*HEADER    LIGASE                                  03-DEC-09   2KR4              
*TITLE     U-BOX DOMAIN OF THE E3 UBIQUITIN LIGASE E4B                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UBIQUITIN CONJUGATION FACTOR E4 B;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: U-BOX DOMAIN (UNP RESIDUES 1092-1173);                     
*COMPND   5 SYNONYM: UBIQUITIN FUSION DEGRADATION PROTEIN 2, UFD2A;              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: UBE4B, UFD2;                                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PBG102;                                    
*SOURCE   9 OTHER_DETAILS: 6XHIS-SUMO TAG WITH H3C PROTEASE CLEAVAGE             
*SOURCE  10 SITE                                                                 
*KEYWDS    U-BOX, E4B, UFD2, RING, UBIQUITIN, E3 LIGASE, UBL                     
*KEYWDS   2 CONJUGATION PATHWAY                                                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.NORDQUIST, S.SOSS, W.CHAZIN                                         
*REVDAT   1   26-JAN-10 2KR4    0                                                


#
#   1139  ASP     HB2       1146  LEU     HG       4.983   (#peak     163   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 163, nxpk= 0, iat= 773, 894, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, 
      rk2=0.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
#   1107  LEU     HB3       1107  LEU     QD1      4.664   (#peak     177   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 177, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 266, 267, 268,
 &end
#
#   1107  LEU     HB3       1107  LEU     QD2      4.664   (#peak     177   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 177, nxpk= 0, iat= 262,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 270, 271, 272,
 &end
#
#   1130  LEU     HA        1133  LEU     HB2      4.774   (#peak     184   #SUP      0.9   #QF         0.87
)
 &rst
  ixpk= 184, nxpk= 0, iat= 620, 682, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1139  ASP     HB2       1144  GLN     H        4.653   (#peak     197   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 197, nxpk= 0, iat= 773, 853, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1131  ARG     HA        1131  ARG     QD       4.257   (#peak     217   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 217, nxpk= 0, iat= 639,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2= 647, 648,
 &end
#
#   1131  ARG     HB2       1131  ARG     QD       4.015   (#peak     224   #SUP       1
)
 &rst
  ixpk= 224, nxpk= 0, iat= 641,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 647, 648,
 &end
#
#   1104  ARG     HB2       1104  ARG     QD       3.905   (#peak     227   #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 227, nxpk= 0, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 217, 218,
 &end
#
#   1116  VAL     HB        1151  LEU     HB3      5.038   (#peak     231   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 231, nxpk= 0, iat= 399, 968, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#   1100  PRO     HD3       1103  PHE     QE       5.643   (#peak     237   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 237, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2= 197, 201,
 &end
#
#   1100  PRO     HD3       1103  PHE     QD       4.829   (#peak     238   #SUP       1
)
 &rst
  ixpk= 238, nxpk= 0, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 195, 203,
 &end
#
#   1099  ALA     QB        1100  PRO     HD3      4.532   (#peak     242   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 242, nxpk= 0, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 140, 141, 142,
 &end
#
#   1138  THR     HB        1143  ARG     HA       3.938   (#peak     258   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 258, nxpk= 0, iat= 759, 831, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1122  THR     HB        1123  VAL     H        4.653   (#peak     262   #SUP      0.63  #QF         0.63
)
 &rst
  ixpk= 262, nxpk= 0, iat= 490, 500, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1139  ASP     HB2       1140  PRO     HD2       5.39   (#peak     265   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 265, nxpk= 0, iat= 773, 782, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#   1129  ILE     HB        1140  PRO     HD2      5.973   (#peak     266   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 266, nxpk= 0, iat= 603, 782, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#   1140  PRO     HD3       1146  LEU     HG       5.203   (#peak     272   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 272, nxpk= 0, iat= 783, 894, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#   1136  SER     HA        1137  PRO     HD2      3.916   (#peak     275   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 275, nxpk= 0, iat= 732, 742, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   1136  SER     HA        1137  PRO     HD3      3.916   (#peak     276   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 276, nxpk= 0, iat= 732, 743, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   1118  LEU     HA        1119  PRO     HD3      4.191   (#peak     277   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 277, nxpk= 0, iat= 437, 456, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1152  GLU     HA        1153  PRO     HD3      3.586   (#peak     287   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 287, nxpk= 0, iat= 984, 999, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   1152  GLU     HA        1153  PRO     HD2       3.63   (#peak     288   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 288, nxpk= 0, iat= 984, 998, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   1114  ASP     HA        1115  PRO     HD2      3.861   (#peak     289   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 289, nxpk= 0, iat= 371, 382, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   1154  VAL     HA        1155  PRO     HD2      3.927   (#peak     294   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 294, nxpk= 0, iat=1013,1028, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   1118  LEU     HA        1119  PRO     HD2      4.191   (#peak     295   #SUP       1
)
 &rst
  ixpk= 295, nxpk= 0, iat= 437, 455, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1152  GLU     QG        1153  PRO     HD2      4.818   (#peak     303   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 303, nxpk= 0, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 989, 990,
 &end
#
#   1099  ALA     HA        1100  PRO     HG3      5.005   (#peak     311   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 311, nxpk= 0, iat= 138, 151, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#   1113  THR     HB        1114  ASP     H        5.225   (#peak     316   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 316, nxpk= 0, iat= 359, 369, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,  &end
#
#   1118  LEU     HB3       1122  THR     HB       5.478   (#peak     319   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 319, nxpk= 0, iat= 440, 490, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1161  ILE     HA        1161  ILE     HG12      4.18   (#peak     328   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 328, nxpk= 0, iat=1131,1139, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   1164  TRP     HA        1167  GLU     QB       4.455   (#peak     357   #SUP      0.58  #QF         0.58
)
 &rst
  ixpk= 357, nxpk= 0, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2=1244,1245,
 &end
#
#   1126  ARG     HA        1126  ARG     HG2      4.653   (#peak     360   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 360, nxpk= 0, iat= 547, 552, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1148  GLU     HA        1148  GLU     QG       3.894   (#peak     363   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 363, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 927, 928,
 &end
#
#   1156  GLU     HA        1156  GLU     QG       3.795   (#peak     372   #SUP       1
)
 &rst
  ixpk= 372, nxpk= 0, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2=1048,1049,
 &end
#
#   1158  LYS     HA        1158  LYS     HG2       4.51   (#peak     374   #SUP       1    #QF         0.79
)
 &rst
  ixpk= 374, nxpk= 0, iat=1077,1082, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   1158  LYS     HA        1158  LYS     HG3       4.51   (#peak     377   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 377, nxpk= 0, iat=1077,1083, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   1130  LEU     HA        1130  LEU     QD1      3.729   (#peak     382   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 382, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 627, 628, 629,
 &end
#
#   1160  GLN     HA        1163  ALA     QB       3.949   (#peak     384   #SUP      0.7   #QF          0.7
)
 &rst
  ixpk= 384, nxpk= 0, iat=1114,  -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr2=1169,1170,1171,
 &end
#
#   1162  GLN     HA        1162  GLN     HG3      4.191   (#peak     386   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 386, nxpk= 0, iat=1150,1156, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1167  GLU     HA        1167  GLU     QB       3.212   (#peak     387   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 387, nxpk= 0, iat=1242,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2=1244,1245,
 &end
#
#   1143  ARG     HA        1143  ARG     QG       4.664   (#peak     391   #SUP       1    #QF         0.96
)
 &rst
  ixpk= 391, nxpk= 0, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 836, 837,
 &end
#
#   1105  ASP     QB        1106  PRO     HD3      4.763   (#peak     409   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 409, nxpk= 0, iat=  -1, 245, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 235, 236,
 &end
#
#   1105  ASP     HA        1106  PRO     HD3      3.883   (#peak     418   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 418, nxpk= 0, iat= 233, 245, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   1092  ALA     HA        1093  GLU     H        3.498   (#peak     419   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 419, nxpk= 0, iat=  38,  46, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   1105  ASP     HA        1106  PRO     HD2      3.883   (#peak     420   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 420, nxpk= 0, iat= 233, 244, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   1105  ASP     QB        1125  ASP     H        5.126   (#peak     432   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 432, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 235, 236,
 &end
#
#   1093  GLU     HA        1094  ILE     H        3.531   (#peak     454   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 454, nxpk= 0, iat=  48,  61, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#   1160  GLN     HA        1163  ALA     H        5.291   (#peak     457   #SUP      0.95  #QF         0.84
)
 &rst
  ixpk= 457, nxpk= 0, iat=1114,1165, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#   1094  ILE     HA        1095  ASP     H        3.377   (#peak     460   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 460, nxpk= 0, iat=  63,  80, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   1128  ILE     HA        1128  ILE     QG2      3.894   (#peak     465   #SUP       1    #QF         0.98
)
 &rst
  ixpk= 465, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 586, 587, 588,
 &end
#
#   1163  ALA     H         1163  ALA     QB        3.19   (#peak     466   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 466, nxpk= 0, iat=1165,  -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
 igr2=1169,1170,1171,
 &end
#
#   1099  ALA     QB        1104  ARG     QD       3.916   (#peak     468   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 468, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 140, 141, 142,
 igr2= 217, 218,
 &end
#
#   1099  ALA     QB        1103  PHE     HB2      3.718   (#peak     469   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 469, nxpk= 0, iat=  -1, 191, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 140, 141, 142,
 &end
#
#   1128  ILE     QG2       1128  ILE     HG12     3.916   (#peak     472   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 472, nxpk= 0, iat=  -1, 590, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 586, 587, 588,
 &end
#
#   1092  ALA     QB        1093  GLU     H        3.355   (#peak     476   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 476, nxpk= 0, iat=  -1,  46, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=  40,  41,  42,
 &end
#
#   1144  GLN     QB        1144  GLN     HG2      3.014   (#peak     511   #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 511, nxpk= 0, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr1= 857, 858,
 &end
#
#   1100  PRO     HB2       1102  GLU     QG       3.828   (#peak     514   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 514, nxpk= 0, iat= 153,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 179, 180,
 &end
#
#   1093  GLU     HB3       1093  GLU     QG       2.926   (#peak     535   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 535, nxpk= 0, iat=  51,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2=  53,  54,
 &end
#
#   1093  GLU     HB2       1093  GLU     QG       2.926   (#peak     536   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 536, nxpk= 0, iat=  50,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2=  53,  54,
 &end
#
#   1093  GLU     HA        1093  GLU     QG       4.103   (#peak     539   #SUP      0.94  #QF          0.2
)
 &rst
  ixpk= 539, nxpk= 0, iat=  48,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2=  53,  54,
 &end
#
#   1138  THR     HA        1144  GLN     HG3      5.214   (#peak     545   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 545, nxpk= 0, iat= 757, 861, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1143  ARG     H         1144  GLN     HG2      5.423   (#peak     548   #SUP      0.37  #QF         0.37
)
 &rst
  ixpk= 548, nxpk= 0, iat= 829, 860, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#   1143  ARG     H         1144  GLN     HG3      5.379   (#peak     549   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 549, nxpk= 0, iat= 829, 861, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#   1103  PHE     HB2       1104  ARG     QG       5.478   (#peak     554   #SUP      0.94  #QF         0.66
)
 &rst
  ixpk= 554, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2= 214, 215,
 &end
#
#   1103  PHE     HB2       1111  LEU     QD2       6.05   (#peak     554   #SUP      0.94  #QF         0.66
)
 &rst
  ixpk= 554, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 332, 333, 334,
 &end
#
#   1093  GLU     HA        1094  ILE     HB       5.863   (#peak     556   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 556, nxpk= 0, iat=  48,  65, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,  &end
#
#   1158  LYS     HA        1161  ILE     HB       4.752   (#peak     557   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 557, nxpk= 0, iat=1077,1133, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#   1124  MET     HB2       1129  ILE     HB       4.961   (#peak     560   #SUP      0.78  #QF         0.64
)
 &rst
  ixpk= 560, nxpk= 0, iat= 520, 603, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   1161  ILE     HB        1162  GLN     QB       5.346   (#peak     560   #SUP      0.78  #QF         0.64
)
 &rst
  ixpk= 560, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2=1152,1153,
 &end
#
#   1094  ILE     QG2       1094  ILE     QD1      3.443   (#peak     573   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 573, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr1=  67,  68,  69,
 igr2=  74,  75,  76,
 &end
#
#   1094  ILE     QD1       1169  GLN     QG       4.796   (#peak     577   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 577, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1=  74,  75,  76,
 igr2=1284,1285,
 &end
#
#   1094  ILE     HA        1094  ILE     QD1      4.246   (#peak     579   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 579, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2=  74,  75,  76,
 &end
#
#   1094  ILE     QD1       1095  ASP     H         5.61   (#peak     580   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 580, nxpk= 0, iat=  -1,  80, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=  74,  75,  76,
 &end
#
#   1104  ARG     HA        1104  ARG     QG       4.675   (#peak     602   #SUP       1
)
 &rst
  ixpk= 602, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 214, 215,
 &end
#
#   1131  ARG     HA        1131  ARG     QG       4.455   (#peak     607   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 607, nxpk= 0, iat= 639,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 644, 645,
 &end
#
#   1094  ILE     QG2       1094  ILE     HG13     3.938   (#peak     624   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 624, nxpk= 0, iat=  -1,  72, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1094  ILE     HG12     3.938   (#peak     625   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 625, nxpk= 0, iat=  -1,  71, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1168  LYS     HB3      3.949   (#peak     626   #SUP       1
)
 &rst
  ixpk= 626, nxpk= 0, iat=  -1,1260, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     HA        1094  ILE     QG2      3.784   (#peak     627   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 627, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=  67,  68,  69,
 &end
#
#   1098  ASP     H         1099  ALA     QB       4.785   (#peak     634   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 634, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 140, 141, 142,
 &end
#
#   1099  ALA     QB        1164  TRP     HZ3      4.213   (#peak     635   #SUP      0.97  #QF         0.85
)
 &rst
  ixpk= 635, nxpk= 0, iat=  -1,1192, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr1= 140, 141, 142,
 &end
#
#   1096  TYR     HA        1099  ALA     QB       4.928   (#peak     638   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 638, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 140, 141, 142,
 &end
#
#   1099  ALA     QB        1103  PHE     HA       5.379   (#peak     639   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 639, nxpk= 0, iat=  -1, 189, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 140, 141, 142,
 &end
#
#   1168  LYS     HB2       1168  LYS     HE2      4.972   (#peak     643   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 643, nxpk= 0, iat=1259,1268, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#   1168  LYS     HB2       1168  LYS     HE3       5.28   (#peak     648   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 648, nxpk= 0, iat=1259,1269, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#   1132  HIS     HA        1135  ASN     QB       4.719   (#peak     653   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 653, nxpk= 0, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 720, 721,
 &end
#
#   1141  PHE     QB        1142  ASN     H        4.543   (#peak     669   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 669, nxpk= 0, iat=  -1, 815, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 799, 800,
 &end
#
#   1100  PRO     HB2       1102  GLU     HB3      5.335   (#peak     712   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 712, nxpk= 0, iat= 153, 177, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#   1119  PRO     HG3       1146  LEU     QD2      3.718   (#peak     721   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 721, nxpk= 0, iat= 459,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 900, 901, 902,
 &end
#
#   1111  LEU     HA        1111  LEU     HG       3.993   (#peak     730   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 730, nxpk= 0, iat= 321, 326, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1151  LEU     HA        1151  LEU     HG       4.499   (#peak     731   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 731, nxpk= 0, iat= 965, 970, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   1118  LEU     HA        1146  LEU     QD2       4.73   (#peak     737   #SUP      0.85  #QF          0.7
)
 &rst
  ixpk= 737, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 900, 901, 902,
 &end
#
#   1139  ASP     HA        1146  LEU     QD2      5.192   (#peak     737   #SUP      0.85  #QF          0.7
)
 &rst
  ixpk= 737, nxpk= 0, iat= 771,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 900, 901, 902,
 &end
#
#   1103  PHE     HA        1111  LEU     HG        6.05   (#peak     739   #SUP      0.95  #QF         0.78
)
 &rst
  ixpk= 739, nxpk= 0, iat= 189, 326, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1104  ARG     HA        1111  LEU     HG        6.05   (#peak     739   #SUP      0.95  #QF         0.78
)
 &rst
  ixpk= 739, nxpk= 0, iat= 209, 326, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1129  ILE     HA        1140  PRO     HG3       4.62   (#peak     740   #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 740, nxpk= 0, iat= 601, 786, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#   1101  ASP     HA        1104  ARG     QD       4.312   (#peak     744   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 744, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 217, 218,
 &end
#
#   1168  LYS     HA        1168  LYS     QD       3.828   (#peak     747   #SUP       1
)
 &rst
  ixpk= 747, nxpk= 0, iat=1257,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2=1265,1266,
 &end
#
#   1160  GLN     HA        1160  GLN     HG2      4.609   (#peak     748   #SUP       1
)
 &rst
  ixpk= 748, nxpk= 0, iat=1114,1119, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#   1164  TRP     HB2       1165  MET     H        4.906   (#peak     750   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 750, nxpk= 0, iat=1179,1199, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   1132  HIS     HB3       1133  LEU     HA       5.071   (#peak     768   #SUP      0.89  #QF         0.29
)
 &rst
  ixpk= 768, nxpk= 0, iat= 666, 680, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#   1132  HIS     HB3       1139  ASP     HA        5.17   (#peak     768   #SUP      0.89  #QF         0.29
)
 &rst
  ixpk= 768, nxpk= 0, iat= 666, 771, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#   1129  ILE     QD1       1132  HIS     HB3      4.785   (#peak     770   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 770, nxpk= 0, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 612, 613, 614,
 &end
#
#   1104  ARG     HA        1104  ARG     QD       4.796   (#peak     798   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 798, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 217, 218,
 &end
#
#   1104  ARG     HB3       1104  ARG     QD       4.125   (#peak     799   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 799, nxpk= 0, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr2= 217, 218,
 &end
#
#   1105  ASP     QB        1124  MET     QG       5.027   (#peak     803   #SUP      0.48  #QF         0.48
)
 &rst
  ixpk= 803, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 235, 236,
 igr2= 523, 524,
 &end
