 -12.595
  428    H    SER  55           H        SER  55 -46.285   4.708 -20.279
  429    HA   SER  55           HA       SER  55 -45.513   3.253 -22.653
  430    HB2  SER  55           2HB      SER  55 -47.681   4.091 -23.454
  431    HB3  SER  55           3HB      SER  55 -47.251   5.737 -22.954
  432    HG   SER  55           HG       SER  55 -46.857   5.278 -25.214
  433    H    ARG  56           H        ARG  56 -43.669   4.348 -23.626
  434    HA   ARG  56           HA       ARG  56 -42.027   5.636 -21.668
  435    HB2  ARG  56           2HB      ARG  56 -40.306   5.675 -23.318
  436    HB3  ARG  56           3HB      ARG  56 -41.218   4.178 -23.487
  437    HG2  ARG  56           2HG      ARG  56 -42.511   5.400 -25.404
  438    HG3  ARG  56           3HG      ARG  56 -41.253   6.635 -25.280
  439    HD2  ARG  56           2HD      ARG  56 -40.526   5.228 -27.006
  440    HD3  ARG  56           3HD      ARG  56 -39.544   4.746 -25.629
  441    HE   ARG  56           HE       ARG  56 -41.866   3.272 -26.826
  442   HH11  ARG  56          1HH1      ARG  56 -39.085   3.017 -24.635
  443   HH12  ARG  56          2HH1      ARG  56 -39.357   1.274 -24.505
  444   HH21  ARG  56          2HH2      ARG  56 -42.006   1.045 -26.506
  445   HH22  ARG  56          1HH2      ARG  56 -40.813   0.297 -25.438
  446    H    ALA  57           H        ALA  57 -43.936   7.067 -24.251
  447    HA   ALA  57           HA       ALA  57 -42.948   9.748 -24.095
  448    HB1  ALA  57           3HB      ALA  57 -45.065  10.283 -25.252
  449    HB2  ALA  57           1HB      ALA  57 -44.301   8.845 -25.956
  450    HB3  ALA  57           2HB      ALA  57 -45.698   8.668 -24.865
  451    H    GLU  58           H        GLU  58 -44.793   7.945 -21.810
  452    HA   GLU  58           HA       GLU  58 -45.981  10.288 -20.465
  453    HB2  GLU  58           2HB      GLU  58 -46.185   7.347 -19.739
  454    HB3  GLU  58           3HB      GLU  58 -47.155   8.660 -19.133
  455    HG2  GLU  58           2HG      GLU  58 -47.185   7.794 -22.060
  456    HG3  GLU  58           3HG      GLU  58 -48.249   7.140 -20.845
  457    H    VAL  59           H        VAL  59 -43.108   8.239 -20.258
  458    HA   VAL  59           HA       VAL  59 -42.834   8.818 -17.342
  459    HB   VAL  59           HB       VAL  59 -41.232   7.189 -17.153
  460   HG11  VAL  59          1HG1      VAL  59 -42.344   5.174 -17.920
  461   HG12  VAL  59          2HG1      VAL  59 -43.564   6.373 -17.465
  462   HG13  VAL  59          3HG1      VAL  59 -43.197   6.065 -19.178
  463   HG21  VAL  59          3HG2      VAL  59 -39.694   7.475 -18.918
  464   HG22  VAL  59          1HG2      VAL  59 -40.370   5.855 -19.137
  465   HG23  VAL  59          2HG2      VAL  59 -40.922   7.164 -20.153
  466    H    MET  60           H        MET  60 -41.606   9.945 -20.361
  467    HA   MET  60           HA       MET  60 -39.013  10.653 -19.913
  468    HB2  MET  60           2HB      MET  60 -41.189  12.184 -21.396
  469    HB3  MET  60           3HB      MET  60 -39.505  12.686 -21.401
  470    HG2  MET  60           2HG      MET  60 -40.565  10.074 -22.483
  471    HG3  MET  60           3HG      MET  60 -40.048  11.466 -23.402
  472    HE1  MET  60           3HE      MET  60 -37.459   8.049 -21.897
  473    HE2  MET  60           1HE      MET  60 -38.769   8.656 -20.866
  474    HE3  MET  60           2HE      MET  60 -39.133   8.037 -22.488
  475    H    GLN  61           H        GLN  61 -38.133  11.501 -18.236
  476    HA   GLN  61           HA       GLN  61 -37.373  13.047 -16.843
  477    HB2  GLN  61           2HB      GLN  61 -39.021  15.056 -18.382
  478    HB3  GLN  61           3HB      GLN  61 -37.570  15.378 -17.445
  479    HG2  GLN  61           2HG      GLN  61 -36.146  14.633 -19.103
  480    HG3  GLN  61           3HG      GLN  61 -37.201  13.335 -19.621
  481   HE21  GLN  61          2HE2      GLN  61 -37.263  13.621 -21.801
  482   HE22  GLN  61          1HE2      GLN  61 -38.014  15.021 -22.533
  483    H    ARG  62           H        ARG  62 -40.029  11.627 -16.156
  484    HA   ARG  62           HA       ARG  62 -41.162  13.445 -14.143
  485    HB2  ARG  62           2HB      ARG  62 -41.399  10.495 -14.854
  486    HB3  ARG  62           3HB      ARG  62 -41.799  10.986 -13.222
  487    HG2  ARG  62           2HG      ARG  62 -43.831  11.071 -14.179
  488    HG3  ARG  62           3HG      ARG  62 -43.342  12.765 -14.252
  489    HD2  ARG  62           2HD      ARG  62 -43.027  10.807 -16.546
  490    HD3  ARG  62           3HD      ARG  62 -44.512  11.712 -16.297
  491    HE   ARG  62           HE       ARG  62 -42.045  12.699 -17.452
  492   HH11  ARG  62          1HH1      ARG  62 -44.895  13.866 -15.761
  493   HH12  ARG  62          2HH1      ARG  62 -44.714  15.463 -16.431
  494   HH21  ARG  62          1HH2      ARG  62 -41.905  14.639 -18.261
  495   HH22  ARG  62          2HH2      ARG  62 -43.033  15.911 -17.825
  496    HA   PRO  63           HA       PRO  63 -38.160  12.694 -10.888
  497    HB2  PRO  63           2HB      PRO  63 -40.461  12.128  -9.057
  498    HB3  PRO  63           3HB      PRO  63 -39.085  13.248  -8.827
  499    HG2  PRO  63           2HG      PRO  63 -41.551  14.200  -9.476
  500    HG3  PRO  63           3HG      PRO  63 -40.083  14.887 -10.240
  501    HD2  PRO  63           2HD      PRO  63 -41.988  12.814 -11.366
  502    HD3  PRO  63           3HD      PRO  63 -41.308  14.272 -12.152
  503    H    CYS  64           H        CYS  64 -37.075  10.886 -10.213
  504    HA   CYS  64           HA       CYS  64 -37.918   8.224 -10.943
  505    HB2  CYS  64           2HB      CYS  64 -35.598   9.362 -10.837
  506    HB3  CYS  64           3HB      CYS  64 -35.618   8.920  -9.118
  507    HG   CYS  64           HG       CYS  64 -34.263   7.162 -10.550
  508    H    THR  65           H        THR  65 -38.519  10.100  -8.080