#
#   1104  ARG     HA        1105  ASP     QB        5.5    (#peak     804   #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 804, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 235, 236,
 &end
#
#   1105  ASP     QB        1108  MET     HA        6.05   (#peak     804   #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 804, nxpk= 0, iat=  -1, 278, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 235, 236,
 &end
#
#   1128  ILE     HB        1140  PRO     HG3      4.796   (#peak     814   #SUP      0.27  #QF         0.27
)
 &rst
  ixpk= 814, nxpk= 0, iat= 584, 786, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1107  LEU     HA        1107  LEU     QD1      3.971   (#peak     815   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 815, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 266, 267, 268,
 &end
#
#   1160  GLN     HA        1160  GLN     HG3      4.609   (#peak     819   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 819, nxpk= 0, iat=1114,1120, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#   1110  THR     HA        1110  THR     QG2      3.685   (#peak     839   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 839, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 311, 312, 313,
 &end
#
#   1110  THR     H         1110  THR     QG2      3.894   (#peak     842   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 842, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 311, 312, 313,
 &end
#
#   1130  LEU     H         1130  LEU     QD1       4.62   (#peak     852   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 852, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 627, 628, 629,
 &end
#
#   1111  LEU     HA        1111  LEU     QD2      3.696   (#peak     859   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 859, nxpk= 0, iat= 321,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 332, 333, 334,
 &end
#
#   1116  VAL     HB        1152  GLU     H        5.258   (#peak     863   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 863, nxpk= 0, iat= 399, 982, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   1112  MET     HG3       1125  ASP     HA       5.368   (#peak     869   #SUP      0.98  #QF         0.97
)
 &rst
  ixpk= 869, nxpk= 0, iat= 346, 535, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#   1105  ASP     HA        1108  MET     HB2       6.05   (#peak     873   #SUP      0.47  #QF         0.47
)
 &rst
  ixpk= 873, nxpk= 0, iat= 233, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1165  MET     QB        1168  LYS     H        5.621   (#peak     881   #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 881, nxpk= 0, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1=1203,1204,
 &end
#
#   1138  THR     HA        1138  THR     QG2      3.564   (#peak     885   #SUP      0.53  #QF         0.53
)
 &rst
  ixpk= 885, nxpk= 0, iat= 757,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2= 761, 762, 763,
 &end
#
#   1133  LEU     HA        1133  LEU     QD1       4.62   (#peak     886   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 886, nxpk= 0, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 687, 688, 689,
 &end
#
#   1131  ARG     HB3       1131  ARG     QD       4.015   (#peak     903   #SUP      0.98  #QF         0.85
)
 &rst
  ixpk= 903, nxpk= 0, iat= 642,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2= 647, 648,
 &end
#
#   1119  PRO     HA        1150  MET     HB3      5.236   (#peak     923   #SUP      0.96  #QF         0.92
)
 &rst
  ixpk= 923, nxpk= 0, iat= 464, 951, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   1126  ARG     HA        1129  ILE     QG2      3.432   (#peak     937   #SUP       1
)
 &rst
  ixpk= 937, nxpk= 0, iat= 547,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 605, 606, 607,
 &end
#
#   1115  PRO     HB2       1123  VAL     QG2      4.939   (#peak     939   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 939, nxpk= 0, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr2= 510, 511, 512,
 &end
#
#   1124  MET     HB3       1129  ILE     HB       4.323   (#peak     942   #SUP      0.79  #QF          0.5
)
 &rst
  ixpk= 942, nxpk= 0, iat= 521, 603, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   1112  MET     HG3       1125  ASP     HB2      5.159   (#peak     945   #SUP      0.87  #QF          0.4
)
 &rst
  ixpk= 945, nxpk= 0, iat= 346, 537, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1125  ASP     HB2       1128  ILE     HB       5.478   (#peak     945   #SUP      0.87  #QF          0.4
)
 &rst
  ixpk= 945, nxpk= 0, iat= 537, 584, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1128  ILE     QG2       1128  ILE     QD1      3.014   (#peak     967   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 967, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1= 586, 587, 588,
 igr2= 593, 594, 595,
 &end
#
#   1128  ILE     HB        1128  ILE     QD1      3.685   (#peak     970   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 970, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 593, 594, 595,
 &end
#
#   1129  ILE     HB        1129  ILE     QD1      3.443   (#peak     975   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 975, nxpk= 0, iat= 603,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 612, 613, 614,
 &end
#
#   1129  ILE     QD1       1140  PRO     HD3      3.597   (#peak     976   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 976, nxpk= 0, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 612, 613, 614,
 &end
#
#   1129  ILE     QD1       1140  PRO     HD2      4.224   (#peak     977   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 977, nxpk= 0, iat=  -1, 782, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 612, 613, 614,
 &end
#
#   1129  ILE     QD1       1146  LEU     HG       3.135   (#peak     980   #SUP      0.51  #QF         0.51
)
 &rst
  ixpk= 980, nxpk= 0, iat=  -1, 894, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr1= 612, 613, 614,
 &end
#
#   1129  ILE     QD1       1140  PRO     HG3      4.983   (#peak     981   #SUP      0.88  #QF         0.26
)
 &rst
  ixpk= 981, nxpk= 0, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 612, 613, 614,
 &end
#
#   1166  ARG     QD        1167  GLU     HA        5.5    (#peak     988   #SUP      0.23  #QF         0.23
)
 &rst
  ixpk= 988, nxpk= 0, iat=  -1,1242, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1227,
 &end
#
#   1112  MET     QE        1115  PRO     QG       4.235   (#peak     993   #SUP      0.98  #QF         0.89
)
 &rst
  ixpk= 993, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 349, 350, 351,
 igr2= 385, 386,
 &end
#
#   1115  PRO     QG        1158  LYS     HB2      4.554   (#peak     993   #SUP      0.98  #QF         0.89
)
 &rst
  ixpk= 993, nxpk= 0, iat=  -1,1079, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr1= 385, 386,
 &end
#
#   1130  LEU     HA        1130  LEU     HG       4.246   (#peak     1011  #SUP      0.97  #QF         0.95
)
 &rst
  ixpk= 1011, nxpk= 0, iat= 620, 625, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#   1130  LEU     HG        1131  ARG     HA       4.862   (#peak     1011  #SUP      0.97  #QF         0.95
)
 &rst
  ixpk= 1011, nxpk= 0, iat= 625, 639, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   1151  LEU     HA        1151  LEU     QD2      3.476   (#peak     1017  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1017, nxpk= 0, iat= 965,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 976, 977, 978,
 &end
#
#   1116  VAL     QG1       1153  PRO     HA        3.96   (#peak     1018  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1018, nxpk= 0, iat=  -1,1007, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 401, 402, 403,
 &end
#
#   1116  VAL     QG1       1117  ARG     H        4.466   (#peak     1019  #SUP      0.5   #QF          0.5
)
 &rst
  ixpk= 1019, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 401, 402, 403,
 &end
#
#   1139  ASP     HB2       1144  GLN     QB       4.906   (#peak     1022  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 1022, nxpk= 0, iat= 773,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 857, 858,
 &end
#
#   1139  ASP     HB3       1144  GLN     QB       5.786   (#peak     1023  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1023, nxpk= 0, iat= 774,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2= 857, 858,
 &end
#
#   1139  ASP     HB3       1140  PRO     HA        6.05   (#peak     1024  #SUP      0.99  #QF         0.34
)
 &rst
  ixpk= 1024, nxpk= 0, iat= 774, 791, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1144  GLN     QB        1144  GLN     HG3      2.981   (#peak     1043  #SUP       1
)
 &rst
  ixpk= 1043, nxpk= 0, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
 igr1= 857, 858,
 &end
#
#   1130  LEU     HA        1132  HIS     H        5.214   (#peak     1061  #SUP      0.68  #QF         0.48
)
 &rst
  ixpk= 1061, nxpk= 0, iat= 620, 661, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1107  LEU     HG        1141  PHE     HZ       4.983   (#peak     1070  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1070, nxpk= 0, iat= 264, 807, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#   1157  LEU     H         1157  LEU     HG       4.026   (#peak     1072  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 1072, nxpk= 0, iat=1056,1063, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#   1165  MET     HA        1168  LYS     HG2      4.829   (#peak     1089  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1089, nxpk= 0, iat=1201,1262, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#   1168  LYS     HA        1168  LYS     HG2      4.356   (#peak     1093  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1093, nxpk= 0, iat=1257,1262, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   1130  LEU     HG        1131  ARG     H        4.147   (#peak     1108  #SUP      0.24  #QF         0.24
)
 &rst
  ixpk= 1108, nxpk= 0, iat= 625, 637, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,  &end
#
#   1124  MET     HB2       1125  ASP     H        4.939   (#peak     1113  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1113, nxpk= 0, iat= 520, 533, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#   1165  MET     HA        1165  MET     HG2      4.048   (#peak     1115  #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 1115, nxpk= 0, iat=1201,1206, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   1102  GLU     HA        1102  GLU     QG       3.938   (#peak     1116  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1116, nxpk= 0, iat= 174,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 179, 180,
 &end
#
#   1100  PRO     HA        1102  GLU     H        5.236   (#peak     1117  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1117, nxpk= 0, iat= 156, 172, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   1115  PRO     HD2       1158  LYS     HG3      5.258   (#peak     1120  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1120, nxpk= 0, iat= 382,1083, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   1139  ASP     HA        1146  LEU     HG       5.335   (#peak     1135  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1135, nxpk= 0, iat= 771, 894, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#   1131  ARG     QD        1132  HIS     HA       4.873   (#peak     1137  #SUP      0.27  #QF         0.27
)
 &rst
  ixpk= 1137, nxpk= 0, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 647, 648,
 &end
#
#   1151  LEU     HB2       1152  GLU     H        5.412   (#peak     1139  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1139, nxpk= 0, iat= 967, 982, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#   1162  GLN     HG2       1163  ALA     QB       5.665   (#peak     1148  #SUP      0.56  #QF         0.43
)
 &rst
  ixpk= 1148, nxpk= 0, iat=1155,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2=1169,1170,1171,
 &end
#
#   1162  GLN     HA        1165  MET     QB       4.851   (#peak     1157  #SUP      0.99  #QF         0.38
)
 &rst
  ixpk= 1157, nxpk= 0, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2=1203,1204,
 &end
#
#   1116  VAL     HA        1117  ARG     HB2      5.445   (#peak     1159  #SUP      0.52  #QF         0.52
)
 &rst
  ixpk= 1159, nxpk= 0, iat= 397, 415, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#   1093  GLU     H         1093  GLU     HB2      4.455   (#peak     1162  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 1162, nxpk= 0, iat=  46,  50, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1132  HIS     HB2       1140  PRO     HB3      5.445   (#peak     1163  #SUP      0.96  #QF         0.52
)
 &rst
  ixpk= 1163, nxpk= 0, iat= 665, 789, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#   1119  PRO     HG2       1146  LEU     QD2      4.554   (#peak     1166  #SUP       1
)
 &rst
  ixpk= 1166, nxpk= 0, iat= 458,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr2= 900, 901, 902,
 &end
#
#   1132  HIS     HB3       1133  LEU     HG        6.05   (#peak     1169  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1169, nxpk= 0, iat= 666, 685, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1094  ILE     QG2       1096  TYR     H        5.225   (#peak     1170  #SUP      0.59  #QF         0.59
)
 &rst
  ixpk= 1170, nxpk= 0, iat=  -1,  92, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=  67,  68,  69,
 &end
#
#   1128  ILE     HA        1128  ILE     QD1      4.411   (#peak     1171  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1171, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 593, 594, 595,
 &end
#
#   1158  LYS     HA        1161  ILE     QD1      4.202   (#peak     1172  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1172, nxpk= 0, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1142,1143,1144,
 &end
#
#   1115  PRO     HD3       1161  ILE     QD1      4.532   (#peak     1173  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1173, nxpk= 0, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2=1142,1143,1144,
 &end
#
#   1161  ILE     HA        1161  ILE     QD1       4.51   (#peak     1174  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1174, nxpk= 0, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2=1142,1143,1144,
 &end
#
#   1103  PHE     HB2       1161  ILE     QD1       6.05   (#peak     1175  #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 1175, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2=1142,1143,1144,
 &end
#
#   1112  MET     HG3       1161  ILE     QD1      4.147   (#peak     1176  #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 1176, nxpk= 0, iat= 346,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2=1142,1143,1144,
 &end
#
#   1115  PRO     HB2       1161  ILE     QD1      5.082   (#peak     1177  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 1177, nxpk= 0, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2=1142,1143,1144,
 &end
#
#   1112  MET     QE        1161  ILE     QD1      3.927   (#peak     1178  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1178, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 349, 350, 351,
 igr2=1142,1143,1144,
 &end
#
#   1115  PRO     QG        1161  ILE     QD1       3.63   (#peak     1179  #SUP       1    #QF         0.87
)
 &rst
  ixpk= 1179, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 385, 386,
 igr2=1142,1143,1144,
 &end
#
#   1161  ILE     HB        1161  ILE     QD1      3.971   (#peak     1179  #SUP       1    #QF         0.87
)
 &rst
  ixpk= 1179, nxpk= 0, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1142,1143,1144,
 &end
#
#   1113  THR     QG2       1161  ILE     QD1      5.016   (#peak     1180  #SUP      0.47  #QF         0.47
)
 &rst
  ixpk= 1180, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1= 361, 362, 363,
 igr2=1142,1143,1144,
 &end
#
#   1161  ILE     QG2       1161  ILE     QD1      3.311   (#peak     1181  #SUP      0.98  #QF         0.76
)
 &rst
  ixpk= 1181, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1=1135,1136,1137,
 igr2=1142,1143,1144,
 &end
#
#   1103  PHE     HA        1161  ILE     QD1      4.466   (#peak     1182  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1182, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2=1142,1143,1144,
 &end
#
#   1113  THR     HA        1161  ILE     QD1      4.851   (#peak     1183  #SUP      0.98  #QF         0.89
)
 &rst
  ixpk= 1183, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr2=1142,1143,1144,
 &end
#
#   1129  ILE     QD1       1139  ASP     H        5.797   (#peak     1184  #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 1184, nxpk= 0, iat=  -1, 769, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
 igr1= 612, 613, 614,
 &end
#
#   1129  ILE     H         1129  ILE     QD1      4.851   (#peak     1186  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1186, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr2= 612, 613, 614,
 &end
#
#   1103  PHE     QD        1161  ILE     QD1      4.719   (#peak     1188  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1188, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 195, 203,
 igr2=1142,1143,1144,
 &end
#
#   1103  PHE     QE        1161  ILE     QD1      5.225   (#peak     1189  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 1189, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr1= 197, 201,
 igr2=1142,1143,1144,
 &end
#
#   1160  GLN     H         1161  ILE     QD1      5.874   (#peak     1190  #SUP      0.69  #QF         0.69
)
 &rst
  ixpk= 1190, nxpk= 0, iat=1112,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr2=1142,1143,1144,
 &end
#
#   1161  ILE     H         1161  ILE     QD1      4.191   (#peak     1191  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1191, nxpk= 0, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2=1142,1143,1144,
 &end
#
#   1157  LEU     HA        1160  GLN     HB3      4.675   (#peak     1197  #SUP      0.75  #QF         0.75
)
 &rst
  ixpk= 1197, nxpk= 0, iat=1058,1117, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1115  PRO     HB2       1157  LEU     HB2      5.269   (#peak     1198  #SUP      0.96  #QF         0.54
)
 &rst
  ixpk= 1198, nxpk= 0, iat= 388,1060, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#   1154  VAL     HB        1157  LEU     HB2      5.599   (#peak     1198  #SUP      0.96  #QF         0.54
)
 &rst
  ixpk= 1198, nxpk= 0, iat=1015,1060, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#   1115  PRO     HB2       1157  LEU     HB3      5.137   (#peak     1199  #SUP      0.59  #QF          0.3
)
 &rst
  ixpk= 1199, nxpk= 0, iat= 388,1061, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1099  ALA     QB        1168  LYS     HE2      5.599   (#peak     1201  #SUP      0.51  #QF         0.51
)
 &rst
  ixpk= 1201, nxpk= 0, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 140, 141, 142,
 &end
#
#   1117  ARG     HB2       1117  ARG     QD       4.653   (#peak     1206  #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 1206, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 421, 422,
 &end
#
#   1168  LYS     HA        1168  LYS     HE2      5.764   (#peak     1208  #SUP      0.95  #QF         0.83
)
 &rst
  ixpk= 1208, nxpk= 0, iat=1257,1268, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,  &end
#
#   1103  PHE     QE        1164  TRP     HA       5.379   (#peak     1212  #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 1212, nxpk= 0, iat=  -1,1177, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
 igr1= 197, 201,
 &end
#
#   1090  GLY     H         1091  SER     QB        5.39   (#peak     1214  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1214, nxpk= 0, iat=  18,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=  29,  30,
 &end
#
#   1096  TYR     QD        1165  MET     HA        5.5    (#peak     1224  #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 1224, nxpk= 0, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 100, 109,
 &end
#
#   1104  ARG     HA        1111  LEU     HA       4.818   (#peak     1230  #SUP      0.5   #QF          0.5
)
 &rst
  ixpk= 1230, nxpk= 0, iat= 209, 321, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#   1163  ALA     HA        1166  ARG     QD       5.225   (#peak     1233  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1233, nxpk= 0, iat=1167,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr2=1226,1227,
 &end
#
#   1091  SER     QB        1092  ALA     HA       4.576   (#peak     1235  #SUP      0.45  #QF         0.45
)
 &rst
  ixpk= 1235, nxpk= 0, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1=  29,  30,
 &end
#
#   1099  ALA     HA        1103  PHE     QD       5.434   (#peak     1237  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1237, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2= 195, 203,
 &end
#
#   1099  ALA     HA        1103  PHE     HB3       6.05   (#peak     1238  #SUP      0.97  #QF         0.94
)
 &rst
  ixpk= 1238, nxpk= 0, iat= 138, 192, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1153  PRO     HD2       1155  PRO     HD3       6.05   (#peak     1238  #SUP      0.97  #QF         0.94
)
 &rst
  ixpk= 1238, nxpk= 0, iat= 998,1029, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1099  ALA     HA        1103  PHE     HB2      5.522   (#peak     1239  #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 1239, nxpk= 0, iat= 138, 191, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,  &end
#
#   1099  ALA     HA        1100  PRO     HG2      5.192   (#peak     1240  #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 1240, nxpk= 0, iat= 138, 150, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#   1100  PRO     HD2       1164  TRP     HZ2      5.335   (#peak     1242  #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 1242, nxpk= 0, iat= 147,1188, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#   1099  ALA     H         1100  PRO     HD2      5.566   (#peak     1243  #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 1243, nxpk= 0, iat= 136, 147, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#   1152  GLU     H         1153  PRO     HD2      5.599   (#peak     1245  #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 1245, nxpk= 0, iat= 982, 998, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#   1105  ASP     QB        1110  THR     QG2      5.467   (#peak     1246  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1246, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
 igr1= 235, 236,
 igr2= 311, 312, 313,
 &end
#
#   1105  ASP     QB        1108  MET     HB3      4.983   (#peak     1247  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1247, nxpk= 0, iat=  -1, 281, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1= 235, 236,
 &end
#
#   1105  ASP     QB        1112  MET     H        5.522   (#peak     1248  #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 1248, nxpk= 0, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 235, 236,
 &end
#
#   1112  MET     HB2       1125  ASP     HB2      5.511   (#peak     1249  #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 1249, nxpk= 0, iat= 342, 537, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
#   1118  LEU     HB3       1146  LEU     QD2       5.5    (#peak     1251  #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 1251, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 900, 901, 902,
 &end
#
#   1124  MET     HB3       1126  ARG     H         6.05   (#peak     1253  #SUP      0.58  #QF         0.58
)
 &rst
  ixpk= 1253, nxpk= 0, iat= 521, 545, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1146  LEU     QD2       1150  MET     QG        5.39   (#peak     1273  #SUP      0.73  #QF         0.57
)
 &rst
  ixpk= 1273, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 900, 901, 902,
 igr2= 953, 954,
 &end
#
#   1147  THR     QG2       1150  MET     QG       5.764   (#peak     1273  #SUP      0.73  #QF         0.57
)
 &rst
  ixpk= 1273, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr1= 912, 913, 914,
 igr2= 953, 954,
 &end
#
#   1108  MET     QG        1128  ILE     QG2      5.423   (#peak     1274  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1274, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
 igr1= 283, 284,
 igr2= 586, 587, 588,
 &end
#
#   1108  MET     HB2       1128  ILE     QG2      5.511   (#peak     1276  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1276, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr2= 586, 587, 588,
 &end
#
#   1108  MET     HB2       1110  THR     QG2      4.818   (#peak     1277  #SUP      0.72  #QF         0.72
)
 &rst
  ixpk= 1277, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 311, 312, 313,
 &end
#
#   1156  GLU     H         1158  LYS     HB3       5.72   (#peak     1282  #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 1282, nxpk= 0, iat=1041,1080, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#   1129  ILE     HA        1140  PRO     HB3      5.687   (#peak     1291  #SUP      0.98  #QF         0.78
)
 &rst
  ixpk= 1291, nxpk= 0, iat= 601, 789, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,  &end
#
#   1139  ASP     HA        1140  PRO     HB3       6.05   (#peak     1291  #SUP      0.98  #QF         0.78
)
 &rst
  ixpk= 1291, nxpk= 0, iat= 771, 789, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1165  MET     HA        1168  LYS     HB3      5.192   (#peak     1293  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1293, nxpk= 0, iat=1201,1260, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#   1140  PRO     HB2       1141  PHE     HA       5.291   (#peak     1302  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 1302, nxpk= 0, iat= 788, 797, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#   1131  ARG     H         1131  ARG     QG       4.873   (#peak     1307  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1307, nxpk= 0, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr2= 644, 645,
 &end
#
#   1107  LEU     H         1107  LEU     HG       5.379   (#peak     1309  #SUP      0.55  #QF         0.55
)
 &rst
  ixpk= 1309, nxpk= 0, iat= 257, 264, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#   1118  LEU     HA        1119  PRO     HG2      5.456   (#peak     1310  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1310, nxpk= 0, iat= 437, 458, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#   1140  PRO     HG3       1141  PHE     H        4.521   (#peak     1314  #SUP      0.28  #QF         0.28
)
 &rst
  ixpk= 1314, nxpk= 0, iat= 786, 795, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#   1148  GLU     H         1151  LEU     HG       5.093   (#peak     1316  #SUP      0.36  #QF         0.36
)
 &rst
  ixpk= 1316, nxpk= 0, iat= 920, 970, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#   1107  LEU     H         1107  LEU     QD1       5.06   (#peak     1318  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1318, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr2= 266, 267, 268,
 &end
#
#   1111  LEU     H         1111  LEU     QD2      5.038   (#peak     1320  #SUP      0.55  #QF         0.55
)
 &rst
  ixpk= 1320, nxpk= 0, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 332, 333, 334,
 &end
#
#   1111  LEU     QD2       1164  TRP     HE3      4.807   (#peak     1325  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1325, nxpk= 0, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 332, 333, 334,
 &end
#
#   1103  PHE     HB3       1111  LEU     QD2      3.839   (#peak     1326  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1326, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 332, 333, 334,
 &end
#
#   1148  GLU     HA        1151  LEU     HG       3.828   (#peak     1327  #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 1327, nxpk= 0, iat= 922, 970, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   1156  GLU     QG        1157  LEU     HG       4.202   (#peak     1328  #SUP      0.74  #QF         0.74
)
 &rst
  ixpk= 1328, nxpk= 0, iat=  -1,1063, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1048,1049,
 &end
#
#   1151  LEU     QD2       1152  GLU     H        4.664   (#peak     1332  #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 1332, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 976, 977, 978,
 &end
#
#   1107  LEU     QD1       1141  PHE     HZ       4.642   (#peak     1335  #SUP       1
)
 &rst
  ixpk= 1335, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 266, 267, 268,
 &end
#
#   1165  MET     HA        1168  LYS     HG3      5.434   (#peak     1337  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1337, nxpk= 0, iat=1201,1263, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#   1094  ILE     QG2       1095  ASP     HB3      5.159   (#peak     1348  #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 1348, nxpk= 0, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1169  GLN     QG       5.643   (#peak     1349  #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 1349, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=  67,  68,  69,
 igr2=1284,1285,
 &end
#
#   1094  ILE     QG2       1095  ASP     HB2      5.159   (#peak     1350  #SUP      0.98  #QF         0.87
)
 &rst
  ixpk= 1350, nxpk= 0, iat=  -1,  84, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1168  LYS     HE2      5.511   (#peak     1350  #SUP      0.98  #QF         0.87
)
 &rst
  ixpk= 1350, nxpk= 0, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1169  GLN     HA       5.214   (#peak     1351  #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 1351, nxpk= 0, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1095  ASP     HA       5.258   (#peak     1352  #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 1352, nxpk= 0, iat=  -1,  82, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1096  TYR     HA       5.258   (#peak     1353  #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 1353, nxpk= 0, iat=  -1,  94, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1=  67,  68,  69,
 &end
#
#   1163  ALA     QB        1164  TRP     HB3      5.357   (#peak     1354  #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 1354, nxpk= 0, iat=  -1,1180, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
 igr1=1169,1170,1171,
 &end
#
#   1163  ALA     QB        1164  TRP     HB2      5.115   (#peak     1355  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1355, nxpk= 0, iat=  -1,1179, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1=1169,1170,1171,
 &end
#
#   1162  GLN     HG3       1163  ALA     QB       4.763   (#peak     1356  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1356, nxpk= 0, iat=1156,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2=1169,1170,1171,
 &end
#
#   1163  ALA     QB        1166  ARG     QB       4.653   (#peak     1357  #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 1357, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=1169,1170,1171,
 igr2=1220,1221,
 &end
#
#   1160  GLN     H         1163  ALA     QB       5.335   (#peak     1361  #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 1361, nxpk= 0, iat=1112,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2=1169,1170,1171,
 &end
#
#   1128  ILE     QD1       1129  ILE     H        5.137   (#peak     1363  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 1363, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 593, 594, 595,
 &end
#
#   1127  SER     H         1128  ILE     QD1      6.017   (#peak     1364  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1364, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr2= 593, 594, 595,
 &end
#
#   1105  ASP     H         1128  ILE     QD1       6.05   (#peak     1365  #SUP      0.74  #QF         0.74
)
 &rst
  ixpk= 1365, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 593, 594, 595,
 &end
#
#   1108  MET     H         1128  ILE     QD1      4.774   (#peak     1366  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1366, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 593, 594, 595,
 &end
#
#   1108  MET     HB3       1128  ILE     QD1      4.158   (#peak     1368  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1368, nxpk= 0, iat= 281,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2= 593, 594, 595,
 &end
#
#   1105  ASP     QB        1128  ILE     QD1      3.905   (#peak     1369  #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 1369, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 235, 236,
 igr2= 593, 594, 595,
 &end
#
#   1125  ASP     HB3       1128  ILE     QD1      4.323   (#peak     1370  #SUP      0.84  #QF         0.74
)
 &rst
  ixpk= 1370, nxpk= 0, iat= 538,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 593, 594, 595,
 &end
#
#   1160  GLN     H         1162  GLN     HG2      5.797   (#peak     1382  #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 1382, nxpk= 0, iat=1112,1155, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
#   1112  MET     HG3       1115  PRO     HD3      4.345   (#peak     1390  #SUP       1
)
 &rst
  ixpk= 1390, nxpk= 0, iat= 346, 383, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   1099  ALA     QB        1100  PRO     HD2       3.96   (#peak     1391  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1391, nxpk= 0, iat=  -1, 147, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 140, 141, 142,
 &end
#
#   1118  LEU     H         1123  VAL     HA       4.378   (#peak      2    #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 2, nxpk= 0, iat= 435, 502, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#   1117  ARG     HA        1118  LEU     H        3.201   (#peak      3    #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 3, nxpk= 0, iat= 413, 435, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#   1118  LEU     H         1122  THR     HB        6.05   (#peak      5    #SUP      0.98  #QF         0.97
)
 &rst
  ixpk= 5, nxpk= 0, iat= 435, 490, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1118  LEU     H         1118  LEU     HB3      4.081   (#peak      6    #SUP       1
)
 &rst
  ixpk= 6, nxpk= 0, iat= 435, 440, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#   1117  ARG     HG2       1118  LEU     H        4.675   (#peak      7    #SUP       1
)
 &rst
  ixpk= 7, nxpk= 0, iat= 418, 435, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1118  LEU     H         1118  LEU     HB2      3.542   (#peak      8    #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 8, nxpk= 0, iat= 435, 439, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   1117  ARG     HG3       1118  LEU     H        4.675   (#peak      9    #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 9, nxpk= 0, iat= 419, 435, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1116  VAL     HA        1117  ARG     H        3.212   (#peak      13   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 13, nxpk= 0, iat= 397, 411, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#   1117  ARG     H         1153  PRO     HA       4.664   (#peak      15   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 15, nxpk= 0, iat= 411,1007, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1117  ARG     H         1117  ARG     HB2      3.993   (#peak      17   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 17, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1116  VAL     H         1124  MET     H        4.026   (#peak      19   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 19, nxpk= 0, iat= 395, 516, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#   1115  PRO     HA        1116  VAL     H        3.135   (#peak      21   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 21, nxpk= 0, iat= 391, 395, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   1115  PRO     HB2       1116  VAL     H        4.257   (#peak      23   #SUP       1
)
 &rst
  ixpk= 23, nxpk= 0, iat= 388, 395, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   1116  VAL     H         1116  VAL     HB       4.246   (#peak      24   #SUP       1    #QF         0.65
)
 &rst
  ixpk= 24, nxpk= 0, iat= 395, 399, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#   1124  MET     HA        1125  ASP     H        3.751   (#peak      27   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 27, nxpk= 0, iat= 518, 533, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   1124  MET     HB3       1125  ASP     H        3.498   (#peak      30   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 30, nxpk= 0, iat= 521, 533, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   1125  ASP     H         1128  ILE     QD1      5.511   (#peak      32   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 32, nxpk= 0, iat= 533,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr2= 593, 594, 595,
 &end
#
#   1156  GLU     H         1157  LEU     H        3.718   (#peak      34   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 34, nxpk= 0, iat=1041,1056, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   1155  PRO     HD2       1156  GLU     H        4.114   (#peak      38   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 38, nxpk= 0, iat=1028,1041, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#   1155  PRO     HD3       1156  GLU     H        4.796   (#peak      39   #SUP       1
)
 &rst
  ixpk= 39, nxpk= 0, iat=1029,1041, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1156  GLU     H         1156  GLU     QG       3.751   (#peak      40   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 40, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2=1048,1049,
 &end
#
#   1156  GLU     H         1156  GLU     QB       3.146   (#peak      41   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 41, nxpk= 0, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1045,1046,
 &end
#
#   1107  LEU     HB3       1108  MET     H        4.224   (#peak      48   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 48, nxpk= 0, iat= 262, 276, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1108  MET     H         1128  ILE     QG2      4.829   (#peak      49   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 49, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 586, 587, 588,
 &end
#
#   1107  LEU     QD1       1108  MET     H        5.863   (#peak      51   #SUP       1    #QF         0.97
)
 &rst
  ixpk= 51, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr1= 266, 267, 268,
 &end
#
#   1107  LEU     QD2       1108  MET     H        5.863   (#peak      51   #SUP       1    #QF         0.97
)
 &rst
  ixpk= 51, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr1= 270, 271, 272,
 &end
#
#   1102  GLU     H         1102  GLU     QG       4.455   (#peak      57   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 57, nxpk= 0, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 179, 180,
 &end
#
#   1100  PRO     HB2       1102  GLU     H        4.092   (#peak      59   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 59, nxpk= 0, iat= 153, 172, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1140  PRO     HD3       1141  PHE     H        5.082   (#peak      66   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 66, nxpk= 0, iat= 783, 795, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   1141  PHE     H         1141  PHE     QB       3.729   (#peak      67   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 67, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 799, 800,
 &end
#
#   1140  PRO     HG2       1141  PHE     H        4.642   (#peak      68   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 68, nxpk= 0, iat= 785, 795, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   1140  PRO     HB2       1141  PHE     H        4.697   (#peak      69   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 69, nxpk= 0, iat= 788, 795, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   1140  PRO     HB3       1141  PHE     H        5.082   (#peak      70   #SUP       1    #QF         0.87
)
 &rst
  ixpk= 70, nxpk= 0, iat= 789, 795, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   1147  THR     HA        1148  GLU     H        3.256   (#peak      72   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 72, nxpk= 0, iat= 908, 920, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   1148  GLU     H         1148  GLU     QG        3.96   (#peak      74   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 74, nxpk= 0, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 927, 928,
 &end
#
#   1148  GLU     H         1148  GLU     QB       3.245   (#peak      75   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 75, nxpk= 0, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 924, 925,
 &end
#
#   1147  THR     QG2       1148  GLU     H        4.092   (#peak      76   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 76, nxpk= 0, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 912, 913, 914,
 &end
#
#   1107  LEU     H         1108  MET     H        3.421   (#peak      78   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 78, nxpk= 0, iat= 257, 276, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   1106  PRO     HD2       1107  LEU     H        4.851   (#peak      81   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 81, nxpk= 0, iat= 244, 257, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   1106  PRO     HB3       1107  LEU     H        4.851   (#peak      82   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 82, nxpk= 0, iat= 251, 257, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   1106  PRO     QG        1107  LEU     H        3.806   (#peak      83   #SUP      0.99  #QF         0.66
)
 &rst
  ixpk= 83, nxpk= 0, iat=  -1, 257, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr1= 247, 248,
 &end
#
#   1107  LEU     H         1107  LEU     HB2      4.202   (#peak      83   #SUP      0.99  #QF         0.66
)
 &rst
  ixpk= 83, nxpk= 0, iat= 257, 261, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   1106  PRO     HB2       1107  LEU     H        4.191   (#peak      84   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 84, nxpk= 0, iat= 250, 257, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1107  LEU     H         1107  LEU     HB3      4.202   (#peak      85   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 85, nxpk= 0, iat= 257, 262, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   1107  LEU     H         1107  LEU     QD2       5.06   (#peak      86   #SUP       1
)
 &rst
  ixpk= 86, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr2= 270, 271, 272,
 &end
#
#   1105  ASP     H         1112  MET     H        4.895   (#peak      88   #SUP       1
)
 &rst
  ixpk= 88, nxpk= 0, iat= 231, 338, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1104  ARG     HA        1105  ASP     H        3.366   (#peak      91   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 91, nxpk= 0, iat= 209, 231, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#   1105  ASP     H         1111  LEU     HA        6.05   (#peak      92   #SUP      0.99  #QF         0.55
)
 &rst
  ixpk= 92, nxpk= 0, iat= 231, 321, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1105  ASP     H         1105  ASP     QB       3.366   (#peak      93   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 93, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2= 235, 236,
 &end
#
#   1104  ARG     HB2       1105  ASP     H        4.961   (#peak      95   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 95, nxpk= 0, iat= 211, 231, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   1104  ARG     HB3       1105  ASP     H        4.213   (#peak      96   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 96, nxpk= 0, iat= 212, 231, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#   1104  ARG     QG        1105  ASP     H        4.488   (#peak      97   #SUP       1
)
 &rst
  ixpk= 97, nxpk= 0, iat=  -1, 231, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 214, 215,
 &end
#
#   1123  VAL     HA        1124  MET     H        3.201   (#peak     100   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 100, nxpk= 0, iat= 502, 516, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#   1124  MET     H         1124  MET     HB3      4.389   (#peak     101   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 101, nxpk= 0, iat= 516, 521, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   1124  MET     H         1124  MET     QG       4.884   (#peak     102   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 102, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2= 523, 524,
 &end
#
#   1123  VAL     HB        1124  MET     H        5.104   (#peak     103   #SUP      0.94  #QF         0.88
)
 &rst
  ixpk= 103, nxpk= 0, iat= 504, 516, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   1124  MET     H         1124  MET     QE        5.61   (#peak     103   #SUP      0.94  #QF         0.88
)
 &rst
  ixpk= 103, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 527, 528, 529,
 &end
#
#   1116  VAL     H         1126  ARG     H        4.895   (#peak     106   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 106, nxpk= 0, iat= 395, 545, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1115  PRO     HA        1126  ARG     H        4.411   (#peak     108   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 108, nxpk= 0, iat= 391, 545, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#   1114  ASP     HB2       1126  ARG     H        4.653   (#peak     110   #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 110, nxpk= 0, iat= 373, 545, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1126  ARG     H         1126  ARG     HB2       3.41   (#peak     111   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 111, nxpk= 0, iat= 545, 549, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   1126  ARG     H         1126  ARG     HB3      3.586   (#peak     112   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 112, nxpk= 0, iat= 545, 550, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   1126  ARG     H         1126  ARG     HG2      5.137   (#peak     113   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 113, nxpk= 0, iat= 545, 552, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1126  ARG     H         1129  ILE     QG2      4.653   (#peak     115   #SUP       1
)
 &rst
  ixpk= 115, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr2= 605, 606, 607,
 &end
#
#   1104  ARG     HA        1112  MET     H        4.279   (#peak     118   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 118, nxpk= 0, iat= 209, 338, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#   1111  LEU     HA        1112  MET     H        3.311   (#peak     119   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 119, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#   1112  MET     H         1112  MET     HG2       3.74   (#peak     120   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 120, nxpk= 0, iat= 338, 345, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   1112  MET     H         1112  MET     HG3      4.235   (#peak     121   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 121, nxpk= 0, iat= 338, 346, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#   1112  MET     H         1112  MET     HB3      3.993   (#peak     122   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 122, nxpk= 0, iat= 338, 343, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1111  LEU     QD2       1112  MET     H        3.872   (#peak     125   #SUP      0.96  #QF         0.35
)