  509    HA   THR  65           HA       THR  65 -38.836   8.150  -6.106
  510    HB   THR  65           HB       THR  65 -40.698  10.418  -5.860
  511    HG1  THR  65           HG1      THR  65 -39.036  11.966  -5.704
  512   HG21  THR  65          1HG2      THR  65 -38.217   9.626  -4.306
  513   HG22  THR  65          2HG2      THR  65 -39.467  10.785  -3.799
  514   HG23  THR  65          3HG2      THR  65 -39.872   9.069  -3.973
  515    H    CYS  66           H        CYS  66 -39.883   6.426  -6.741
  516    HA   CYS  66           HA       CYS  66 -42.358   6.143  -7.986
  517    HB2  CYS  66           2HB      CYS  66 -42.482   3.924  -6.926
  518    HB3  CYS  66           3HB      CYS  66 -40.844   4.267  -7.508
  519    HG   CYS  66           HG       CYS  66 -40.726   2.979  -5.227
  520    H    ASP  67           H        ASP  67 -41.893   7.514  -4.890
  521    HA   ASP  67           HA       ASP  67 -44.345   7.323  -3.552
  522    HB2  ASP  67           2HB      ASP  67 -42.381   8.606  -2.775
  523    HB3  ASP  67           3HB      ASP  67 -42.583   9.752  -4.094
  524    H    PHE  68           H        PHE  68 -43.566   9.327  -6.468
  525    HA   PHE  68           HA       PHE  68 -46.128  10.645  -6.545
  526    HB2  PHE  68           2HB      PHE  68 -43.957  10.257  -8.633
  527    HB3  PHE  68           3HB      PHE  68 -45.403  11.213  -8.908
  528    HD1  PHE  68           HD1      PHE  68 -45.940  13.168  -7.321
  529    HD2  PHE  68           HD2      PHE  68 -42.067  11.298  -7.568
  530    HE1  PHE  68           HE1      PHE  68 -44.901  15.177  -6.292
  531    HE2  PHE  68           HE2      PHE  68 -41.031  13.300  -6.531
  532    HZ   PHE  68           HZ       PHE  68 -42.445  15.245  -5.893
  533    H    LEU  69           H        LEU  69 -45.368   7.425  -7.312
  534    HA   LEU  69           HA       LEU  69 -48.040   7.079  -8.527
  535    HB2  LEU  69           2HB      LEU  69 -47.215   5.278  -9.978
  536    HB3  LEU  69           3HB      LEU  69 -46.619   6.876 -10.362
  537    HG   LEU  69           HG       LEU  69 -44.426   6.284  -9.228
  538   HD11  LEU  69          1HD1      LEU  69 -43.858   3.909  -9.013
  539   HD12  LEU  69          2HD1      LEU  69 -45.143   4.313  -7.887
  540   HD13  LEU  69          3HD1      LEU  69 -45.538   3.449  -9.383
  541   HD21  LEU  69          3HD2      LEU  69 -45.322   4.603 -11.598
  542   HD22  LEU  69          1HD2      LEU  69 -44.716   6.273 -11.662
  543   HD23  LEU  69          2HD2      LEU  69 -43.637   4.966 -11.155
  544    H    HIS  70           H        HIS  70 -46.992   6.893  -5.681
  545    HA   HIS  70           HA       HIS  70 -47.112   4.135  -4.962
  546    HB2  HIS  70           2HB      HIS  70 -47.183   4.799  -2.746
  547    HB3  HIS  70           3HB      HIS  70 -46.195   5.990  -3.554
  548    HD2  HIS  70           HD2      HIS  70 -48.848   7.822  -4.541
  549    HE1  HIS  70           HE1      HIS  70 -49.304   8.397  -0.345
  550    HE2  HIS  70           HE2      HIS  70 -49.946   9.277  -2.646
  551    H    GLY  71           H        GLY  71 -48.708   2.858  -4.002
  552    HA2  GLY  71           HA2      GLY  71 -51.513   3.506  -4.845
  553    HA3  GLY  71           HA3      GLY  71 -50.748   1.940  -5.080
  554    HA   PRO  72           HA       PRO  72 -53.318   2.277  -1.183
  555    HB2  PRO  72           2HB      PRO  72 -54.614  -0.187  -2.354
  556    HB3  PRO  72           3HB      PRO  72 -55.370   1.171  -1.462
  557    HG2  PRO  72           2HG      PRO  72 -55.568   1.066  -4.150
  558    HG3  PRO  72           3HG      PRO  72 -55.152   2.626  -3.362
  559    HD2  PRO  72           2HD      PRO  72 -53.281   0.614  -4.647
  560    HD3  PRO  72           3HD      PRO  72 -53.358   2.383  -4.869
  561    H    ARG  73           H        ARG  73 -51.257  -0.234  -2.360
  562    HA   ARG  73           HA       ARG  73 -51.015  -1.359   0.412
  563    HB2  ARG  73           2HB      ARG  73 -50.395  -2.700  -2.257
  564    HB3  ARG  73           3HB      ARG  73 -49.877  -3.307  -0.685
  565    HG2  ARG  73           2HG      ARG  73 -52.412  -3.066  -0.015
  566    HG3  ARG  73           3HG      ARG  73 -52.697  -3.105  -1.754
  567    HD2  ARG  73           2HD      ARG  73 -51.159  -5.203  -0.157
  568    HD3  ARG  73           3HD      ARG  73 -52.881  -5.306  -0.544
  569    HE   ARG  73           HE       ARG  73 -51.624  -5.004  -3.021
  570   HH11  ARG  73          2HH1      ARG  73 -51.511  -7.387  -0.445
  571   HH12  ARG  73          1HH1      ARG  73 -51.218  -8.700  -1.550
  572   HH21  ARG  73          1HH2      ARG  73 -51.300  -6.728  -4.367
  573   HH22  ARG  73          2HH2      ARG  73 -51.104  -8.339  -3.712
  574    H    THR  74           H        THR  74 -49.485   0.917  -1.540
  575    HA   THR  74           HA       THR  74 -46.751   0.133  -0.866
  576    HB   THR  74           HB       THR  74 -47.565   2.974  -1.462
  577    HG1  THR  74           HG1      THR  74 -46.695   1.440  -3.578
  578   HG21  THR  74          1HG2      THR  74 -45.263   2.768  -0.856
  579   HG22  THR  74          2HG2      THR  74 -45.057   1.292  -1.806
  580   HG23  THR  74          3HG2      THR  74 -45.267   2.865  -2.622
  581    H    GLN  75           H        GLN  75 -45.558   0.643   0.900
  582    HA   GLN  75           HA       GLN  75 -47.017   1.839   3.167
  583    HB2  GLN  75           2HB      GLN  75 -44.123   0.952   3.112
  584    HB3  GLN  75           3HB      GLN  75 -45.127   1.332   4.507
  585    HG2  GLN  75           2HG      GLN  75 -45.390  -1.075   2.687
  586    HG3  GLN  75           3HG      GLN  75 -44.824  -1.008   4.358
  587   HE21  GLN  75          2HE2      GLN  75 -47.744  -1.170   2.313
  588   HE22  GLN  75          1HE2      GLN  75 -48.836  -1.232   3.684
  589    H    ARG  76           H        ARG  76 -46.785   3.855   3.917
  590    HA   ARG  76           HA       ARG  76 -45.634   5.850   2.157
  591    HB2  ARG  76           2HB      ARG  76 -46.560   6.243   4.990
  592    HB3  ARG  76           3HB      ARG  76 -46.422   7.469   3.732
  593    HG2  ARG  76           2HG      ARG  76 -48.504   5.260   3.965
  594    HG3  ARG  76           3HG      ARG  76 -48.747   7.004   3.926
  595    HD2  ARG  76           2HD      ARG  76 -47.900   6.971   1.526
  596    HD3  ARG  76           3HD      ARG  76 -47.905   5.210   1.604
  597    HE   ARG  76           HE       ARG  76 -50.367   6.869   2.051
  598   HH11  ARG  76          1HH2      ARG  76 -49.075   3.938   0.572
  599   HH12  ARG  76          2HH2      ARG  76 -50.394   3.822  -0.548
  600   HH21  ARG  76          1HH1      ARG  76 -52.109   6.514   0.742
  601   HH22  ARG  76          2HH1      ARG  76 -52.119   5.154  -0.341
  602    H    ARG  77           H        ARG  77 -44.558   4.404   5.201
  603    HA   ARG  77           HA       ARG  77 -42.088   5.798   5.510
  604    HB2  ARG  77           2HB      ARG  77 -41.357   3.929   6.835
  605    HB3  ARG  77           3HB      ARG  77 -43.037   4.346   7.219
  606    HG2  ARG  77           2HG      ARG  77 -43.770   2.411   5.792
  607    HG3  ARG  77           3HG      ARG  77 -42.067   1.949   5.599
  608    HD2  ARG  77           2HD      ARG  77 -41.879   1.739   8.070
  609    HD3  ARG  77           3HD      ARG  77 -43.597   2.129   8.225
  610    HE   ARG  77           HE       ARG  77 -42.398  -0.401   7.365
  611   HH11  ARG  77          1HH1      ARG  77 -45.412   1.411   7.443
  612   HH12  ARG  77          2HH1      ARG  77 -46.334   0.011   6.935
  613   HH21  ARG  77          1HH2      ARG  77 -43.712  -2.173   7.028
  614   HH22  ARG  77          2HH2      ARG  77 -45.439  -1.954   6.931
  615    H    ALA  78           H        ALA  78 -42.841   3.031   3.429
  616    HA   ALA  78           HA       ALA  78 -40.179   2.513   2.492
  617    HB1  ALA  78           3HB      ALA  78 -42.874   1.961   1.125
  618    HB2  ALA  78           1HB      ALA  78 -41.338   1.409   0.617
  619    HB3  ALA  78           2HB      ALA  78 -41.941   0.864   2.179
  620    H    ALA  79           H        ALA  79 -42.898   4.453   1.134
  621    HA   ALA  79           HA       ALA  79 -41.400   5.410  -1.145
  622    HB1  ALA  79           3HB      ALA  79 -43.884   5.281  -1.006
  623    HB2  ALA  79           1HB      ALA  79 -43.870   6.564   0.232
  624    HB3  ALA  79           2HB      ALA  79 -43.325   6.913  -1.416
  625    H    ALA  80           H        ALA  80 -41.891   6.731   2.116
  626    HA   ALA  80           HA       ALA  80 -40.627   9.241   1.682
  627    HB1  ALA  80           3HB      ALA  80 -42.162   8.782   3.533
  628    HB2  ALA  80           1HB      ALA  80 -41.025   7.594   4.210
  629    HB3  ALA  80           2HB      ALA  80 -40.588   9.319   4.160
  630    H    GLN  81           H        GLN  81 -39.269   6.219   3.207
  631    HA   GLN  81           HA       GLN  81 -36.598   7.078   3.424
  632    HB2  GLN  81           2HB      GLN  81 -37.604   5.020   4.390
  633    HB3  GLN  81           3HB      GLN  81 -37.473   4.252   2.799
  634    HG2  GLN  81           2HG      GLN  81 -35.040   4.445   2.857
  635    HG3  GLN  81           3HG      GLN  81 -35.102   5.547   4.232
  636   HE21  GLN  81          2HE2      GLN  81 -35.946   2.130   3.360
  637   HE22  GLN  81          1HE2      GLN  81 -35.601   1.528   4.976
  638    H    ILE  82           H        ILE  82 -38.258   5.792   0.499
  639    HA   ILE  82           HA       ILE  82 -35.889   5.863  -1.143
  640    HB   ILE  82           HB       ILE  82 -38.850   5.867  -1.691
  641   HG12  ILE  82          2HG1      ILE  82 -36.607   3.910  -2.401
  642   HG13  ILE  82          3HG1      ILE  82 -37.493   3.859  -0.873
  643   HG21  ILE  82          1HG2      ILE  82 -37.975   7.261  -3.456
  644   HG22  ILE  82          2HG2      ILE  82 -36.616   6.150  -3.739
  645   HG23  ILE  82          3HG2      ILE  82 -38.285   5.661  -4.136
  646   HD11  ILE  82          3HD1      ILE  82 -39.626   3.709  -2.147
  647   HD12  ILE  82          1HD1      ILE  82 -38.648   3.442  -3.623
  648   HD13  ILE  82          2HD1      ILE  82 -38.541   2.300  -2.268
  649    H    ALA  83           H        ALA  83 -38.495   8.330  -0.678
  650    HA   ALA  83           HA       ALA  83 -37.338  10.362  -2.243
  651    HB1  ALA  83           3HB      ALA  83 -38.609  11.910  -0.877
  652    HB2  ALA  83           1HB      ALA  83 -39.578  10.433  -1.157
  653    HB3  ALA  83           2HB      ALA  83 -38.782  10.714   0.411
  654    H    GLN  84           H        GLN  84 -36.473   9.355   1.056
  655    HA   GLN  84           HA       GLN  84 -34.580  11.478   1.558
  656    HB2  GLN  84           2HB      GLN  84 -34.422   8.743   2.819
  657    HB3  GLN  84           3HB      GLN  84 -33.737  10.256   3.366
  658    HG2  GLN  84           2HG      GLN  84 -36.559   9.322   3.572
  659    HG3  GLN  84           3HG      GLN  84 -35.508   9.916   4.811
  660   HE21  GLN  84          1HE2      GLN  84 -37.973  10.752   2.571
  661   HE22  GLN  84          2HE2      GLN  84 -37.978  12.489   2.904
  662    H    ALA  85           H        ALA  85 -34.289   8.234   0.046
  663    HA   ALA  85           HA       ALA  85 -31.421   8.419  -0.278
  664    HB1  ALA  85           3HB      ALA  85 -32.658   6.268  -0.221
  665    HB2  ALA  85           1HB      ALA  85 -33.451   6.688  -1.755
  666    HB3  ALA  85           2HB      ALA  85 -31.696   6.446  -1.701
  667    H    LEU  86           H        LEU  86 -34.150   9.543  -2.225
  668    HA   LEU  86           HA       LEU  86 -32.442  10.140  -4.502
  669    HB2  LEU  86           2HB      LEU  86 -35.279  11.077  -4.061