 &rst
  ixpk= 125, nxpk= 0, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 332, 333, 334,
 &end
#
#   1112  MET     H         1161  ILE     QD1       4.95   (#peak     126   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 126, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2=1142,1143,1144,
 &end
#
#   1127  SER     H         1128  ILE     H        3.806   (#peak     128   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 128, nxpk= 0, iat= 569, 580, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   1114  ASP     HB2       1127  SER     H        5.412   (#peak     130   #SUP      0.92  #QF         0.68
)
 &rst
  ixpk= 130, nxpk= 0, iat= 373, 569, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#   1126  ARG     HD3       1127  SER     H        5.742   (#peak     130   #SUP      0.92  #QF         0.68
)
 &rst
  ixpk= 130, nxpk= 0, iat= 556, 569, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1125  ASP     HB3       1127  SER     H        4.928   (#peak     131   #SUP      0.69  #QF         0.69
)
 &rst
  ixpk= 131, nxpk= 0, iat= 538, 569, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#   1126  ARG     HB2       1127  SER     H        4.664   (#peak     132   #SUP      0.75  #QF         0.75
)
 &rst
  ixpk= 132, nxpk= 0, iat= 549, 569, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1126  ARG     HB3       1127  SER     H        3.619   (#peak     133   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 133, nxpk= 0, iat= 550, 569, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#   1164  TRP     HB3       1165  MET     H        3.993   (#peak     139   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 139, nxpk= 0, iat=1180,1199, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1165  MET     H         1165  MET     HG3      3.674   (#peak     141   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 141, nxpk= 0, iat=1199,1207, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   1161  ILE     QG2       1165  MET     H        4.719   (#peak     142   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 142, nxpk= 0, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1135,1136,1137,
 &end
#
#   1096  TYR     HA        1098  ASP     H        4.576   (#peak     145   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 145, nxpk= 0, iat=  94, 124, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#   1097  SER     QB        1098  ASP     H        4.499   (#peak     148   #SUP       1
)
 &rst
  ixpk= 148, nxpk= 0, iat=  -1, 124, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 117, 118,
 &end
#
#   1098  ASP     H         1098  ASP     HB2      4.169   (#peak     149   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 149, nxpk= 0, iat= 124, 128, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#   1098  ASP     H         1098  ASP     HB3      4.169   (#peak     150   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 150, nxpk= 0, iat= 124, 129, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#   1137  PRO     HA        1138  THR     H        3.542   (#peak     154   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 154, nxpk= 0, iat= 751, 755, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   1119  PRO     HA        1121  GLY     H        4.719   (#peak     156   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 156, nxpk= 0, iat= 464, 479, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   1120  SER     QB        1121  GLY     H        4.697   (#peak     158   #SUP      0.99  #QF         0.21
)
 &rst
  ixpk= 158, nxpk= 0, iat=  -1, 479, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1= 472, 473,
 &end
#
#   1137  PRO     HB3       1138  THR     H        5.115   (#peak     160   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 160, nxpk= 0, iat= 749, 755, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1118  LEU     HB2       1121  GLY     H        4.719   (#peak     162   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 162, nxpk= 0, iat= 439, 479, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   1095  ASP     HA        1097  SER     H        4.587   (#peak     166   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 166, nxpk= 0, iat=  82, 113, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   1097  SER     H         1097  SER     QB       3.685   (#peak     168   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 168, nxpk= 0, iat= 113,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 117, 118,
 &end
#
#   1108  MET     H         1109  ASP     H        3.674   (#peak     169   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 169, nxpk= 0, iat= 276, 293, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   1107  LEU     H         1109  ASP     H        4.334   (#peak     170   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 170, nxpk= 0, iat= 257, 293, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   1109  ASP     H         1110  THR     H         4.07   (#peak     172   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 172, nxpk= 0, iat= 293, 305, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   1109  ASP     H         1109  ASP     HB2      4.554   (#peak     174   #SUP       1
)
 &rst
  ixpk= 174, nxpk= 0, iat= 293, 297, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1105  ASP     QB        1109  ASP     H        4.367   (#peak     175   #SUP      0.92  #QF         0.79
)
 &rst
  ixpk= 175, nxpk= 0, iat=  -1, 293, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1= 235, 236,
 &end
#
#   1108  MET     HB3       1109  ASP     H        4.664   (#peak     177   #SUP       1
)
 &rst
  ixpk= 177, nxpk= 0, iat= 281, 293, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1104  ARG     HB3       1109  ASP     H        5.907   (#peak     178   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 178, nxpk= 0, iat= 212, 293, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
#   1139  ASP     H         1144  GLN     H        4.389   (#peak     180   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 180, nxpk= 0, iat= 769, 853, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   1138  THR     HA        1139  ASP     H        3.256   (#peak     181   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 181, nxpk= 0, iat= 757, 769, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#   1139  ASP     H         1143  ARG     HA       4.631   (#peak     183   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 183, nxpk= 0, iat= 769, 831, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#   1138  THR     HB        1139  ASP     H        3.707   (#peak     184   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 184, nxpk= 0, iat= 759, 769, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   1139  ASP     H         1139  ASP     HB3       3.74   (#peak     185   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 185, nxpk= 0, iat= 769, 774, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   1139  ASP     H         1139  ASP     HB2      3.641   (#peak     186   #SUP      0.95  #QF         0.94
)
 &rst
  ixpk= 186, nxpk= 0, iat= 769, 773, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   1139  ASP     H         1144  GLN     QB        6.05   (#peak     187   #SUP      0.9   #QF         0.34
)
 &rst
  ixpk= 187, nxpk= 0, iat= 769,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 857, 858,
 &end
#
#   1138  THR     QG2       1139  ASP     H        4.059   (#peak     189   #SUP       1
)
 &rst
  ixpk= 189, nxpk= 0, iat=  -1, 769, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 761, 762, 763,
 &end
#
#   1114  ASP     H         1114  ASP     HB2      4.191   (#peak     190   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 190, nxpk= 0, iat= 369, 373, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1113  THR     QG2       1114  ASP     H        4.862   (#peak     191   #SUP       1
)
 &rst
  ixpk= 191, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 361, 362, 363,
 &end
#
#   1112  MET     HA        1114  ASP     H        4.939   (#peak     192   #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 192, nxpk= 0, iat= 340, 369, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#   1114  ASP     H         1114  ASP     HB3      4.323   (#peak     193   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 193, nxpk= 0, iat= 369, 374, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   1112  MET     HB2       1114  ASP     H         4.95   (#peak     194   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 194, nxpk= 0, iat= 342, 369, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#   1095  ASP     HA        1096  TYR     H        3.135   (#peak     198   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 198, nxpk= 0, iat=  82,  92, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   1126  ARG     HA        1130  LEU     H        4.675   (#peak     199   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 199, nxpk= 0, iat= 547, 618, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1096  TYR     H         1096  TYR     HB3       4.4    (#peak     200   #SUP       1
)
 &rst
  ixpk= 200, nxpk= 0, iat=  92,  97, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   1096  TYR     H         1096  TYR     HB2      3.784   (#peak     201   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 201, nxpk= 0, iat=  92,  96, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   1095  ASP     HB3       1096  TYR     H        5.203   (#peak     203   #SUP       1
)
 &rst
  ixpk= 203, nxpk= 0, iat=  85,  92, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#   1129  ILE     H         1130  LEU     H        3.729   (#peak     205   #SUP       1
)
 &rst
  ixpk= 205, nxpk= 0, iat= 599, 618, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#   1129  ILE     HB        1130  LEU     H         4.62   (#peak     209   #SUP       1
)
 &rst
  ixpk= 209, nxpk= 0, iat= 603, 618, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#   1130  LEU     H         1130  LEU     HB3      3.267   (#peak     210   #SUP      0.91  #QF         0.85
)
 &rst
  ixpk= 210, nxpk= 0, iat= 618, 623, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#   1130  LEU     H         1130  LEU     HB2      3.993   (#peak     211   #SUP       1
)
 &rst
  ixpk= 211, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1129  ILE     QG2       1130  LEU     H        3.476   (#peak     212   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 212, nxpk= 0, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 605, 606, 607,
 &end
#
#   1110  THR     HA        1111  LEU     H        3.223   (#peak     215   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 215, nxpk= 0, iat= 307, 319, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,  &end
#
#   1111  LEU     H         1111  LEU     HB2      3.355   (#peak     217   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 217, nxpk= 0, iat= 319, 323, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   1111  LEU     H         1111  LEU     HB3      3.355   (#peak     218   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 218, nxpk= 0, iat= 319, 324, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   1110  THR     QG2       1111  LEU     H        4.103   (#peak     219   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 219, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr1= 311, 312, 313,
 &end
#
#   1104  ARG     QG        1111  LEU     H        4.444   (#peak     220   #SUP      0.46  #QF         0.46
)
 &rst
  ixpk= 220, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 214, 215,
 &end
#
#   1138  THR     HA        1146  LEU     H        3.773   (#peak     222   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 222, nxpk= 0, iat= 757, 887, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   1145  MET     HA        1146  LEU     H        3.047   (#peak     224   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 224, nxpk= 0, iat= 872, 887, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#   1137  PRO     QG        1146  LEU     H        5.115   (#peak     226   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 226, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 745, 746,
 &end
#
#   1138  THR     QG2       1146  LEU     H        4.631   (#peak     228   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 228, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 761, 762, 763,
 &end
#
#   1122  THR     HA        1123  VAL     H        3.179   (#peak     231   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 231, nxpk= 0, iat= 488, 500, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   1123  VAL     H         1123  VAL     HB        3.41   (#peak     232   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 232, nxpk= 0, iat= 500, 504, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
#   1122  THR     QG2       1123  VAL     H        3.344   (#peak     233   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 233, nxpk= 0, iat=  -1, 500, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 492, 493, 494,
 &end
#
#   1095  ASP     H         1095  ASP     HB2      3.828   (#peak     236   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 236, nxpk= 0, iat=  80,  84, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   1095  ASP     H         1095  ASP     HB3      3.828   (#peak     237   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 237, nxpk= 0, iat=  80,  85, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   1094  ILE     HB        1095  ASP     H        4.653   (#peak     238   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 238, nxpk= 0, iat=  65,  80, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1094  ILE     QG2       1095  ASP     H        3.729   (#peak     239   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 239, nxpk= 0, iat=  -1,  80, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1=  67,  68,  69,
 &end
#
#   1117  ARG     H         1152  GLU     H        3.938   (#peak     240   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 240, nxpk= 0, iat= 411, 982, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1151  LEU     HA        1152  GLU     H        3.135   (#peak     243   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 243, nxpk= 0, iat= 965, 982, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,  &end
#
#   1152  GLU     H         1152  GLU     QG        4.51   (#peak     244   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 244, nxpk= 0, iat= 982,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2= 989, 990,
 &end
#
#   1152  GLU     H         1152  GLU     HB2      4.312   (#peak     245   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 245, nxpk= 0, iat= 982, 986, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   1117  ARG     HB3       1152  GLU     H        4.224   (#peak     246   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 246, nxpk= 0, iat= 416, 982, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1151  LEU     HB3       1152  GLU     H        4.059   (#peak     247   #SUP      0.54  #QF         0.54
)
 &rst
  ixpk= 247, nxpk= 0, iat= 968, 982, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#   1116  VAL     QG1       1152  GLU     H        5.181   (#peak     248   #SUP      0.89  #QF         0.85
)
 &rst
  ixpk= 248, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 401, 402, 403,
 &end
#
#   1098  ASP     H         1099  ALA     H        3.487   (#peak     249   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 249, nxpk= 0, iat= 124, 136, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   1097  SER     HA        1099  ALA     H         4.73   (#peak     252   #SUP       1
)
 &rst
  ixpk= 252, nxpk= 0, iat= 115, 136, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   1098  ASP     HB2       1099  ALA     H         4.84   (#peak     254   #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 254, nxpk= 0, iat= 128, 136, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#   1098  ASP     HB3       1099  ALA     H         4.84   (#peak     255   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 255, nxpk= 0, iat= 129, 136, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#   1099  ALA     H         1099  ALA     QB       3.069   (#peak     256   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 256, nxpk= 0, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
 igr2= 140, 141, 142,
 &end
#
#   1101  ASP     H         1102  GLU     H        3.916   (#peak     257   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 257, nxpk= 0, iat= 160, 172, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   1100  PRO     HA        1101  ASP     H        2.915   (#peak     260   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 260, nxpk= 0, iat= 156, 160, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
#   1101  ASP     H         1101  ASP     HB2      3.806   (#peak     261   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 261, nxpk= 0, iat= 160, 164, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   1101  ASP     H         1101  ASP     HB3      3.806   (#peak     262   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 262, nxpk= 0, iat= 160, 165, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   1100  PRO     HB3       1101  ASP     H        4.213   (#peak     263   #SUP       1
)
 &rst
  ixpk= 263, nxpk= 0, iat= 154, 160, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#   1100  PRO     HB2       1101  ASP     H        4.158   (#peak     264   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 264, nxpk= 0, iat= 153, 160, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1093  GLU     HB2       1094  ILE     H        4.367   (#peak     267   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 267, nxpk= 0, iat=  50,  61, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   1094  ILE     H         1094  ILE     HB       3.377   (#peak     268   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 268, nxpk= 0, iat=  61,  65, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   1094  ILE     H         1094  ILE     HG12     4.191   (#peak     269   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 269, nxpk= 0, iat=  61,  71, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1094  ILE     H         1094  ILE     HG13     4.191   (#peak     270   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 270, nxpk= 0, iat=  61,  72, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#   1094  ILE     H         1094  ILE     QG2       4.29   (#peak     272   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 272, nxpk= 0, iat=  61,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2=  67,  68,  69,
 &end
#
#   1164  TRP     H         1165  MET     H        3.718   (#peak     273   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 273, nxpk= 0, iat=1175,1199, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#   1164  TRP     H         1164  TRP     HB3      3.399   (#peak     276   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 276, nxpk= 0, iat=1175,1180, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   1164  TRP     H         1164  TRP     HB2      3.454   (#peak     277   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 277, nxpk= 0, iat=1175,1179, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#   1161  ILE     HA        1164  TRP     H        4.301   (#peak     278   #SUP       1
)
 &rst
  ixpk= 278, nxpk= 0, iat=1131,1175, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   1160  GLN     HB3       1164  TRP     H        5.896   (#peak     279   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 279, nxpk= 0, iat=1117,1175, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1163  ALA     QB        1164  TRP     H         3.52   (#peak     280   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 280, nxpk= 0, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr1=1169,1170,1171,
 &end
#
#   1128  ILE     H         1129  ILE     H        3.542   (#peak     282   #SUP       1
)
 &rst
  ixpk= 282, nxpk= 0, iat= 580, 599, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#   1125  ASP     HB3       1128  ILE     H        3.938   (#peak     286   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 286, nxpk= 0, iat= 538, 580, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1128  ILE     H         1128  ILE     HB       3.355   (#peak     287   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 287, nxpk= 0, iat= 580, 584, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#   1128  ILE     H         1128  ILE     HG12     4.158   (#peak     288   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 288, nxpk= 0, iat= 580, 590, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1128  ILE     H         1128  ILE     HG13     4.158   (#peak     289   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 289, nxpk= 0, iat= 580, 591, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1128  ILE     H         1128  ILE     QG2      4.191   (#peak     290   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 290, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 586, 587, 588,
 &end
#
#   1157  LEU     H         1158  LYS     H        3.553   (#peak     293   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 293, nxpk= 0, iat=1056,1075, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   1156  GLU     QG        1157  LEU     H        4.092   (#peak     297   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 297, nxpk= 0, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1048,1049,
 &end
#
#   1156  GLU     QB        1157  LEU     H        4.092   (#peak     298   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 298, nxpk= 0, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr1=1045,1046,
 &end
#
#   1093  GLU     H         1093  GLU     QG       4.598   (#peak     303   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 303, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2=  53,  54,
 &end
#
#   1093  GLU     H         1093  GLU     HB3      4.455   (#peak     305   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 305, nxpk= 0, iat=  46,  51, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1160  GLN     H         1161  ILE     H        3.663   (#peak     307   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 307, nxpk= 0, iat=1112,1129, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   1159  GLU     H         1160  GLN     H        3.696   (#peak     308   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 308, nxpk= 0, iat=1097,1112, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   1157  LEU     HA        1160  GLN     H        4.092   (#peak     310   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 310, nxpk= 0, iat=1058,1112, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1160  GLN     H         1160  GLN     HB2      3.399   (#peak     312   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 312, nxpk= 0, iat=1112,1116, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#   1159  GLU     QB        1160  GLN     H        3.575   (#peak     313   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 313, nxpk= 0, iat=  -1,1112, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr1=1101,1102,
 &end
#
#   1160  GLN     H         1161  ILE     HB       5.544   (#peak     314   #SUP       1    #QF         0.95
)