  670    HB3  LEU  86           3HB      LEU  86 -34.345  11.065  -5.551
  671    HG   LEU  86           HG       LEU  86 -35.700   8.813  -4.115
  672   HD11  LEU  86          1HD1      LEU  86 -36.663   9.998  -6.073
  673   HD12  LEU  86          2HD1      LEU  86 -35.286   9.483  -7.050
  674   HD13  LEU  86          3HD1      LEU  86 -36.406   8.265  -6.391
  675   HD21  LEU  86          3HD2      LEU  86 -33.320   8.393  -5.995
  676   HD22  LEU  86          1HD2      LEU  86 -33.460   7.810  -4.323
  677   HD23  LEU  86          2HD2      LEU  86 -34.501   7.131  -5.566
  678    H    LEU  87           H        LEU  87 -33.785  12.103  -1.856
  679    HA   LEU  87           HA       LEU  87 -32.467  14.537  -2.835
  680    HB2  LEU  87           2HB      LEU  87 -32.783  15.464  -0.581
  681    HB3  LEU  87           3HB      LEU  87 -34.247  14.961  -1.421
  682    HG   LEU  87           HG       LEU  87 -33.725  12.764   0.126
  683   HD11  LEU  87          1HD1      LEU  87 -33.254  13.508   2.390
  684   HD12  LEU  87          2HD1      LEU  87 -31.868  13.866   1.334
  685   HD13  LEU  87          3HD1      LEU  87 -32.978  15.168   1.821
  686   HD21  LEU  87          3HD2      LEU  87 -35.513  13.634   1.620
  687   HD22  LEU  87          1HD2      LEU  87 -35.283  15.255   0.934
  688   HD23  LEU  87          2HD2      LEU  87 -35.892  13.931  -0.082
  689    H    GLY  88           H        GLY  88 -31.393  11.784  -0.904
  690    HA2  GLY  88           HA2      GLY  88 -29.099  11.156  -1.305
  691    HA3  GLY  88           HA3      GLY  88 -28.603  12.845  -1.276
  692    H    ALA  89           H        ALA  89 -30.868  11.883   1.188
  693    HA   ALA  89           HA       ALA  89 -29.230  12.420   3.406
  694    HB1  ALA  89           3HB      ALA  89 -30.888  11.153   4.708
  695    HB2  ALA  89           1HB      ALA  89 -31.680  12.188   3.507
  696    HB3  ALA  89           2HB      ALA  89 -31.524  10.436   3.216
  697    H    GLU  90           H        GLU  90 -29.902   9.233   1.915
  698    HA   GLU  90           HA       GLU  90 -27.191   8.288   2.278
  699    HB2  GLU  90           2HB      GLU  90 -27.853   6.170   3.439
  700    HB3  GLU  90           3HB      GLU  90 -27.897   7.603   4.457
  701    HG2  GLU  90           2HG      GLU  90 -30.354   7.698   4.303
  702    HG3  GLU  90           3HG      GLU  90 -30.364   6.345   3.175
  703    H    GLU  91           H        GLU  91 -26.692   6.669   0.715
  704    HA   GLU  91           HA       GLU  91 -28.791   6.016  -1.292
  705    HB2  GLU  91           2HB      GLU  91 -25.842   5.294  -1.056
  706    HB3  GLU  91           3HB      GLU  91 -26.949   4.518  -2.190
  707    HG2  GLU  91           2HG      GLU  91 -26.154   6.219  -3.510
  708    HG3  GLU  91           3HG      GLU  91 -27.664   6.894  -2.909
  709    H    ARG  92           H        ARG  92 -30.175   4.541  -0.982
  710    HA   ARG  92           HA       ARG  92 -29.644   2.173   0.770
  711    HB2  ARG  92           2HB      ARG  92 -30.449   4.125   2.128
  712    HB3  ARG  92           3HB      ARG  92 -31.886   4.215   1.121
  713    HG2  ARG  92           2HG      ARG  92 -32.510   3.145   3.129
  714    HG3  ARG  92           3HG      ARG  92 -32.495   1.886   1.894
  715    HD2  ARG  92           2HD      ARG  92 -30.340   1.054   2.697
  716    HD3  ARG  92           3HD      ARG  92 -30.205   2.381   3.848
  717    HE   ARG  92           HE       ARG  92 -31.872  -0.026   4.069
  718   HH11  ARG  92          1HH2      ARG  92 -31.351   3.207   5.435
  719   HH12  ARG  92          2HH2      ARG  92 -32.378   2.843   6.799
  720   HH21  ARG  92          1HH1      ARG  92 -33.025  -0.407   5.922
  721   HH22  ARG  92          2HH1      ARG  92 -33.217   0.853   7.106
  722    H    LYS  93           H        LYS  93 -30.638   0.387   0.218
  723    HA   LYS  93           HA       LYS  93 -32.634   0.283  -1.979
  724    HB2  LYS  93           2HB      LYS  93 -30.725  -1.237  -2.055
  725    HB3  LYS  93           3HB      LYS  93 -31.243  -1.956  -0.507
  726    HG2  LYS  93           2HG      LYS  93 -33.473  -2.451  -1.769
  727    HG3  LYS  93           3HG      LYS  93 -32.564  -2.046  -3.228
  728    HD2  LYS  93           2HD      LYS  93 -31.832  -4.199  -1.211
  729    HD3  LYS  93           3HD      LYS  93 -32.622  -4.473  -2.769
  730    HE2  LYS  93           2HE      LYS  93 -30.629  -3.445  -3.910
  731    HE3  LYS  93           3HE      LYS  93 -29.820  -3.330  -2.336
  732    HZ1  LYS  93           HZ1      LYS  93 -30.719  -5.815  -3.682
  733    HZ2  LYS  93           HZ2      LYS  93 -29.165  -5.347  -3.504
  734    HZ3  LYS  93           HZ3      LYS  93 -30.032  -5.788  -2.183
  735    H    VAL  94           H        VAL  94 -34.704   0.038  -1.656
  736    HA   VAL  94           HA       VAL  94 -35.803  -0.695   1.018
  737    HB   VAL  94           HB       VAL  94 -36.953   1.599  -0.591
  738   HG11  VAL  94          1HG1      VAL  94 -38.385   0.659   1.159
  739   HG12  VAL  94          2HG1      VAL  94 -37.104   0.838   2.362
  740   HG13  VAL  94          3HG1      VAL  94 -37.875   2.269   1.622
  741   HG21  VAL  94          3HG2      VAL  94 -34.848   1.895   1.587
  742   HG22  VAL  94          1HG2      VAL  94 -34.706   2.415  -0.109
  743   HG23  VAL  94          2HG2      VAL  94 -35.854   3.223   0.947
  744    H    GLU  95           H        GLU  95 -37.797  -1.634   0.972
  745    HA   GLU  95           HA       GLU  95 -38.659  -2.820  -1.589
  746    HB2  GLU  95           2HB      GLU  95 -40.153  -4.131  -0.215
  747    HB3  GLU  95           3HB      GLU  95 -38.499  -4.208   0.429
  748    HG2  GLU  95           2HG      GLU  95 -39.086  -2.550   2.178
  749    HG3  GLU  95           3HG      GLU  95 -40.730  -2.440   1.561
  750    H    ILE  96           H        ILE  96 -40.864  -2.511  -2.355