 &rst
  ixpk= 314, nxpk= 0, iat=1112,1133, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,  &end
#
#   1131  ARG     H         1132  HIS     H        3.498   (#peak     318   #SUP       1
)
 &rst
  ixpk= 318, nxpk= 0, iat= 637, 661, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   1129  ILE     HA        1132  HIS     H        4.356   (#peak     319   #SUP       1
)
 &rst
  ixpk= 319, nxpk= 0, iat= 601, 661, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   1132  HIS     H         1132  HIS     HB3      3.586   (#peak     321   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 321, nxpk= 0, iat= 661, 666, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   1132  HIS     H         1132  HIS     HB2      3.487   (#peak     322   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 322, nxpk= 0, iat= 661, 665, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#   1166  ARG     H         1167  GLU     H        3.432   (#peak     325   #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 325, nxpk= 0, iat=1216,1240, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#   1155  PRO     HA        1158  LYS     H        4.026   (#peak     328   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 328, nxpk= 0, iat=1037,1075, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#   1164  TRP     HA        1167  GLU     H        4.554   (#peak     328   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 328, nxpk= 0, iat=1177,1240, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1167  GLU     H         1167  GLU     QB       2.981   (#peak     331   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 331, nxpk= 0, iat=1240,  -1, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
 igr2=1244,1245,
 &end
#
#   1158  LYS     H         1158  LYS     HB2      3.377   (#peak     332   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 332, nxpk= 0, iat=1075,1079, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,  &end
#
#   1126  ARG     HA        1129  ILE     H        4.741   (#peak     338   #SUP      0.87  #QF         0.57
)
 &rst
  ixpk= 338, nxpk= 0, iat= 547, 599, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#   1128  ILE     HB        1129  ILE     H        3.465   (#peak     339   #SUP      0.99  #QF         0.91
)
 &rst
  ixpk= 339, nxpk= 0, iat= 584, 599, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,  &end
#
#   1129  ILE     H         1129  ILE     HB       3.773   (#peak     339   #SUP      0.99  #QF         0.91
)
 &rst
  ixpk= 339, nxpk= 0, iat= 599, 603, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   1129  ILE     H         1129  ILE     QG2      3.245   (#peak     340   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 340, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 605, 606, 607,
 &end
#
#   1116  VAL     HA        1154  VAL     H        3.927   (#peak     342   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 342, nxpk= 0, iat= 397,1011, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#   1153  PRO     HA        1154  VAL     H        3.322   (#peak     343   #SUP       1    #QF         0.73
)
 &rst
  ixpk= 343, nxpk= 0, iat=1007,1011, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,  &end
#
#   1154  VAL     H         1155  PRO     HA        6.05   (#peak     344   #SUP      0.48  #QF         0.48
)
 &rst
  ixpk= 344, nxpk= 0, iat=1011,1037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1154  VAL     H         1155  PRO     HD2      5.258   (#peak     345   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 345, nxpk= 0, iat=1011,1028, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   1154  VAL     H         1155  PRO     HD3      5.181   (#peak     346   #SUP       1
)
 &rst
  ixpk= 346, nxpk= 0, iat=1011,1029, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#   1154  VAL     H         1154  VAL     QG2      4.862   (#peak     350   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 350, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1021,1022,1023,
 &end
#
#   1121  GLY     H         1122  THR     H        3.641   (#peak     351   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 351, nxpk= 0, iat= 479, 486, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   1120  SER     HA        1122  THR     H        5.709   (#peak     354   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 354, nxpk= 0, iat= 470, 486, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
#   1120  SER     QB        1122  THR     H        4.015   (#peak     355   #SUP      0.99  #QF         0.62
)
 &rst
  ixpk= 355, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr1= 472, 473,
 &end
#
#   1122  THR     H         1122  THR     HB       3.663   (#peak     356   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 356, nxpk= 0, iat= 486, 490, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#   1118  LEU     HB3       1122  THR     H        4.895   (#peak     358   #SUP       1
)
 &rst
  ixpk= 358, nxpk= 0, iat= 440, 486, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1118  LEU     HB2       1122  THR     H        4.345   (#peak     359   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 359, nxpk= 0, iat= 439, 486, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   1122  THR     H         1122  THR     QG2      4.433   (#peak     360   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 360, nxpk= 0, iat= 486,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2= 492, 493, 494,
 &end
#
#   1139  ASP     HB3       1144  GLN     H        3.993   (#peak     364   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 364, nxpk= 0, iat= 774, 853, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#   1144  GLN     H         1144  GLN     HG3      3.696   (#peak     365   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 365, nxpk= 0, iat= 853, 861, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   1144  GLN     H         1144  GLN     QB       3.245   (#peak     366   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 366, nxpk= 0, iat= 853,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2= 857, 858,
 &end
#
#   1101  ASP     HA        1104  ARG     H        4.785   (#peak     369   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 369, nxpk= 0, iat= 162, 207, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#   1103  PHE     HB2       1104  ARG     H        4.609   (#peak     371   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 371, nxpk= 0, iat= 191, 207, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#   1104  ARG     H         1104  ARG     HB2      3.531   (#peak     372   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 372, nxpk= 0, iat= 207, 211, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#   1104  ARG     H         1104  ARG     HB3      4.378   (#peak     373   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 373, nxpk= 0, iat= 207, 212, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#   1104  ARG     H         1104  ARG     QG       4.125   (#peak     374   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 374, nxpk= 0, iat= 207,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr2= 214, 215,
 &end
#
#   1102  GLU     HA        1104  ARG     H         4.62   (#peak     375   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 375, nxpk= 0, iat= 174, 207, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#   1165  MET     H         1166  ARG     H        3.751   (#peak     376   #SUP       1
)
 &rst
  ixpk= 376, nxpk= 0, iat=1199,1216, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   1166  ARG     H         1166  ARG     QB       3.256   (#peak     381   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 381, nxpk= 0, iat=1216,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2=1220,1221,
 &end
#
#   1163  ALA     QB        1166  ARG     H        5.379   (#peak     382   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 382, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1=1169,1170,1171,
 &end
#
#   1150  MET     H         1151  LEU     H        3.432   (#peak     384   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 384, nxpk= 0, iat= 946, 963, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
#   1149  SER     QB        1150  MET     H         3.96   (#peak     386   #SUP      0.97  #QF         0.49
)
 &rst
  ixpk= 386, nxpk= 0, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 939, 940,
 &end
#
#   1165  MET     HA        1168  LYS     H        4.257   (#peak     387   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 387, nxpk= 0, iat=1201,1255, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   1150  MET     H         1150  MET     HB2      3.938   (#peak     388   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 388, nxpk= 0, iat= 946, 950, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1168  LYS     H         1168  LYS     HB2      3.267   (#peak     389   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 389, nxpk= 0, iat=1255,1259, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
#   1168  LYS     H         1168  LYS     HG2      3.564   (#peak     391   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 391, nxpk= 0, iat=1255,1262, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#   1168  LYS     H         1168  LYS     HG3       4.29   (#peak     392   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 392, nxpk= 0, iat=1255,1263, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   1150  MET     H         1150  MET     QG       3.542   (#peak     393   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 393, nxpk= 0, iat= 946,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2= 953, 954,
 &end
#
#   1132  HIS     H         1133  LEU     H         3.63   (#peak     396   #SUP       1
)
 &rst
  ixpk= 396, nxpk= 0, iat= 661, 678, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,  &end
#
#   1133  LEU     H         1134  LEU     H        3.751   (#peak     397   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 397, nxpk= 0, iat= 678, 697, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#   1130  LEU     HA        1133  LEU     H        4.015   (#peak     400   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 400, nxpk= 0, iat= 620, 678, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#   1132  HIS     HB3       1133  LEU     H        3.795   (#peak     401   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 401, nxpk= 0, iat= 666, 678, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   1132  HIS     HB2       1133  LEU     H        4.257   (#peak     402   #SUP       1
)
 &rst
  ixpk= 402, nxpk= 0, iat= 665, 678, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   1133  LEU     H         1133  LEU     HB3      4.048   (#peak     404   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 404, nxpk= 0, iat= 678, 683, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   1133  LEU     H         1133  LEU     QD1      4.411   (#peak     405   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 405, nxpk= 0, iat= 678,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 687, 688, 689,
 &end
#
#   1133  LEU     H         1133  LEU     QD2      4.411   (#peak     406   #SUP       1
)
 &rst
  ixpk= 406, nxpk= 0, iat= 678,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 691, 692, 693,
 &end
#
#   1158  LYS     HA        1162  GLN     H        4.906   (#peak     409   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 409, nxpk= 0, iat=1077,1148, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   1162  GLN     H         1162  GLN     HG2      3.674   (#peak     411   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 411, nxpk= 0, iat=1148,1155, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   1162  GLN     H         1162  GLN     HG3       3.96   (#peak     412   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 412, nxpk= 0, iat=1148,1156, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#   1162  GLN     H         1162  GLN     QB       3.377   (#peak     413   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 413, nxpk= 0, iat=1148,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1152,1153,
 &end
#
#   1161  ILE     HB        1162  GLN     H        3.509   (#peak     414   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 414, nxpk= 0, iat=1133,1148, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#   1130  LEU     H         1131  ARG     H        3.707   (#peak     416   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 416, nxpk= 0, iat= 618, 637, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   1128  ILE     HA        1131  ARG     H        4.158   (#peak     420   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 420, nxpk= 0, iat= 582, 637, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1130  LEU     HB2       1131  ARG     H        4.642   (#peak     423   #SUP      0.78  #QF         0.54
)
 &rst
  ixpk= 423, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   1165  MET     HA        1169  GLN     H        5.148   (#peak     434   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 434, nxpk= 0, iat=1201,1277, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#   1169  GLN     H         1169  GLN     HB3      3.773   (#peak     435   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 435, nxpk= 0, iat=1277,1282, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   1168  LYS     HB2       1169  GLN     H        3.817   (#peak     436   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 436, nxpk= 0, iat=1259,1277, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   1150  MET     HA        1151  LEU     H        3.883   (#peak     439   #SUP       1    #QF          0.9
)
 &rst
  ixpk= 439, nxpk= 0, iat= 948, 963, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#   1151  LEU     H         1151  LEU     HG       3.586   (#peak     441   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 441, nxpk= 0, iat= 963, 970, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
#   1141  PHE     H         1142  ASN     H        3.443   (#peak     442   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 442, nxpk= 0, iat= 795, 815, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#   1142  ASN     H         1143  ARG     HA       4.422   (#peak     447   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 447, nxpk= 0, iat= 815, 831, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#   1142  ASN     H         1143  ARG     QD       5.027   (#peak     448   #SUP      0.91  #QF         0.81
)
 &rst
  ixpk= 448, nxpk= 0, iat= 815,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 839, 840,
 &end
#
#   1139  ASP     HB2       1142  ASN     H        5.115   (#peak     450   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 450, nxpk= 0, iat= 773, 815, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1102  GLU     H         1103  PHE     H        3.938   (#peak     451   #SUP       1
)
 &rst
  ixpk= 451, nxpk= 0, iat= 172, 187, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1103  PHE     H         1103  PHE     HB3      4.092   (#peak     455   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 455, nxpk= 0, iat= 187, 192, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1100  PRO     HB2       1103  PHE     H        4.103   (#peak     457   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 457, nxpk= 0, iat= 153, 187, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   1100  PRO     HG3       1103  PHE     H        5.192   (#peak     458   #SUP       1
)
 &rst
  ixpk= 458, nxpk= 0, iat= 151, 187, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#   1169  GLN     HB3       1170  SER     H        4.763   (#peak     459   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 459, nxpk= 0, iat=1282,1294, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#   1135  ASN     H         1136  SER     H        3.179   (#peak     461   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 461, nxpk= 0, iat= 716, 730, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   1136  SER     H         1136  SER     HB2      4.488   (#peak     462   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 462, nxpk= 0, iat= 730, 734, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   1135  ASN     QB        1136  SER     H        3.729   (#peak     463   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 463, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 720, 721,
 &end
#
#   1133  LEU     HA        1135  ASN     H        4.906   (#peak     466   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 466, nxpk= 0, iat= 680, 716, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   1132  HIS     HA        1135  ASN     H        4.928   (#peak     467   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 467, nxpk= 0, iat= 663, 716, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#   1135  ASN     H         1135  ASN     QB       3.509   (#peak     469   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 469, nxpk= 0, iat= 716,  -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
 igr2= 720, 721,
 &end
#
#   1134  LEU     HB3       1135  ASN     H        4.554   (#peak     470   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 470, nxpk= 0, iat= 702, 716, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1141  PHE     H         1143  ARG     H        4.455   (#peak     471   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 471, nxpk= 0, iat= 795, 829, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1142  ASN     H         1143  ARG     H        3.421   (#peak     472   #SUP       1
)
 &rst
  ixpk= 472, nxpk= 0, iat= 815, 829, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   1143  ARG     H         1143  ARG     HA       3.201   (#peak     475   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 475, nxpk= 0, iat= 829, 831, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#   1138  THR     HB        1143  ARG     H        4.807   (#peak     476   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 476, nxpk= 0, iat= 759, 829, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   1139  ASP     HB3       1143  ARG     H        4.213   (#peak     477   #SUP      0.95  #QF         0.88
)
 &rst
  ixpk= 477, nxpk= 0, iat= 774, 829, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#   1143  ARG     H         1143  ARG     QG       4.532   (#peak     480   #SUP       1
)
 &rst
  ixpk= 480, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 836, 837,
 &end
#
#   1148  GLU     H         1149  SER     H        4.543   (#peak     481   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 481, nxpk= 0, iat= 920, 935, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#   1147  THR     HA        1149  SER     H        4.653   (#peak     484   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 484, nxpk= 0, iat= 908, 935, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1147  THR     HB        1149  SER     H         4.4    (#peak     485   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 485, nxpk= 0, iat= 910, 935, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   1149  SER     H         1149  SER     QB       3.916   (#peak     487   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 487, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 939, 940,
 &end
#
#   1148  GLU     QG        1149  SER     H        4.807   (#peak     489   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 489, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 927, 928,
 &end
#
#   1148  GLU     QB        1149  SER     H        4.312   (#peak     490   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 490, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 924, 925,
 &end
#
#   1147  THR     QG2       1149  SER     H        5.071   (#peak     491   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 491, nxpk= 0, iat=  -1, 935, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 912, 913, 914,
 &end
#
#   1146  LEU     HA        1147  THR     H        3.289   (#peak     493   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 493, nxpk= 0, iat= 889, 906, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
#   1147  THR     H         1150  MET     QG       4.411   (#peak     495   #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 495, nxpk= 0, iat= 906,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 953, 954,
 &end
#
#   1146  LEU     QD2       1147  THR     H        3.564   (#peak     497   #SUP      0.97  #QF         0.92
)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 900, 901, 902,
 &end
#
#   1146  LEU     QD1       1147  THR     H        3.784   (#peak     497   #SUP      0.97  #QF         0.92
)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 896, 897, 898,
 &end
#
#   1146  LEU     HG        1147  THR     H        5.511   (#peak     498   #SUP      0.98  #QF         0.96
)
 &rst
  ixpk= 498, nxpk= 0, iat= 894, 906, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
#   1147  THR     H         1151  LEU     HG       5.896   (#peak     498   #SUP      0.98  #QF         0.96
)
 &rst
  ixpk= 498, nxpk= 0, iat= 906, 970, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1120  SER     H         1121  GLY     H        3.905   (#peak     499   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 499, nxpk= 0, iat= 468, 479, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1119  PRO     HD2       1120  SER     H        4.774   (#peak     504   #SUP       1    #QF         0.72
)
 &rst
  ixpk= 504, nxpk= 0, iat= 455, 468, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1118  LEU     HB3       1120  SER     H        3.949   (#peak     505   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 505, nxpk= 0, iat= 440, 468, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#   1119  PRO     HB2       1120  SER     H        4.026   (#peak     506   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 506, nxpk= 0, iat= 461, 468, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#   1118  LEU     HB2       1120  SER     H        4.158   (#peak     507   #SUP       1
)
 &rst
  ixpk= 507, nxpk= 0, iat= 439, 468, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1113  THR     H         1114  ASP     H        3.388   (#peak     509   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 509, nxpk= 0, iat= 355, 369, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#   1112  MET     HA        1113  THR     H        3.905   (#peak     512   #SUP       1
)
 &rst
  ixpk= 512, nxpk= 0, iat= 340, 355, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1112  MET     HG2       1113  THR     H        4.884   (#peak     513   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 513, nxpk= 0, iat= 345, 355, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   1112  MET     HB2       1113  THR     H        4.598   (#peak     514   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 514, nxpk= 0, iat= 342, 355, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   1113  THR     H         1113  THR     QG2      4.246   (#peak     515   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 515, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 361, 362, 363,
 &end
#
#   1105  ASP     H         1110  THR     H        4.422   (#peak     516   #SUP       1
)
 &rst