  751    HA   ILE  96           HA       ILE  96 -42.539  -0.466  -1.257
  752    HB   ILE  96           HB       ILE  96 -42.384   0.739  -3.726
  753   HG12  ILE  96          2HG1      ILE  96 -40.091   1.468  -4.153
  754   HG13  ILE  96          3HG1      ILE  96 -39.474   0.321  -2.961
  755   HG21  ILE  96          1HG2      ILE  96 -40.810   1.785  -1.408
  756   HG22  ILE  96          2HG2      ILE  96 -41.672   2.676  -2.670
  757   HG23  ILE  96          3HG2      ILE  96 -42.594   1.785  -1.462
  758   HD11  ILE  96          3HD1      ILE  96 -39.220  -0.579  -5.202
  759   HD12  ILE  96          1HD1      ILE  96 -40.425  -1.530  -4.327
  760   HD13  ILE  96          2HD1      ILE  96 -40.965  -0.345  -5.521
  761    H    ALA  97           H        ALA  97 -44.455  -0.122  -2.522
  762    HA   ALA  97           HA       ALA  97 -45.057  -2.416  -4.329
  763    HB1  ALA  97           3HB      ALA  97 -46.545  -2.301  -2.351
  764    HB2  ALA  97           1HB      ALA  97 -47.076  -0.698  -2.881
  765    HB3  ALA  97           2HB      ALA  97 -47.423  -2.094  -3.870
  766    H    PHE  98           H        PHE  98 -46.013  -2.211  -6.224
  767    HA   PHE  98           HA       PHE  98 -46.277   0.498  -7.475
  768    HB2  PHE  98           2HB      PHE  98 -45.278  -2.110  -8.650
  769    HB3  PHE  98           3HB      PHE  98 -46.025  -0.892  -9.661
  770    HD1  PHE  98           HD2      PHE  98 -43.045  -1.551  -7.466
  771    HD2  PHE  98           HD1      PHE  98 -44.936   1.084 -10.320
  772    HE1  PHE  98           HE2      PHE  98 -40.938  -0.262  -7.708
  773    HE2  PHE  98           HE1      PHE  98 -42.818   2.344 -10.562
  774    HZ   PHE  98           HZ       PHE  98 -40.839   1.713  -9.212
  775    H    TYR  99           H        TYR  99 -48.076   0.800  -8.847
  776    HA   TYR  99           HA       TYR  99 -49.973  -1.443  -8.986
  777    HB2  TYR  99           2HB      TYR  99 -51.898  -0.278  -8.548
  778    HB3  TYR  99           3HB      TYR  99 -50.811   0.208  -7.266
  779    HD1  TYR  99           HD1      TYR  99 -49.798   2.550  -7.299
  780    HD2  TYR  99           HD2      TYR  99 -52.812   1.273 -10.114
  781    HE1  TYR  99           HE1      TYR  99 -50.337   4.928  -7.822
  782    HE2  TYR  99           HE2      TYR  99 -53.323   3.646 -10.650
  783    HH   TYR  99           HH       TYR  99 -52.837   5.845 -10.214
  784    H    ARG 100           H        ARG 100 -50.892  -1.790 -10.879
  785    HA   ARG 100           HA       ARG 100 -49.729  -0.431 -13.193
  786    HB2  ARG 100           2HB      ARG 100 -51.355  -2.956 -12.760
  787    HB3  ARG 100           3HB      ARG 100 -51.114  -2.309 -14.393
  788    HG2  ARG 100           2HG      ARG 100 -48.728  -2.349 -14.176
  789    HG3  ARG 100           3HG      ARG 100 -48.812  -2.854 -12.477
  790    HD2  ARG 100           2HD      ARG 100 -49.685  -5.007 -13.066
  791    HD3  ARG 100           3HD      ARG 100 -49.964  -4.507 -14.750
  792    HE   ARG 100           HE       ARG 100 -47.276  -4.056 -14.407
  793   HH11  ARG 100          1HH1      ARG 100 -49.137  -6.979 -13.839
  794   HH12  ARG 100          2HH1      ARG 100 -47.882  -8.003 -14.480
  795   HH21  ARG 100          2HH2      ARG 100 -45.920  -5.363 -15.476
  796   HH22  ARG 100          1HH2      ARG 100 -46.037  -7.106 -15.324
  797    H    LYS 101           H        LYS 101 -50.832   0.282 -14.991
  798    HA   LYS 101           HA       LYS 101 -53.055   2.035 -14.728
  799    HB2  LYS 101           2HB      LYS 101 -51.460   2.226 -16.468
  800    HB3  LYS 101           3HB      LYS 101 -51.745   0.599 -17.064
  801    HG2  LYS 101           2HG      LYS 101 -54.032   2.582 -17.119
  802    HG3  LYS 101           3HG      LYS 101 -52.711   2.758 -18.279
  803    HD2  LYS 101           2HD      LYS 101 -53.001   0.483 -19.089
  804    HD3  LYS 101           3HD      LYS 101 -54.292   0.176 -17.923
  805    HE2  LYS 101           2HE      LYS 101 -55.662   1.975 -18.920
  806    HE3  LYS 101           3HE      LYS 101 -54.374   2.330 -20.081
  807    HZ1  LYS 101           HZ1      LYS 101 -56.070   0.895 -21.058
  808    HZ2  LYS 101           HZ2      LYS 101 -54.660   0.080 -20.982
  809    HZ3  LYS 101           HZ3      LYS 101 -55.854  -0.245 -19.913
  810    H    ASP 102           H        ASP 102 -53.040  -1.431 -15.356
  811    HA   ASP 102           HA       ASP 102 -55.868  -1.647 -15.928
  812    HB2  ASP 102           2HB      ASP 102 -54.029  -3.200 -16.687
  813    HB3  ASP 102           3HB      ASP 102 -53.915  -3.797 -15.031
  814    H    GLY 103           H        GLY 103 -54.292  -1.029 -12.986
  815    HA2  GLY 103           HA2      GLY 103 -55.436  -0.514 -11.021
  816    HA3  GLY 103           HA3      GLY 103 -56.733  -1.633 -11.427
  817    H    SER 104           H        SER 104 -53.750  -3.231 -11.825
  818    HA   SER 104           HA       SER 104 -54.182  -4.794  -9.353
  819    HB2  SER 104           2HB      SER 104 -52.139  -5.136 -11.576
  820    HB3  SER 104           3HB      SER 104 -52.419  -6.261 -10.231
  821    HG   SER 104           HG       SER 104 -53.566  -6.878 -12.131
  822    H    CYS 105           H        CYS 105 -53.040  -4.578  -7.479
  823    HA   CYS 105           HA       CYS 105 -50.625  -2.807  -7.437
  824    HB2  CYS 105           2HB      CYS 105 -52.714  -1.717  -6.644
  825    HB3  CYS 105           3HB      CYS 105 -52.902  -2.992  -5.428
  826    HG   CYS 105           HG       CYS 105 -52.055  -0.821  -4.284
  827    H    PHE 106           H        PHE 106 -48.830  -3.583  -6.452
  828    HA   PHE 106           HA       PHE 106 -48.961  -5.933  -4.632
  829    HB2  PHE 106           2HB      PHE 106 -47.319  -7.112  -6.179
  830    HB3  PHE 106           3HB      PHE 106 -48.989  -7.039  -6.703
  831    HD1  PHE 106           HD1      PHE 106 -45.566  -5.748  -7.373