  ixpk= 516, nxpk= 0, iat= 231, 305, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#   1108  MET     HB3       1110  THR     H        4.378   (#peak     524   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 524, nxpk= 0, iat= 281, 305, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#   1159  GLU     H         1159  GLU     QB       3.069   (#peak     532   #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 532, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,
 igr2=1101,1102,
 &end
#
#   1158  LYS     HG2       1159  GLU     H        5.533   (#peak     533   #SUP       1
)
 &rst
  ixpk= 533, nxpk= 0, iat=1082,1097, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#   1158  LYS     HG3       1159  GLU     H        5.533   (#peak     534   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 534, nxpk= 0, iat=1083,1097, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#   1155  PRO     HA        1159  GLU     H        4.774   (#peak     535   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 535, nxpk= 0, iat=1037,1097, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1158  LYS     HB2       1159  GLU     H        4.169   (#peak     536   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 536, nxpk= 0, iat=1079,1097, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#   1170  SER     HA        1172  ASP     H        4.037   (#peak     538   #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 538, nxpk= 0, iat=1296,1316, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#   1162  GLN     HG2       1163  ALA     H        4.136   (#peak     539   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 539, nxpk= 0, iat=1155,1165, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   1158  LYS     HA        1161  ILE     H        4.301   (#peak     543   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 543, nxpk= 0, iat=1077,1129, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
#   1160  GLN     HB3       1161  ILE     H        4.224   (#peak     545   #SUP      0.97  #QF         0.54
)
 &rst
  ixpk= 545, nxpk= 0, iat=1117,1129, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1162  GLN     QB        1163  ALA     H        4.565   (#peak     545   #SUP      0.97  #QF         0.54
)
 &rst
  ixpk= 545, nxpk= 0, iat=  -1,1165, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1=1152,1153,
 &end
#
#   1161  ILE     H         1161  ILE     HB       3.179   (#peak     546   #SUP      0.98  #QF         0.87
)
 &rst
  ixpk= 546, nxpk= 0, iat=1129,1133, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
#   1161  ILE     H         1161  ILE     HG13     3.421   (#peak     547   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 547, nxpk= 0, iat=1129,1140, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   1161  ILE     H         1161  ILE     HG12     4.136   (#peak     549   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 549, nxpk= 0, iat=1129,1139, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   1170  SER     HA        1171  SER     H        3.707   (#peak     553   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 553, nxpk= 0, iat=1296,1305, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#   1171  SER     H         1171  SER     QB        3.96   (#peak     554   #SUP      0.75  #QF         0.75
)
 &rst
  ixpk= 554, nxpk= 0, iat=1305,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2=1309,1310,
 &end
#
#   1091  SER     HA        1092  ALA     H        3.916   (#peak     559   #SUP       1
)
 &rst
  ixpk= 559, nxpk= 0, iat=  27,  36, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
#   1092  ALA     H         1092  ALA     QB       4.224   (#peak     560   #SUP       1
)
 &rst
  ixpk= 560, nxpk= 0, iat=  36,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=  40,  41,  42,
 &end
#
#   1090  GLY     H         1091  SER     HA        5.06   (#peak     561   #SUP      0.6   #QF          0.6
)
 &rst
  ixpk= 561, nxpk= 0, iat=  18,  27, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1144  GLN     HA        1145  MET     H        3.047   (#peak     564   #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 564, nxpk= 0, iat= 855, 870, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#   1124  MET     H         1125  ASP     H        5.247   (#peak     566   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 566, nxpk= 0, iat= 516, 533, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#   1163  ALA     H         1164  TRP     H        3.762   (#peak     576   #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 576, nxpk= 0, iat=1165,1175, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   1117  ARG     H         1154  VAL     H        5.214   (#peak     579   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 579, nxpk= 0, iat= 411,1011, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1158  LYS     H         1159  GLU     H        3.454   (#peak     581   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 581, nxpk= 0, iat=1075,1097, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,  &end
#
#   1120  SER     H         1122  THR     H        5.016   (#peak     584   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 584, nxpk= 0, iat= 468, 486, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   1108  MET     H         1110  THR     H        5.159   (#peak     585   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 585, nxpk= 0, iat= 276, 305, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1169  GLN     H         1169  GLN     HB2      3.773   (#peak     587   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 587, nxpk= 0, iat=1277,1281, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   1093  GLU     QG        1094  ILE     H        4.862   (#peak     588   #SUP       1
)
 &rst
  ixpk= 588, nxpk= 0, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=  53,  54,
 &end
#
#   1099  ALA     H         1100  PRO     HD3      5.808   (#peak     589   #SUP       1
)
 &rst
  ixpk= 589, nxpk= 0, iat= 136, 148, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
#   1139  ASP     H         1140  PRO     HD3      5.599   (#peak     590   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 590, nxpk= 0, iat= 769, 783, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#   1094  ILE     HG12      1095  ASP     H        5.731   (#peak     591   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 591, nxpk= 0, iat=  71,  80, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#   1094  ILE     HG13      1095  ASP     H        5.731   (#peak     592   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 592, nxpk= 0, iat=  72,  80, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#   1100  PRO     HG2       1101  ASP     H        5.115   (#peak     594   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 594, nxpk= 0, iat= 150, 160, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1161  ILE     QD1       1162  GLN     H        5.159   (#peak     597   #SUP       1
)
 &rst
  ixpk= 597, nxpk= 0, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1142,1143,1144,
 &end
#
#   1138  THR     QG2       1143  ARG     H         5.17   (#peak     600   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 600, nxpk= 0, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1= 761, 762, 763,
 &end
#
#   1119  PRO     HD3       1120  SER     H        4.774   (#peak     602   #SUP       1
)
 &rst
  ixpk= 602, nxpk= 0, iat= 456, 468, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1118  LEU     HA        1120  SER     H        4.796   (#peak     603   #SUP       1
)
 &rst
  ixpk= 603, nxpk= 0, iat= 437, 468, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1095  ASP     H         1096  TYR     H        5.016   (#peak     604   #SUP      0.73  #QF         0.73
)
 &rst
  ixpk= 604, nxpk= 0, iat=  80,  92, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   1102  GLU     H         1104  ARG     H        5.027   (#peak     605   #SUP      0.73  #QF         0.73
)
 &rst
  ixpk= 605, nxpk= 0, iat= 172, 207, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#   1149  SER     H         1150  MET     H        4.257   (#peak     606   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 606, nxpk= 0, iat= 935, 946, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   1111  LEU     H         1112  MET     H        5.093   (#peak     609   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 609, nxpk= 0, iat= 319, 338, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,  &end
#
#   1118  LEU     H         1121  GLY     H        4.862   (#peak     611   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 611, nxpk= 0, iat= 435, 479, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   1118  LEU     H         1122  THR     H        4.972   (#peak     613   #SUP       1
)
 &rst
  ixpk= 613, nxpk= 0, iat= 435, 486, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#   1129  ILE     H         1129  ILE     HG13     5.478   (#peak     622   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 622, nxpk= 0, iat= 599, 610, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1129  ILE     H         1131  ARG     H        4.906   (#peak     624   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 624, nxpk= 0, iat= 599, 637, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   1133  LEU     H         1135  ASN     H        5.214   (#peak     626   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 626, nxpk= 0, iat= 678, 716, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1136  SER     H         1138  THR     H         5.06   (#peak     627   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 627, nxpk= 0, iat= 730, 755, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1137  PRO     HB2       1138  THR     H        5.115   (#peak     628   #SUP       1
)
 &rst
  ixpk= 628, nxpk= 0, iat= 748, 755, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1118  LEU     HB3       1121  GLY     H         5.17   (#peak     629   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 629, nxpk= 0, iat= 440, 479, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#   1138  THR     HB        1144  GLN     H        5.203   (#peak     632   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 632, nxpk= 0, iat= 759, 853, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#   1143  ARG     QG        1144  GLN     H         6.05   (#peak     633   #SUP       1    #QF         0.96
)
 &rst
  ixpk= 633, nxpk= 0, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 836, 837,
 &end
#
#   1138  THR     QG2       1144  GLN     H        5.214   (#peak     634   #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 634, nxpk= 0, iat=  -1, 853, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1= 761, 762, 763,
 &end
#
#   1145  MET     H         1145  MET     HG2      4.675   (#peak     635   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 635, nxpk= 0, iat= 870, 877, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1145  MET     H         1145  MET     HG3      4.675   (#peak     636   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 636, nxpk= 0, iat= 870, 878, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1144  GLN     HG3       1145  MET     H        4.345   (#peak     637   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 637, nxpk= 0, iat= 861, 870, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   1138  THR     QG2       1145  MET     H        5.225   (#peak     638   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 638, nxpk= 0, iat=  -1, 870, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 761, 762, 763,
 &end
#
#   1145  MET     H         1146  LEU     H        4.884   (#peak     639   #SUP      0.73  #QF         0.73
)
 &rst
  ixpk= 639, nxpk= 0, iat= 870, 887, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   1146  LEU     H         1147  THR     H        5.005   (#peak     642   #SUP       1
)
 &rst
  ixpk= 642, nxpk= 0, iat= 887, 906, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#   1147  THR     H         1148  GLU     H        5.291   (#peak     643   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 643, nxpk= 0, iat= 906, 920, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#   1149  SER     H         1151  LEU     H        5.445   (#peak     644   #SUP      0.97  #QF         0.84
)
 &rst
  ixpk= 644, nxpk= 0, iat= 935, 963, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#   1156  GLU     H         1158  LYS     H        5.302   (#peak     645   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 645, nxpk= 0, iat=1041,1075, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   1157  LEU     H         1159  GLU     H        4.895   (#peak     646   #SUP       1
)
 &rst
  ixpk= 646, nxpk= 0, iat=1056,1097, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1158  LYS     H         1161  ILE     H        5.456   (#peak     647   #SUP       1
)
 &rst
  ixpk= 647, nxpk= 0, iat=1075,1129, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#   1165  MET     H         1167  GLU     H        5.082   (#peak     648   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 648, nxpk= 0, iat=1199,1240, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   1103  PHE     HZ        1164  TRP     H        5.896   (#peak     650   #SUP       1
)
 &rst
  ixpk= 650, nxpk= 0, iat= 199,1175, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1129  ILE     H         1132  HIS     H        5.775   (#peak     651   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 651, nxpk= 0, iat= 599, 661, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,  &end
#
#   1138  THR     H         1146  LEU     HB2      5.478   (#peak     652   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 652, nxpk= 0, iat= 755, 891, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1150  MET     HB2       1151  LEU     H        4.697   (#peak     653   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 653, nxpk= 0, iat= 950, 963, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   1125  ASP     H         1125  ASP     HB3      3.817   (#peak     654   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 654, nxpk= 0, iat= 533, 538, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#   1108  MET     H         1108  MET     QG       4.895   (#peak     656   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 656, nxpk= 0, iat= 276,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 283, 284,
 &end
#
#   1144  GLN     H         1144  GLN     HG2       3.74   (#peak     657   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 657, nxpk= 0, iat= 853, 860, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#   1126  ARG     HG2       1127  SER     H        5.632   (#peak     662   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 662, nxpk= 0, iat= 552, 569, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#   1126  ARG     HG3       1127  SER     H        5.632   (#peak     663   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 663, nxpk= 0, iat= 553, 569, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#   1170  SER     H         1170  SER     QB        3.52   (#peak     666   #SUP      0.62  #QF         0.62
)
 &rst
  ixpk= 666, nxpk= 0, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=1298,1299,
 &end
#
#   1112  MET     HB3       1113  THR     H        5.115   (#peak     670   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 670, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1113  THR     H         1161  ILE     QD1      5.731   (#peak     672   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 672, nxpk= 0, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr2=1142,1143,1144,
 &end
#
#   1118  LEU     H         1123  VAL     H        5.995   (#peak     676   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 676, nxpk= 0, iat= 435, 500, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#   1118  LEU     H         1152  GLU     H         6.05   (#peak     677   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 677, nxpk= 0, iat= 435, 982, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1117  ARG     QD        1118  LEU     H        5.775   (#peak     678   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 678, nxpk= 0, iat=  -1, 435, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
 igr1= 421, 422,
 &end
#
#   1118  LEU     H         1119  PRO     HA        6.05   (#peak     679   #SUP      0.82  #QF         0.61
)
 &rst
  ixpk= 679, nxpk= 0, iat= 435, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1118  LEU     H         1151  LEU     HA        6.05   (#peak     679   #SUP      0.82  #QF         0.61
)
 &rst
  ixpk= 679, nxpk= 0, iat= 435, 965, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1126  ARG     H         1129  ILE     H        5.434   (#peak     680   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 680, nxpk= 0, iat= 545, 599, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#   1126  ARG     H         1128  ILE     H        5.709   (#peak     681   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 681, nxpk= 0, iat= 545, 580, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
#   1125  ASP     H         1126  ARG     H        5.819   (#peak     682   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 682, nxpk= 0, iat= 533, 545, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,  &end
#
#   1114  ASP     HA        1126  ARG     H         5.94   (#peak     683   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 683, nxpk= 0, iat= 371, 545, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
#   1114  ASP     HB3       1126  ARG     H        4.565   (#peak     689   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 689, nxpk= 0, iat= 374, 545, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#   1103  PHE     HB3       1112  MET     H        5.731   (#peak     691   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 691, nxpk= 0, iat= 192, 338, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#   1104  ARG     H         1112  MET     H        5.742   (#peak     692   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 692, nxpk= 0, iat= 207, 338, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1117  ARG     HA        1123  VAL     H         6.05   (#peak     695   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 695, nxpk= 0, iat= 413, 500, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1128  ILE     H         1130  LEU     H        4.675   (#peak     701   #SUP      0.3   #QF          0.3
)
 &rst
  ixpk= 701, nxpk= 0, iat= 580, 618, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1097  SER     H         1099  ALA     H        5.973   (#peak     703   #SUP      0.64  #QF         0.64
)
 &rst
  ixpk= 703, nxpk= 0, iat= 113, 136, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#   1096  TYR     QD        1097  SER     H         6.05   (#peak     704   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 704, nxpk= 0, iat=  -1, 113, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 100, 109,
 &end
#
#   1096  TYR     HB3       1097  SER     H        5.368   (#peak     705   #SUP       1
)
 &rst
  ixpk= 705, nxpk= 0, iat=  97, 113, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#   1096  TYR     QD        1098  ASP     H        5.896   (#peak     708   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 708, nxpk= 0, iat=  -1, 124, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 100, 109,
 &end
#
#   1096  TYR     HB3       1098  ASP     H        5.588   (#peak     709   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 709, nxpk= 0, iat=  97, 124, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
#   1096  TYR     HA        1099  ALA     H        4.994   (#peak     710   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 710, nxpk= 0, iat=  94, 136, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   1097  SER     QB        1099  ALA     H        5.544   (#peak     711   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 711, nxpk= 0, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 117, 118,
 &end
#
#   1100  PRO     HG3       1101  ASP     H         6.05   (#peak     713   #SUP       1
)
 &rst
  ixpk= 713, nxpk= 0, iat= 151, 160, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1101  ASP     H         1104  ARG     QD        6.05   (#peak     714   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 714, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 217, 218,
 &end
#
#   1100  PRO     HD2       1102  GLU     H         6.05   (#peak     718   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 718, nxpk= 0, iat= 147, 172, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1100  PRO     HG3       1102  GLU     H        5.313   (#peak     719   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 719, nxpk= 0, iat= 151, 172, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   1102  GLU     H         1104  ARG     HB2       6.05   (#peak     720   #SUP      0.46  #QF         0.46
)
 &rst
  ixpk= 720, nxpk= 0, iat= 172, 211, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1101  ASP     HA        1103  PHE     H        4.972   (#peak     721   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 721, nxpk= 0, iat= 162, 187, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#   1100  PRO     HD2       1103  PHE     H        5.577   (#peak     722   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 722, nxpk= 0, iat= 147, 187, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#   1103  PHE     H         1103  PHE     HB2      3.597   (#peak     723   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 723, nxpk= 0, iat= 187, 191, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#   1103  PHE     H         1104  ARG     HB3       6.05   (#peak     724   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 724, nxpk= 0, iat= 187, 212, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1099  ALA     QB        1103  PHE     H         4.95   (#peak     725   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 725, nxpk= 0, iat=  -1, 187, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 140, 141, 142,
 &end
#
#   1105  ASP     H         1109  ASP     H        5.445   (#peak     726   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 726, nxpk= 0, iat= 231, 293, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#   1104  ARG     H         1105  ASP     H        5.566   (#peak     728   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 728, nxpk= 0, iat= 207, 231, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#   1104  ARG     QD        1105  ASP     H        5.918   (#peak     731   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 731, nxpk= 0, iat=  -1, 231, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr1= 217, 218,
 &end
#
#   1107  LEU     H         1110  THR     H         6.05   (#peak     734   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 734, nxpk= 0, iat= 257, 305, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1105  ASP     HA        1107  LEU     H        5.401   (#peak     735   #SUP      0.74  #QF         0.74
)
 &rst
  ixpk= 735, nxpk= 0, iat= 233, 257, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#   1109  ASP     H         1110  THR     QG2       5.61   (#peak     736   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 736, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 311, 312, 313,
 &end
#
#   1110  THR     H         1111  LEU     H        5.577   (#peak     739   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 739, nxpk= 0, iat= 305, 319, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#   1105  ASP     HA        1110  THR     H         6.05   (#peak     741   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 741, nxpk= 0, iat= 233, 305, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1112  MET     H         1113  THR     H         5.72   (#peak     742   #SUP       1
)
 &rst
  ixpk= 742, nxpk= 0, iat= 338, 355, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#   1110  THR     H         1112  MET     H         6.05   (#peak     744   #SUP      0.53  #QF         0.53
)
 &rst
  ixpk= 744, nxpk= 0, iat= 305, 338, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1112  MET     HG2       1114  ASP     H        5.489   (#peak     747   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 747, nxpk= 0, iat= 345, 369, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#   1112  MET     QE        1114  ASP     H        5.368   (#peak     748   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 748, nxpk= 0, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr1= 349, 350, 351,
 &end
#
#   1114  ASP     H         1115  PRO     QG       5.643   (#peak     749   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 749, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2= 385, 386,
 &end
#
#   1112  MET     HG3       1114  ASP     H        5.346   (#peak     751   #SUP       1
)
 &rst
  ixpk= 751, nxpk= 0, iat= 346, 369, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   1112  MET     HB3       1114  ASP     H        5.412   (#peak     752   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 752, nxpk= 0, iat= 343, 369, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#   1116  VAL     H         1126  ARG     HA       5.808   (#peak     754   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 754, nxpk= 0, iat= 395, 547, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
#   1116  VAL     H         1129  ILE     QG2      5.533   (#peak     757   #SUP       1
)
 &rst
  ixpk= 757, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr2= 605, 606, 607,
 &end
#
#   1117  ARG     H         1118  LEU     H        5.302   (#peak     758   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 758, nxpk= 0, iat= 411, 435, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#   1117  ARG     H         1151  LEU     HA       5.412   (#peak     759   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 759, nxpk= 0, iat= 411, 965, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#   1117  ARG     H         1117  ARG     QD       5.698   (#peak     760   #SUP      0.62  #QF         0.62
)
 &rst
  ixpk= 760, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 421, 422,
 &end
#
#   1117  ARG     H         1152  GLU     QG       5.577   (#peak     761   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 761, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr2= 989, 990,
 &end
#
#   1118  LEU     H         1120  SER     H        5.632   (#peak     766   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 766, nxpk= 0, iat= 435, 468, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#   1120  SER     H         1146  LEU     QD2       5.94   (#peak     767   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 767, nxpk= 0, iat= 468,  -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr2= 900, 901, 902,
 &end
#
#   1136  SER     HA        1138  THR     H        5.544   (#peak     770   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 770, nxpk= 0, iat= 732, 755, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,  &end
#
#   1123  VAL     H         1124  MET     H        5.445   (#peak     772   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 772, nxpk= 0, iat= 500, 516, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#   1124  MET     H         1129  ILE     QG2       6.05   (#peak     775   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 775, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 605, 606, 607,
 &end
#
#   1123  VAL     QG1       1124  MET     H        3.883   (#peak     776   #SUP      0.98  #QF          0.5
)
 &rst
  ixpk= 776, nxpk= 0, iat=  -1, 516, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 506, 507, 508,
 &end
#
#   1125  ASP     H         1129  ILE     H        5.698   (#peak     777   #SUP       1
)
 &rst
  ixpk= 777, nxpk= 0, iat= 533, 599, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#   1125  ASP     H         1128  ILE     H        5.742   (#peak     778   #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 778, nxpk= 0, iat= 533, 580, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1124  MET     QE        1125  ASP     H        5.599   (#peak     779   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 779, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 527, 528, 529,
 &end
#
#   1126  ARG     HD2       1127  SER     H        5.742   (#peak     781   #SUP       1
)
 &rst
  ixpk= 781, nxpk= 0, iat= 555, 569, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1127  SER     H         1129  ILE     QG2      4.961   (#peak     782   #SUP       1
)
 &rst
  ixpk= 782, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr2= 605, 606, 607,
 &end
#
#   1127  SER     H         1127  SER     QB       3.762   (#peak     784   #SUP       1
)
 &rst
  ixpk= 784, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2= 573, 574,
 &end
#
#   1127  SER     H         1129  ILE     H        5.236   (#peak     787   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 787, nxpk= 0, iat= 569, 599, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   1129  ILE     H         1132  HIS     HB2       6.05   (#peak     788   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 788, nxpk= 0, iat= 599, 665, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1125  ASP     HB3       1129  ILE     H        5.049   (#peak     789   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 789, nxpk= 0, iat= 538, 599, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   1124  MET     HB3       1129  ILE     H        4.972   (#peak     790   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 790, nxpk= 0, iat= 521, 599, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#   1131  ARG     H         1131  ARG     QD        5.06   (#peak     791   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 791, nxpk= 0, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 647, 648,
 &end
#
#   1132  HIS     HA        1134  LEU     H        5.357   (#peak     793   #SUP      0.35  #QF         0.35
)
 &rst
  ixpk= 793, nxpk= 0, iat= 663, 697, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#   1129  ILE     QG2       1131  ARG     H        4.972   (#peak     794   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 794, nxpk= 0, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 605, 606, 607,
 &end
#
#   1128  ILE     HA        1132  HIS     H        5.049   (#peak     795   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 795, nxpk= 0, iat= 582, 661, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   1131  ARG     QD        1132  HIS     H        5.258   (#peak     796   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 796, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 647, 648,
 &end
#
#   1131  ARG     QG        1132  HIS     H        4.972   (#peak     799   #SUP       1
)
 &rst
  ixpk= 799, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 644, 645,
 &end
#
#   1132  HIS     H         1140  PRO     HB3       6.05   (#peak     800   #SUP      0.82  #QF          0.4
)
 &rst
  ixpk= 800, nxpk= 0, iat= 661, 789, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1132  HIS     H         1140  PRO     HG3       6.05   (#peak     800   #SUP      0.82  #QF          0.4
)
 &rst
  ixpk= 800, nxpk= 0, iat= 661, 786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1133  LEU     H         1137  PRO     HA        6.05   (#peak     801   #SUP      0.32  #QF         0.32
)
 &rst
  ixpk= 801, nxpk= 0, iat= 678, 751, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1132  HIS     HB2       1134  LEU     H         6.05   (#peak     802   #SUP      0.86  #QF         0.55
)
 &rst
  ixpk= 802, nxpk= 0, iat= 665, 697, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1132  HIS     HB3       1135  ASN     H         6.05   (#peak     804   #SUP      0.99  #QF         0.93
)
 &rst
  ixpk= 804, nxpk= 0, iat= 666, 716, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1136  SER     H         1137  PRO     HA       5.324   (#peak     806   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 806, nxpk= 0, iat= 730, 751, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#   1136  SER     H         1137  PRO     HD2      5.335   (#peak     807   #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 807, nxpk= 0, iat= 730, 742, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#   1138  THR     H         1138  THR     QG2      4.081   (#peak     808   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 808, nxpk= 0, iat= 755,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 761, 762, 763,
 &end
#
#   1139  ASP     HB3       1141  PHE     H        4.642   (#peak     810   #SUP       1    #QF         0.75
)
 &rst
  ixpk= 810, nxpk= 0, iat= 774, 795, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   1140  PRO     HD2       1141  PHE     H        4.983   (#peak     810   #SUP       1    #QF         0.75
)
 &rst
  ixpk= 810, nxpk= 0, iat= 782, 795, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#   1139  ASP     HA        1143  ARG     H        5.665   (#peak     812   #SUP       1    #QF          0.9
)
 &rst
  ixpk= 812, nxpk= 0, iat= 771, 829, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
#   1141  PHE     HA        1143  ARG     H         6.05   (#peak     812   #SUP       1    #QF          0.9
)
 &rst
  ixpk= 812, nxpk= 0, iat= 797, 829, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1139  ASP     H         1143  ARG     H        5.159   (#peak     813   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 813, nxpk= 0, iat= 769, 829, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1143  ARG     H         1143  ARG     QD       4.411   (#peak     814   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 814, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 839, 840,
 &end
#
#   1142  ASN     HA        1144  GLN     H        5.698   (#peak     815   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 815, nxpk= 0, iat= 817, 853, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#   1138  THR     HA        1144  GLN     H        5.566   (#peak     817   #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 817, nxpk= 0, iat= 757, 853, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#   1138  THR     HA        1145  MET     H        6.028   (#peak     818   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 818, nxpk= 0, iat= 757, 870, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,  &end
#
#   1149  SER     H         1151  LEU     QD1       6.05   (#peak     823   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 823, nxpk= 0, iat= 935,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 972, 973, 974,
 &end
#
#   1147  THR     HA        1150  MET     H        5.423   (#peak     824   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 824, nxpk= 0, iat= 908, 946, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#   1149  SER     QB        1151  LEU     H        5.401   (#peak     825   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 825, nxpk= 0, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 939, 940,
 &end
#
#   1150  MET     QG        1151  LEU     H        5.269   (#peak     826   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 826, nxpk= 0, iat=  -1, 963, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr1= 953, 954,
 &end
#
#   1151  LEU     H         1151  LEU     HB2      3.344   (#peak     827   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 827, nxpk= 0, iat= 963, 967, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,  &end
#
#   1151  LEU     H         1152  GLU     H        5.346   (#peak     828   #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 828, nxpk= 0, iat= 963, 982, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   1152  GLU     H         1153  PRO     HD3      5.511   (#peak     829   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 829, nxpk= 0, iat= 982, 999, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
#   1117  ARG     HB2       1154  VAL     H         6.05   (#peak     830   #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 830, nxpk= 0, iat= 415,1011, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1154  VAL     HA        1157  LEU     H        5.346   (#peak     832   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 832, nxpk= 0, iat=1013,1056, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   1157  LEU     H         1157  LEU     HB2      3.641   (#peak     834   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 834, nxpk= 0, iat=1056,1060, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#   1157  LEU     H         1157  LEU     HB3      4.048   (#peak     835   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 835, nxpk= 0, iat=1056,1061, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   1157  LEU     H         1161  ILE     QD1       6.05   (#peak     836   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 836, nxpk= 0, iat=1056,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2=1142,1143,1144,
 &end
#
#   1115  PRO     HD3       1158  LYS     H         6.05   (#peak     838   #SUP       1
)
 &rst
  ixpk= 838, nxpk= 0, iat= 383,1075, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1167  GLU     H         1168  LYS     HG2      5.137   (#peak     840   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 840, nxpk= 0, iat=1240,1262, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1158  LYS     H         1161  ILE     QD1      5.247   (#peak     841   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 841, nxpk= 0, iat=1075,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2=1142,1143,1144,
 &end
#
#   1156  GLU     H         1159  GLU     H        5.874   (#peak     842   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 842, nxpk= 0, iat=1041,1097, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
#   1157  LEU     HA        1159  GLU     H        5.214   (#peak     844   #SUP      0.7   #QF          0.7
)
 &rst
  ixpk= 844, nxpk= 0, iat=1058,1097, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1161  ILE     HG12      1162  GLN     H        5.907   (#peak     850   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 850, nxpk= 0, iat=1139,1148, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
#   1164  TRP     H         1167  GLU     QB        6.05   (#peak     852   #SUP      0.7   #QF          0.7
)
 &rst
  ixpk= 852, nxpk= 0, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2=1244,1245,
 &end
#
#   1161  ILE     QG2       1164  TRP     H        5.412   (#peak     854   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 854, nxpk= 0, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1=1135,1136,1137,
 &end
#
#   1165  MET     H         1165  MET     HG2      3.806   (#peak     855   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 855, nxpk= 0, iat=1199,1206, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#   1165  MET     H         1165  MET     QB       3.531   (#peak     856   #SUP       1
)
 &rst
  ixpk= 856, nxpk= 0, iat=1199,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2=1203,1204,
 &end
#
#   1164  TRP     HB3       1166  ARG     H        5.709   (#peak     857   #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 857, nxpk= 0, iat=1180,1216, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
#   1166  ARG     H         1166  ARG     QD       5.357   (#peak     858   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 858, nxpk= 0, iat=1216,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr2=1226,1227,
 &end
#
#   1165  MET     HG3       1166  ARG     H        5.313   (#peak     859   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 859, nxpk= 0, iat=1207,1216, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#   1094  ILE     QD1       1169  GLN     H        5.082   (#peak     860   #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 860, nxpk= 0, iat=  -1,1277, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1=  74,  75,  76,
 &end
#
#   1168  LYS     HG3       1169  GLN     H        5.753   (#peak     861   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 861, nxpk= 0, iat=1263,1277, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,  &end
#
#   1094  ILE     QG2       1169  GLN     H        5.973   (#peak     862   #SUP       1
)
 &rst
  ixpk= 862, nxpk= 0, iat=  -1,1277, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr1=  67,  68,  69,
 &end
#
#   1116  VAL     H         1124  MET     HB3      5.984   (#peak     872   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 872, nxpk= 0, iat= 395, 521, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
#   1117  ARG     HA        1122  THR     H         6.05   (#peak     873   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 873, nxpk= 0, iat= 413, 486, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1155  PRO     HD3       1158  LYS     H         6.05   (#peak     875   #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 875, nxpk= 0, iat=1029,1075, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1164  TRP     HB3       1167  GLU     H         6.05   (#peak     877   #SUP      0.67  #QF         0.67
)
 &rst
  ixpk= 877, nxpk= 0, iat=1180,1240, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1163  ALA     HA        1166  ARG     H        4.345   (#peak     878   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 878, nxpk= 0, iat=1167,1216, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#   1132  HIS     HB3       1134  LEU     H        5.676   (#peak     880   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 880, nxpk= 0, iat= 666, 697, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
#   1158  LYS     H         1158  LYS     HB3      3.157   (#peak     881   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 881, nxpk= 0, iat=1075,1080, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,  &end
#
#   1134  LEU     H         1136  SER     H        4.829   (#peak     882   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 882, nxpk= 0, iat= 697, 730, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#   1103  PHE     H         1103  PHE     QD       4.367   (#peak      2    #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 2, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 195, 203,
 &end
#
#   1164  TRP     HE3       1165  MET     HA       4.092   (#peak      29   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 29, nxpk= 0, iat=1194,1201, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1096  TYR     QE        1165  MET     HA       4.213   (#peak      30   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 30, nxpk= 0, iat=  -1,1201, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 102, 107,
 &end
#
#   1158  LYS     HA        1160  GLN     H        4.675   (#peak      32   #SUP      0.44  #QF         0.44
)
 &rst
  ixpk= 32, nxpk= 0, iat=1077,1112, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#   1103  PHE     QE        1164  TRP     HB2      3.993   (#peak      33   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 33, nxpk= 0, iat=  -1,1179, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 197, 201,
 &end
#
#   1103  PHE     HB3       1104  ARG     H        4.609   (#peak      41   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 41, nxpk= 0, iat= 192, 207, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#   1104  ARG     H         1104  ARG     QD       4.345   (#peak      54   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 54, nxpk= 0, iat= 207,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 217, 218,
 &end
#
#   1100  PRO     HD2       1103  PHE     QE       4.994   (#peak      57   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 57, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr2= 197, 201,
 &end
#
#   1164  TRP     HE3       1165  MET     HG3      3.938   (#peak      59   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 59, nxpk= 0, iat=1194,1207, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#   1100  PRO     HD2       1103  PHE     QD       4.543   (#peak      61   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 61, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 195, 203,
 &end
#
#   1168  LYS     H         1168  LYS     HE3      5.214   (#peak      83   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 83, nxpk= 0, iat=1255,1269, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1125  ASP     H         1125  ASP     HB2      4.268   (#peak      84   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 84, nxpk= 0, iat= 533, 537, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   1172  ASP     H         1172  ASP     QB       4.158   (#peak      87   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 87, nxpk= 0, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2=1320,1321,
 &end
#
#   1172  ASP     QB        1173  HIS     H        4.631   (#peak      88   #SUP      0.54  #QF         0.54
)
 &rst
  ixpk= 88, nxpk= 0, iat=  -1,1328, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=1320,1321,
 &end
#
#   1105  ASP     QB        1141  PHE     QE       5.203   (#peak      90   #SUP      0.64  #QF         0.64
)
 &rst
  ixpk= 90, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 235, 236,
 igr2= 805, 809,
 &end
#
#   1105  ASP     QB        1108  MET     H        4.675   (#peak      91   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 91, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 235, 236,
 &end
#
#   1105  ASP     QB        1107  LEU     H        4.257   (#peak      92   #SUP      0.98  #QF         0.97
)
 &rst
  ixpk= 92, nxpk= 0, iat=  -1, 257, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 235, 236,
 &end
#
#   1105  ASP     QB        1110  THR     H        4.697   (#peak      94   #SUP       1
)
 &rst
  ixpk= 94, nxpk= 0, iat=  -1, 305, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1= 235, 236,
 &end
#
#   1109  ASP     H         1109  ASP     HB3      4.554   (#peak      98   #SUP       1
)
 &rst
  ixpk= 98, nxpk= 0, iat= 293, 298, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1153  PRO     HB3       1154  VAL     H        5.016   (#peak     101   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 101, nxpk= 0, iat=1005,1011, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   1162  GLN     HG3       1163  ALA     H        4.587   (#peak     103   #SUP       1    #QF         0.53
)
 &rst
  ixpk= 103, nxpk= 0, iat=1156,1165, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#   1160  GLN     H         1162  GLN     HG3      4.895   (#peak     104   #SUP      0.5   #QF          0.5
)
 &rst
  ixpk= 104, nxpk= 0, iat=1112,1156, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1119  PRO     HG2       1120  SER     H        4.488   (#peak     106   #SUP      0.98  #QF         0.97
)
 &rst
  ixpk= 106, nxpk= 0, iat= 458, 468, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   1139  ASP     HB2       1143  ARG     H         4.51   (#peak     112   #SUP      0.22  #QF         0.22
)
 &rst
  ixpk= 112, nxpk= 0, iat= 773, 829, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   1160  GLN     HB2       1161  ILE     H        4.444   (#peak     114   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 114, nxpk= 0, iat=1116,1129, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   1164  TRP     HE3       1165  MET     HG2      4.686   (#peak     115   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 115, nxpk= 0, iat=1194,1206, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   1152  GLU     QG        1154  VAL     H        5.104   (#peak     117   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 117, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 989, 990,