  832    HD2  PHE 106           HD2      PHE 106 -49.683  -5.755  -8.658
  833    HE1  PHE 106           HE1      PHE 106 -44.910  -4.663  -9.506
  834    HE2  PHE 106           HE2      PHE 106 -49.026  -4.656 -10.777
  835    HZ   PHE 106           HZ       PHE 106 -46.636  -4.104 -11.211
  836    H    LEU 107           H        LEU 107 -47.324  -6.174  -3.273
  837    HA   LEU 107           HA       LEU 107 -44.954  -4.353  -3.305
  838    HB2  LEU 107           2HB      LEU 107 -46.685  -4.362  -1.346
  839    HB3  LEU 107           3HB      LEU 107 -46.107  -5.957  -0.999
  840    HG   LEU 107           HG       LEU 107 -44.933  -4.861   0.541
  841   HD11  LEU 107          1HD1      LEU 107 -43.087  -5.763  -0.788
  842   HD12  LEU 107          2HD1      LEU 107 -42.985  -4.224  -1.685
  843   HD13  LEU 107          3HD1      LEU 107 -42.637  -4.282   0.045
  844   HD21  LEU 107          3HD2      LEU 107 -44.229  -2.608   0.628
  845   HD22  LEU 107          1HD2      LEU 107 -44.668  -2.371  -1.064
  846   HD23  LEU 107          2HD2      LEU 107 -45.927  -2.709   0.137
  847    H    CYS 108           H        CYS 108 -42.976  -5.288  -3.462
  848    HA   CYS 108           HA       CYS 108 -42.502  -8.096  -2.701
  849    HB2  CYS 108           2HB      CYS 108 -42.134  -6.962  -5.479
  850    HB3  CYS 108           3HB      CYS 108 -40.966  -8.147  -4.875
  851    HG   CYS 108           HG       CYS 108 -44.228  -8.545  -4.589
  852    H    LEU 109           H        LEU 109 -39.977  -8.457  -2.766
  853    HA   LEU 109           HA       LEU 109 -38.740  -6.243  -1.279
  854    HB2  LEU 109           2HB      LEU 109 -38.567  -8.603  -0.550
  855    HB3  LEU 109           3HB      LEU 109 -37.709  -9.006  -2.031
  856    HG   LEU 109           HG       LEU 109 -35.780  -7.660  -1.355
  857   HD11  LEU 109          1HD1      LEU 109 -37.440  -6.886   1.078
  858   HD12  LEU 109          2HD1      LEU 109 -35.690  -6.619   0.911
  859   HD13  LEU 109          3HD1      LEU 109 -36.802  -5.796  -0.180
  860   HD21  LEU 109          3HD2      LEU 109 -35.975  -9.973  -0.519
  861   HD22  LEU 109          1HD2      LEU 109 -35.090  -8.932   0.608
  862   HD23  LEU 109          2HD2      LEU 109 -36.779  -9.374   0.950
  863    H    VAL 110           H        VAL 110 -39.243  -5.036  -3.392
  864    HA   VAL 110           HA       VAL 110 -37.855  -5.461  -5.789
  865    HB   VAL 110           HB       VAL 110 -38.814  -2.854  -4.639
  866   HG11  VAL 110          1HG1      VAL 110 -39.109  -2.131  -7.021
  867   HG12  VAL 110          2HG1      VAL 110 -37.414  -2.379  -6.598
  868   HG13  VAL 110          3HG1      VAL 110 -38.291  -3.603  -7.540
  869   HG21  VAL 110          3HG2      VAL 110 -40.219  -4.865  -6.466
  870   HG22  VAL 110          1HG2      VAL 110 -40.671  -4.485  -4.791
  871   HG23  VAL 110          2HG2      VAL 110 -40.868  -3.272  -6.042
  872    H    ASP 111           H        ASP 111 -35.973  -4.413  -6.764
  873    HA   ASP 111           HA       ASP 111 -33.890  -4.097  -4.640
  874    HB2  ASP 111           2HB      ASP 111 -33.958  -5.971  -6.443
  875    HB3  ASP 111           3HB      ASP 111 -33.243  -4.755  -7.500
  876    H    VAL 112           H        VAL 112 -34.685  -1.841  -4.387
  877    HA   VAL 112           HA       VAL 112 -34.209   0.054  -6.536
  878    HB   VAL 112           HB       VAL 112 -35.040   0.540  -3.644
  879   HG11  VAL 112          1HG1      VAL 112 -35.709   2.177  -6.125
  880   HG12  VAL 112          2HG1      VAL 112 -36.123   2.545  -4.447
  881   HG13  VAL 112          3HG1      VAL 112 -34.438   2.633  -4.963
  882   HG21  VAL 112          3HG2      VAL 112 -36.588  -1.064  -4.620
  883   HG22  VAL 112          1HG2      VAL 112 -37.357   0.523  -4.613
  884   HG23  VAL 112          2HG2      VAL 112 -36.666  -0.135  -6.123
  885    H    VAL 113           H        VAL 113 -31.868  -0.595  -6.637
  886    HA   VAL 113           HA       VAL 113 -30.208   0.938  -4.672
  887    HB   VAL 113           HB       VAL 113 -30.014  -1.506  -4.615
  888   HG11  VAL 113          1HG1      VAL 113 -30.192  -2.010  -7.049
  889   HG12  VAL 113          2HG1      VAL 113 -28.574  -1.311  -7.290
  890   HG13  VAL 113          3HG1      VAL 113 -28.784  -2.750  -6.280
  891   HG21  VAL 113          3HG2      VAL 113 -27.439  -0.086  -5.376
  892   HG22  VAL 113          1HG2      VAL 113 -28.207  -0.099  -3.766
  893   HG23  VAL 113          2HG2      VAL 113 -27.586  -1.599  -4.463
  894    HA   PRO 114           HA       PRO 114 -29.102   3.446  -8.178
  895    HB2  PRO 114           2HB      PRO 114 -27.552   5.291  -7.028
  896    HB3  PRO 114           3HB      PRO 114 -29.209   5.052  -6.427
  897    HG2  PRO 114           2HG      PRO 114 -26.679   3.845  -5.265
  898    HG3  PRO 114           3HG      PRO 114 -27.944   4.817  -4.430
  899    HD2  PRO 114           2HD      PRO 114 -28.029   2.102  -4.445
  900    HD3  PRO 114           3HD      PRO 114 -29.508   3.107  -4.545
  901    H    VAL 115           H        VAL 115 -26.854   4.679  -9.020
  902    HA   VAL 115           HA       VAL 115 -24.626   2.700  -8.945
  903    HB   VAL 115           HB       VAL 115 -24.085   3.238 -11.287
  904   HG11  VAL 115          1HG1      VAL 115 -25.111   1.112 -10.627
  905   HG12  VAL 115          2HG1      VAL 115 -26.729   1.813 -10.837
  906   HG13  VAL 115          3HG1      VAL 115 -25.650   1.624 -12.235
  907   HG21  VAL 115          3HG2      VAL 115 -25.454   5.252 -11.570
  908   HG22  VAL 115          1HG2      VAL 115 -25.764   4.038 -12.814
  909   HG23  VAL 115          2HG2      VAL 115 -26.928   4.263 -11.481
  910    H    LYS 116           H        LYS 116 -22.792   3.343  -8.463
  911    HA   LYS 116           HA       LYS 116 -22.109   6.222  -8.221
  912    HB2  LYS 116           2HB      LYS 116 -21.109   3.859  -6.588
  913    HB3  LYS 116           3HB      LYS 116 -20.573   5.504  -6.378
  914    HG2  LYS 116           2HG      LYS 116 -22.441   6.148  -5.259
  915    HG3  LYS 116           3HG      LYS 116 -23.518   5.103  -6.164
  916    HD2  LYS 116           2HD      LYS 116 -22.903   3.177  -4.865
  917    HD3  LYS 116           3HD      LYS 116 -21.527   4.005  -4.118
  918    HE2  LYS 116           2HE      LYS 116 -24.359   5.050  -3.804
  919    HE3  LYS 116           3HE      LYS 116 -23.771   3.750  -2.764
  920    HZ1  LYS 116           HZ1      LYS 116 -22.329   5.159  -1.699
  921    HZ2  LYS 116           HZ2      LYS 116 -22.065   6.120  -2.982
  922    HZ3  LYS 116           HZ3      LYS 116 -23.447   6.295  -2.120
  923    H    ASN 117           H        ASN 117 -19.914   6.731  -8.251
  924    HA   ASN 117           HA       ASN 117 -18.366   5.310 -10.394
  925    HB2  ASN 117           2HB      ASN 117 -17.251   7.278 -10.879
  926    HB3  ASN 117           3HB      ASN 117 -18.888   7.813 -10.587
  927   HD21  ASN 117          2HD2      ASN 117 -19.287   8.822  -8.306
  928   HD22  ASN 117          1HD2      ASN 117 -17.893   9.657  -7.636
  929    H    GLU 118           H        GLU 118 -15.818   5.677  -9.968
  930    HA   GLU 118           HA       GLU 118 -15.140   3.827  -7.925
  931    HB2  GLU 118           2HB      GLU 118 -12.847   4.207  -8.584
  932    HB3  GLU 118           3HB      GLU 118 -13.890   4.086  -9.998
  933    HG2  GLU 118           2HG      GLU 118 -13.874   6.580 -10.209
  934    HG3  GLU 118           3HG      GLU 118 -12.805   6.681  -8.809
  935    H    ASP 119           H        ASP 119 -15.374   7.323  -7.658
  936    HA   ASP 119           HA       ASP 119 -13.922   7.557  -5.165
  937    HB2  ASP 119           2HB      ASP 119 -14.544   9.398  -6.850
  938    HB3  ASP 119           3HB      ASP 119 -16.159   9.358  -6.141
  939    H    GLY 120           H        GLY 120 -17.008   6.228  -5.923
  940    HA2  GLY 120           HA2      GLY 120 -18.375   5.030  -4.437
  941    HA3  GLY 120           HA3      GLY 120 -17.777   5.969  -3.069
  942    H    ALA 121           H        ALA 121 -18.494   8.190  -5.473
  943    HA   ALA 121           HA       ALA 121 -21.031   8.882  -4.163
  944    HB1  ALA 121           3HB      ALA 121 -19.213  10.580  -4.454
  945    HB2  ALA 121           1HB      ALA 121 -19.406  10.440  -6.219
  946    HB3  ALA 121           2HB      ALA 121 -20.738  11.064  -5.230
  947    H    VAL 122           H        VAL 122 -22.982   9.095  -5.020
  948    HA   VAL 122           HA       VAL 122 -23.616   7.381  -7.251
  949    HB   VAL 122           HB       VAL 122 -24.943   7.288  -5.310
  950   HG11  VAL 122          1HG1      VAL 122 -25.982  10.099  -5.810
  951   HG12  VAL 122          2HG1      VAL 122 -26.546   8.943  -4.601
  952   HG13  VAL 122          3HG1      VAL 122 -24.913   9.611  -4.471
  953   HG21  VAL 122          3HG2      VAL 122 -27.146   7.336  -6.304
  954   HG22  VAL 122          1HG2      VAL 122 -26.593   8.409  -7.597
  955   HG23  VAL 122          2HG2      VAL 122 -25.956   6.761  -7.486
  956    H    ILE 123           H        ILE 123 -23.000   8.051  -9.155
  957    HA   ILE 123           HA       ILE 123 -23.551  10.808 -10.018
  958    HB   ILE 123           HB       ILE 123 -22.161  10.611 -11.744
  959   HG12  ILE 123          2HG1      ILE 123 -22.880   8.719 -12.966
  960   HG13  ILE 123          3HG1      ILE 123 -21.153   8.653 -12.731
  961   HG21  ILE 123          1HG2      ILE 123 -20.857   8.768  -9.732
  962   HG22  ILE 123          2HG2      ILE 123 -20.061   9.884 -10.864
  963   HG23  ILE 123          3HG2      ILE 123 -21.037  10.519  -9.527
  964   HD11  ILE 123          3HD1      ILE 123 -21.537   6.932 -10.898
  965   HD12  ILE 123          1HD1      ILE 123 -23.243   6.907 -11.408
  966   HD13  ILE 123          2HD1      ILE 123 -21.985   6.433 -12.539
  967    H    MET 124           H        MET 124 -24.911   7.586 -10.516
  968    HA   MET 124           HA       MET 124 -27.153   8.990 -11.846
  969    HB2  MET 124           2HB      MET 124 -25.639   6.738 -13.137
  970    HB3  MET 124           3HB      MET 124 -27.396   6.750 -13.254
  971    HG2  MET 124           2HG      MET 124 -27.118   8.008 -15.045
  972    HG3  MET 124           3HG      MET 124 -26.882   9.335 -13.925
  973    HE1  MET 124           3HE      MET 124 -25.676  10.755 -15.711
  974    HE2  MET 124           1HE      MET 124 -24.932  10.868 -14.101
  975    HE3  MET 124           2HE      MET 124 -23.901  10.775 -15.542
  976    H    PHE 125           H        PHE 125 -29.059   8.146 -11.753
  977    HA   PHE 125           HA       PHE 125 -29.616   6.360  -9.403
  978    HB2  PHE 125           2HB      PHE 125 -30.933   8.826 -10.552
  979    HB3  PHE 125           3HB      PHE 125 -31.940   7.628  -9.777
  980    HD1  PHE 125           HD1      PHE 125 -29.288   7.265  -7.620
  981    HD2  PHE 125           HD2      PHE 125 -32.110  10.269  -8.916
  982    HE1  PHE 125           HE1      PHE 125 -28.994   8.468  -5.491
  983    HE2  PHE 125           HE2      PHE 125 -31.757  11.491  -6.783
  984    HZ   PHE 125           HZ       PHE 125 -30.178  10.601  -5.083
  985    H    ILE 126           H        ILE 126 -29.152   4.572 -10.722
  986    HA   ILE 126           HA       ILE 126 -31.374   3.864 -12.587
  987    HB   ILE 126           HB       ILE 126 -28.723   2.452 -12.179
  988   HG12  ILE 126          2HG1      ILE 126 -29.691   4.389 -14.323
  989   HG13  ILE 126          3HG1      ILE 126 -28.382   4.654 -13.192
  990   HG21  ILE 126          1HG2      ILE 126 -30.781   1.059 -12.985
  991   HG22  ILE 126          2HG2      ILE 126 -30.729   2.032 -14.434
  992   HG23  ILE 126          3HG2      ILE 126 -29.339   1.026 -13.997
  993   HD11  ILE 126          3HD1      ILE 126 -27.436   4.120 -15.292
  994   HD12  ILE 126          1HD1      ILE 126 -27.150   2.741 -14.182
  995   HD13  ILE 126          2HD1      ILE 126 -28.405   2.635 -15.433
  996    H    LEU 127           H        LEU 127 -32.631   3.996 -10.555
  997    HA   LEU 127           HA       LEU 127 -32.227   1.829  -8.640
  998    HB2  LEU 127           2HB      LEU 127 -34.634   3.647  -8.833
  999    HB3  LEU 127           3HB      LEU 127 -34.105   2.640  -7.513
 1000    HG   LEU 127           HG       LEU 127 -33.255   4.455  -6.633
 1001   HD11  LEU 127          1HD1      LEU 127 -31.197   5.245  -6.923
 1002   HD12  LEU 127          2HD1      LEU 127 -31.192   3.490  -7.107
 1003   HD13  LEU 127          3HD1      LEU 127 -31.028   4.544  -8.550
 1004   HD21  LEU 127          3HD2      LEU 127 -34.491   5.917  -8.120
 1005   HD22  LEU 127          1HD2      LEU 127 -32.899   6.601  -7.772
 1006   HD23  LEU 127          2HD2      LEU 127 -33.194   5.786  -9.334
 1007    H    ASN 128           H        ASN 128 -32.214   0.126 -10.034
 1008    HA   ASN 128           HA       ASN 128 -34.115  -0.712 -11.877
 1009    HB2  ASN 128           2HB      ASN 128 -32.575  -2.585 -10.018
 1010    HB3  ASN 128           3HB      ASN 128 -33.227  -2.978 -11.600
 1011   HD21  ASN 128          2HD2      ASN 128 -30.540  -1.593  -9.866
 1012   HD22  ASN 128          1HD2      ASN 128 -29.602  -1.194 -11.290
 1013    H    PHE 129           H        PHE 129 -36.412  -0.666 -11.425
 1014    HA   PHE 129           HA       PHE 129 -37.296  -1.720  -8.864
 1015    HB2  PHE 129           2HB      PHE 129 -38.910  -0.596 -11.151
 1016    HB3  PHE 129           3HB      PHE 129 -39.486  -1.072  -9.542
 1017    HD1  PHE 129           HD2      PHE 129 -38.487   0.120  -7.486
 1018    HD2  PHE 129           HD1      PHE 129 -38.249   1.677 -11.497
 1019    HE1  PHE 129           HE2      PHE 129 -38.157   2.404  -6.574
 1020    HE2  PHE 129           HE1      PHE 129 -37.912   3.962 -10.577
 1021    HZ   PHE 129           HZ       PHE 129 -37.859   4.329  -8.126
 1022    H    GLU 130           H        GLU 130 -36.113  -3.743  -9.623
 1023    HA   GLU 130           HA       GLU 130 -37.796  -5.581 -11.203
 1024    HB2  GLU 130           2HB      GLU 130 -36.138  -7.295 -10.489
 1025    HB3  GLU 130           3HB      GLU 130 -35.522  -5.956 -11.494
 1026    HG2  GLU 130           2HG      GLU 130 -34.515  -4.870  -9.621
 1027    HG3  GLU 130           3HG      GLU 130 -35.282  -5.946  -8.466
 1028    H    VAL 131           H        VAL 131 -39.293  -6.775 -10.487
 1029    HA   VAL 131           HA       VAL 131 -40.157  -6.745  -7.666
 1030    HB   VAL 131           HB       VAL 131 -41.299  -7.815 -10.241
 1031   HG11  VAL 131          1HG1      VAL 131 -43.396  -8.281  -9.089
 1032   HG12  VAL 131          2HG1      VAL 131 -42.103  -9.266  -8.398
 1033   HG13  VAL 131          3HG1      VAL 131 -42.673  -7.810  -7.542
 1034   HG21  VAL 131          3HG2      VAL 131 -42.222  -5.545  -8.423
 1035   HG22  VAL 131          1HG2      VAL 131 -41.351  -5.341  -9.956
 1036   HG23  VAL 131          2HG2      VAL 131 -42.976  -6.042  -9.954
 1037    H    VAL 132           H        VAL 132 -39.294  -8.179  -6.263
 1038    HA   VAL 132           HA       VAL 132 -38.930 -10.972  -7.160
 1039    HB   VAL 132           HB       VAL 132 -36.798 -10.020  -7.659
 1040   HG11  VAL 132          1HG1      VAL 132 -36.722  -8.114  -6.094
 1041   HG12  VAL 132          2HG1      VAL 132 -36.520  -9.246  -4.736
 1042   HG13  VAL 132          3HG1      VAL 132 -35.273  -9.117  -5.991
 1043   HG21  VAL 132          3HG2      VAL 132 -35.368 -11.545  -6.445
 1044   HG22  VAL 132          1HG2      VAL 132 -36.569 -11.731  -5.152
 1045   HG23  VAL 132          2HG2      VAL 132 -36.911 -12.341  -6.791
 1046    H    MET 133           H        MET 133 -39.377 -12.472  -5.687
 1047    HA   MET 133           HA       MET 133 -39.399 -11.854  -2.816
 1048    HB2  MET 133           2HB      MET 133 -41.636 -12.752  -2.456
 1049    HB3  MET 133           3HB      MET 133 -41.686 -11.303  -3.454
 1050    HG2  MET 133           2HG      MET 133 -41.962 -12.660  -5.481
 1051    HG3  MET 133           3HG      MET 133 -41.844 -14.148  -4.541
 1052    HE1  MET 133           3HE      MET 133 -45.199 -14.373  -2.642
 1053    HE2  MET 133           1HE      MET 133 -43.695 -15.192  -3.115
 1054    HE3  MET 133           2HE      MET 133 -43.644 -13.808  -1.998
 1055    H    GLU 134           H        GLU 134 -39.489 -13.756  -1.472
 1056    HA   GLU 134           HA       GLU 134 -38.057 -16.054  -2.547
 1057    HB2  GLU 134           2HB      GLU 134 -39.325 -15.610   0.184
 1058    HB3  GLU 134           3HB      GLU 134 -38.259 -16.948  -0.264
 1059    HG2  GLU 134           2HG      GLU 134 -36.470 -15.263  -0.830
 1060    HG3  GLU 134           3HG      GLU 134 -37.512 -13.994  -0.187
 1061    H    LYS 135           H        LYS 135 -38.747 -18.203  -2.656
 1062    HA   LYS 135           HA       LYS 135 -41.618 -18.882  -2.454
 1063    HB2  LYS 135           2HB      LYS 135 -41.242 -18.007  -4.768
 1064    HB3  LYS 135           3HB      LYS 135 -40.018 -19.260  -5.025
 1065    HG2  LYS 135           2HG      LYS 135 -41.743 -21.015  -4.688
 1066    HG3  LYS 135           3HG      LYS 135 -42.959 -19.764  -4.360
 1067    HD2  LYS 135           2HD      LYS 135 -42.644 -18.861  -6.651
 1068    HD3  LYS 135           3HD      LYS 135 -41.420 -20.109  -6.975
 1069    HE2  LYS 135           2HE      LYS 135 -43.120 -21.876  -6.561
 1070    HE3  LYS 135           3HE      LYS 135 -44.337 -20.633  -6.241
 1071    HZ1  LYS 135           HZ1      LYS 135 -42.926 -21.007  -8.831
 1072    HZ2  LYS 135           HZ2      LYS 135 -44.471 -21.434  -8.528
 1073    HZ3  LYS 135           HZ3      LYS 135 -44.052 -19.858  -8.535