 &end
#
#   1106  PRO     HB3       1141  PHE     HZ       5.907   (#peak     121   #SUP      0.76  #QF         0.38
)
 &rst
  ixpk= 121, nxpk= 0, iat= 251, 807, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
#   1157  LEU     H         1160  GLN     HB2       6.05   (#peak     121   #SUP      0.76  #QF         0.38
)
 &rst
  ixpk= 121, nxpk= 0, iat=1056,1116, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1096  TYR     QE        1165  MET     HG2      4.741   (#peak     122   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 122, nxpk= 0, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 102, 107,
 &end
#
#   1112  MET     HG3       1113  THR     H        5.038   (#peak     128   #SUP      0.96  #QF         0.35
)
 &rst
  ixpk= 128, nxpk= 0, iat= 346, 355, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#   1160  GLN     H         1160  GLN     HB3      4.092   (#peak     129   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 129, nxpk= 0, iat=1112,1117, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1103  PHE     HZ        1160  GLN     HB3      4.224   (#peak     130   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 130, nxpk= 0, iat= 199,1117, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1102  GLU     QG        1103  PHE     QE       4.576   (#peak     131   #SUP      0.99  #QF          0.6
)
 &rst
  ixpk= 131, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 179, 180,
 igr2= 197, 201,
 &end
#
#   1103  PHE     QE        1160  GLN     HB3      5.115   (#peak     131   #SUP      0.99  #QF          0.6
)
 &rst
  ixpk= 131, nxpk= 0, iat=  -1,1117, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 197, 201,
 &end
#
#   1102  GLU     QG        1103  PHE     H        4.609   (#peak     132   #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 132, nxpk= 0, iat=  -1, 187, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1= 179, 180,
 &end
#
#   1128  ILE     HB        1141  PHE     QE       5.159   (#peak     133   #SUP      0.58  #QF         0.58
)
 &rst
  ixpk= 133, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2= 805, 809,
 &end
#
#   1102  GLU     QG        1103  PHE     QD       4.664   (#peak     136   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 136, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 179, 180,
 igr2= 195, 203,
 &end
#
#   1125  ASP     H         1128  ILE     HB       4.642   (#peak     138   #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 138, nxpk= 0, iat= 533, 584, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   1158  LYS     HB3       1159  GLU     H        4.411   (#peak     141   #SUP       1    #QF         0.57
)
 &rst
  ixpk= 141, nxpk= 0, iat=1080,1097, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#   1165  MET     QB        1166  ARG     H        4.356   (#peak     142   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 142, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1=1203,1204,
 &end
#
#   1158  LYS     HB3       1160  GLN     H         5.5    (#peak     144   #SUP      0.97  #QF         0.51
)
 &rst
  ixpk= 144, nxpk= 0, iat=1080,1112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   1164  TRP     HE3       1165  MET     QB       5.753   (#peak     144   #SUP      0.97  #QF         0.51
)
 &rst
  ixpk= 144, nxpk= 0, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2=1203,1204,
 &end
#
#   1106  PRO     QG        1141  PHE     QE       4.312   (#peak     146   #SUP      0.38  #QF         0.38
)
 &rst
  ixpk= 146, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 247, 248,
 igr2= 805, 809,
 &end
#
#   1096  TYR     QD        1165  MET     QB       5.885   (#peak     147   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 147, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 100, 109,
 igr2=1203,1204,
 &end
#
#   1106  PRO     QG        1141  PHE     HZ       4.411   (#peak     148   #SUP      0.79  #QF         0.42
)
 &rst
  ixpk= 148, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 247, 248,
 &end
#
#   1096  TYR     QE        1165  MET     QB       4.719   (#peak     149   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 149, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
 igr1= 102, 107,
 igr2=1203,1204,
 &end
#
#   1150  MET     H         1150  MET     HB3      4.334   (#peak     151   #SUP       1
)
 &rst
  ixpk= 151, nxpk= 0, iat= 946, 951, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   1152  GLU     H         1152  GLU     HB3      4.312   (#peak     153   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 153, nxpk= 0, iat= 982, 987, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#   1154  VAL     H         1154  VAL     HB       4.158   (#peak     154   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 154, nxpk= 0, iat=1011,1015, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1144  GLN     QB        1145  MET     H        3.718   (#peak     156   #SUP      0.91  #QF          0.8
)
 &rst
  ixpk= 156, nxpk= 0, iat=  -1, 870, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr1= 857, 858,
 &end
#
#   1107  LEU     HB2       1141  PHE     HZ       5.115   (#peak     160   #SUP       1    #QF         0.58
)
 &rst
  ixpk= 160, nxpk= 0, iat= 261, 807, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1107  LEU     HB2       1108  MET     H        4.224   (#peak     161   #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 161, nxpk= 0, iat= 261, 276, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1167  GLU     QB        1168  LYS     H        3.872   (#peak     174   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 174, nxpk= 0, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr1=1244,1245,
 &end
#
#   1100  PRO     HD3       1164  TRP     HZ2      4.873   (#peak     179   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 179, nxpk= 0, iat= 148,1188, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#   1102  GLU     HB2       1103  PHE     QE        6.05   (#peak     181   #SUP      0.95  #QF         0.64
)
 &rst
  ixpk= 181, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 197, 201,
 &end
#
#   1102  GLU     HB2       1103  PHE     QD        4.29   (#peak     182   #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 182, nxpk= 0, iat= 176,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 195, 203,
 &end
#
#   1102  GLU     H         1102  GLU     HB3      4.554   (#peak     183   #SUP      0.78  #QF         0.63
)
 &rst
  ixpk= 183, nxpk= 0, iat= 172, 177, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1102  GLU     HB3       1103  PHE     H        5.049   (#peak     188   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 188, nxpk= 0, iat= 177, 187, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#   1108  MET     H         1108  MET     HB3      4.455   (#peak     191   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 191, nxpk= 0, iat= 276, 281, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1166  ARG     QB        1167  GLU     H        4.367   (#peak     194   #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 194, nxpk= 0, iat=  -1,1240, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1=1220,1221,
 &end
#
#   1133  LEU     H         1133  LEU     HB2      4.048   (#peak     197   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 197, nxpk= 0, iat= 678, 682, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   1153  PRO     HB2       1154  VAL     H        4.686   (#peak     198   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 198, nxpk= 0, iat=1004,1011, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   1093  GLU     HB3       1094  ILE     H        4.367   (#peak     200   #SUP      0.62  #QF         0.62
)
 &rst
  ixpk= 200, nxpk= 0, iat=  51,  61, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   1130  LEU     H         1130  LEU     HG       3.872   (#peak     204   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 204, nxpk= 0, iat= 618, 625, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   1106  PRO     HB2       1141  PHE     QE       4.323   (#peak     207   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 207, nxpk= 0, iat= 250,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 805, 809,
 &end
#
#   1100  PRO     HB3       1102  GLU     H        4.664   (#peak     219   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 219, nxpk= 0, iat= 154, 172, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1103  PHE     H         1112  MET     QE       4.741   (#peak     222   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 222, nxpk= 0, iat= 187,  -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr2= 349, 350, 351,
 &end
#
#   1103  PHE     QD        1112  MET     QE       4.323   (#peak     224   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 224, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr1= 195, 203,
 igr2= 349, 350, 351,
 &end
#
#   1134  LEU     HB2       1135  ASN     H        4.554   (#peak     227   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 227, nxpk= 0, iat= 701, 716, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1117  ARG     H         1117  ARG     HB3      3.905   (#peak     229   #SUP      0.96  #QF         0.26
)
 &rst
  ixpk= 229, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1117  ARG     HB3       1118  LEU     H         4.73   (#peak     231   #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 231, nxpk= 0, iat= 416, 435, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
#   1115  PRO     QG        1158  LYS     H        4.444   (#peak     245   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 245, nxpk= 0, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 385, 386,
 &end
#
#   1168  LYS     HB3       1169  GLN     H        4.499   (#peak     246   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 246, nxpk= 0, iat=1260,1277, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   1094  ILE     HB        1096  TYR     QE       4.345   (#peak     249   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 249, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2= 102, 107,
 &end
#
#   1096  TYR     QE        1168  LYS     HB3      4.741   (#peak     249   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 249, nxpk= 0, iat=  -1,1260, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 102, 107,
 &end
#
#   1096  TYR     QE        1168  LYS     HB2      4.631   (#peak     255   #SUP      0.51  #QF         0.51
)
 &rst
  ixpk= 255, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 102, 107,
 &end
#
#   1107  LEU     HB3       1141  PHE     HZ       5.115   (#peak     257   #SUP      0.99  #QF         0.88
)
 &rst
  ixpk= 257, nxpk= 0, iat= 262, 807, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1164  TRP     HZ2       1168  LYS     QD       4.444   (#peak     270   #SUP       1
)
 &rst
  ixpk= 270, nxpk= 0, iat=1188,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2=1265,1266,
 &end
#
#   1139  ASP     H         1146  LEU     QD2      5.786   (#peak     275   #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 275, nxpk= 0, iat= 769,  -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
 igr2= 900, 901, 902,
 &end
#
#   1146  LEU     QD1       1150  MET     H        5.489   (#peak     280   #SUP      0.88  #QF         0.31
)
 &rst
  ixpk= 280, nxpk= 0, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 896, 897, 898,
 &end
#
#   1147  THR     QG2       1150  MET     H        5.511   (#peak     280   #SUP      0.88  #QF         0.31
)
 &rst
  ixpk= 280, nxpk= 0, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 912, 913, 914,
 &end
#
#   1128  ILE     H         1129  ILE     QG2      4.598   (#peak     282   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 282, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 605, 606, 607,
 &end
#
#   1129  ILE     QD1       1133  LEU     H        5.016   (#peak     284   #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 284, nxpk= 0, iat=  -1, 678, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr1= 612, 613, 614,
 &end
#
#   1140  PRO     HG2       1141  PHE     QD       4.488   (#peak     287   #SUP      0.99  #QF         0.31
)
 &rst
  ixpk= 287, nxpk= 0, iat= 785,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2= 803, 811,
 &end
#
#   1099  ALA     QB        1103  PHE     QD       3.806   (#peak     292   #SUP      0.82  #QF         0.71
)
 &rst
  ixpk= 292, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 140, 141, 142,
 igr2= 195, 203,
 &end
#
#   1128  ILE     QG2       1129  ILE     H        4.334   (#peak     296   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 296, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 586, 587, 588,
 &end
#
#   1099  ALA     QB        1164  TRP     HE3      4.532   (#peak     299   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 299, nxpk= 0, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 140, 141, 142,
 &end
#
#   1099  ALA     QB        1164  TRP     HZ2      4.697   (#peak     301   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 301, nxpk= 0, iat=  -1,1188, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 140, 141, 142,
 &end
#
#   1154  VAL     H         1154  VAL     QG1      4.862   (#peak     301   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 301, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1017,1018,1019,
 &end
#
#   1099  ALA     QB        1164  TRP     HH2      4.015   (#peak     302   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 302, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 140, 141, 142,
 &end
#
#   1128  ILE     QG2       1141  PHE     QE        4.62   (#peak     302   #SUP       1    #QF         0.99
)
 &rst
  ixpk= 302, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 586, 587, 588,
 igr2= 805, 809,
 &end
#
#   1096  TYR     QD        1099  ALA     QB       4.257   (#peak     304   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 304, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 100, 109,
 igr2= 140, 141, 142,
 &end
#
#   1151  LEU     H         1151  LEU     HB3      4.422   (#peak     310   #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 310, nxpk= 0, iat= 963, 968, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#   1150  MET     H         1151  LEU     HG       4.246   (#peak     315   #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 315, nxpk= 0, iat= 946, 970, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#   1160  GLN     H         1161  ILE     HG13     5.632   (#peak     316   #SUP      0.89  #QF          0.4
)
 &rst
  ixpk= 316, nxpk= 0, iat=1112,1140, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#   1140  PRO     HB2       1141  PHE     QE       3.729   (#peak     318   #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 318, nxpk= 0, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2= 805, 809,
 &end
#
#   1140  PRO     HB2       1141  PHE     QD       4.565   (#peak     319   #SUP      0.94  #QF         0.62
)
 &rst
  ixpk= 319, nxpk= 0, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 803, 811,
 &end
#
#   1111  LEU     QD2       1164  TRP     HZ3      4.873   (#peak     320   #SUP      0.26  #QF         0.26
)
 &rst
  ixpk= 320, nxpk= 0, iat=  -1,1192, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1= 332, 333, 334,
 &end
#
#   1103  PHE     QE        1161  ILE     HG13     4.532   (#peak     321   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 321, nxpk= 0, iat=  -1,1140, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 197, 201,
 &end
#
#   1103  PHE     QD        1161  ILE     HG13     4.917   (#peak     323   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 323, nxpk= 0, iat=  -1,1140, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1= 195, 203,
 &end
#
#   1116  VAL     H         1123  VAL     QG1      4.873   (#peak     325   #SUP      0.94  #QF          0.9
)
 &rst
  ixpk= 325, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr2= 506, 507, 508,
 &end
#
#   1149  SER     H         1151  LEU     HG       5.654   (#peak     327   #SUP      0.95  #QF         0.33
)
 &rst
  ixpk= 327, nxpk= 0, iat= 935, 970, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,  &end
#
#   1128  ILE     QD1       1141  PHE     QE       5.324   (#peak     334   #SUP      0.63  #QF          0.4
)
 &rst
  ixpk= 334, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
 igr1= 593, 594, 595,
 igr2= 805, 809,
 &end
#
#   1164  TRP     HH2       1168  LYS     HG2       6.05   (#peak     334   #SUP      0.63  #QF          0.4
)
 &rst
  ixpk= 334, nxpk= 0, iat=1190,1262, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1096  TYR     QD        1168  LYS     HG2      4.477   (#peak     335   #SUP      0.42  #QF         0.42
)
 &rst
  ixpk= 335, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 100, 109,
 &end
#
#   1128  ILE     H         1128  ILE     QD1      4.169   (#peak     336   #SUP      0.2   #QF          0.2
)
 &rst
  ixpk= 336, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 593, 594, 595,
 &end
#
#   1103  PHE     QD        1111  LEU     QD2       4.29   (#peak     337   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 337, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 195, 203,
 igr2= 332, 333, 334,
 &end
#
#   1103  PHE     QD        1161  ILE     QG2       4.62   (#peak     337   #SUP      0.99  #QF         0.94
)
 &rst
  ixpk= 337, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 195, 203,
 igr2=1135,1136,1137,
 &end
#
#   1107  LEU     H         1128  ILE     QD1       5.61   (#peak     340   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 340, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr2= 593, 594, 595,
 &end
#
#   1127  SER     H         1130  LEU     QD2      5.203   (#peak     341   #SUP      0.97  #QF         0.41
)
 &rst
  ixpk= 341, nxpk= 0, iat= 569,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr2= 631, 632, 633,
 &end
#
#   1161  ILE     QG2       1162  GLN     H        3.949   (#peak     342   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 342, nxpk= 0, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1=1135,1136,1137,
 &end
#
#   1161  ILE     QG2       1164  TRP     HE3      4.532   (#peak     343   #SUP      0.98  #QF         0.74
)
 &rst
  ixpk= 343, nxpk= 0, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=1135,1136,1137,
 &end
#
#   1104  ARG     QG        1110  THR     H        4.752   (#peak     347   #SUP      0.99  #QF         0.75
)
 &rst
  ixpk= 347, nxpk= 0, iat=  -1, 305, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 214, 215,
 &end
#
#   1103  PHE     QE        1161  ILE     QG2      5.104   (#peak     347   #SUP      0.99  #QF         0.75
)
 &rst
  ixpk= 347, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr1= 197, 201,
 igr2=1135,1136,1137,
 &end
#
#   1151  LEU     H         1151  LEU     QD2      4.169   (#peak     349   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 349, nxpk= 0, iat= 963,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 976, 977, 978,
 &end
#
#   1164  TRP     HE3       1168  LYS     HG2      4.708   (#peak     354   #SUP      0.67  #QF         0.67
)
 &rst
  ixpk= 354, nxpk= 0, iat=1194,1262, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#   1130  LEU     QD1       1131  ARG     H        5.522   (#peak     355   #SUP       1    #QF         0.96
)
 &rst
  ixpk= 355, nxpk= 0, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
 igr1= 627, 628, 629,
 &end
#
#   1130  LEU     QD2       1131  ARG     H         6.05   (#peak     355   #SUP       1    #QF         0.96
)
 &rst
  ixpk= 355, nxpk= 0, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 631, 632, 633,
 &end
#
#   1123  VAL     H         1123  VAL     QG2      4.554   (#peak     363   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 363, nxpk= 0, iat= 500,  -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr2= 510, 511, 512,
 &end
#
#   1111  LEU     H         1111  LEU     HG       4.664   (#peak     366   #SUP      0.55  #QF         0.55
)
 &rst
  ixpk= 366, nxpk= 0, iat= 319, 326, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1094  ILE     H         1094  ILE     QD1      4.708   (#peak     367   #SUP       1
)
 &rst
  ixpk= 367, nxpk= 0, iat=  61,  -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr2=  74,  75,  76,
 &end
#
#   1111  LEU     HG        1164  TRP     HZ3      4.323   (#peak     370   #SUP      0.54  #QF         0.54
)
 &rst
  ixpk= 370, nxpk= 0, iat= 326,1192, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   1133  LEU     QD2       1148  GLU     H         5.39   (#peak     372   #SUP      0.9   #QF         0.84
)
 &rst
  ixpk= 372, nxpk= 0, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 691, 692, 693,
 &end
#
#   1140  PRO     HG3       1141  PHE     QD       5.093   (#peak     377   #SUP      0.93  #QF         0.81
)
 &rst
  ixpk= 377, nxpk= 0, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 803, 811,
 &end
#
#   1107  LEU     QD2       1141  PHE     HZ       4.642   (#peak     378   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 378, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 270, 271, 272,
 &end
#
#   1100  PRO     HG3       1103  PHE     QE       4.851   (#peak     380   #SUP      0.91  #QF         0.84
)
 &rst
  ixpk= 380, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2= 197, 201,
 &end
#
#   1100  PRO     HG3       1103  PHE     QD       4.158   (#peak     381   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 381, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr2= 195, 203,
 &end
#
#   1094  ILE     QG2       1096  TYR     QD       4.565   (#peak     384   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 384, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=  67,  68,  69,
 igr2= 100, 109,
 &end
#
#   1094  ILE     QG2       1096  TYR     QE       4.114   (#peak     385   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 385, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1=  67,  68,  69,
 igr2= 102, 107,
 &end
#
#   1096  TYR     H         1096  TYR     QD       4.367   (#peak     408   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 408, nxpk= 0, iat=  92,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2= 100, 109,
 &end
#
#   1141  PHE     H         1141  PHE     QD       4.125   (#peak     428   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 428, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr2= 803, 811,
 &end
#
#   1164  TRP     HE3       1165  MET     H        4.268   (#peak     431   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 431, nxpk= 0, iat=1194,1199, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   1141  PHE     QE        1141  PHE     HZ       2.673   (#peak     456   #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 456, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,
 igr1= 805, 809,
 &end
#
#   1141  PHE     QD        1141  PHE     HZ       4.345   (#peak     457   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 457, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1= 803, 811,
 &end
#
#   1099  ALA     H         1164  TRP     HH2      4.466   (#peak     459   #SUP      0.97  #QF         0.95
)
 &rst
  ixpk= 459, nxpk= 0, iat= 136,1190, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#   1096  TYR     QD        1164  TRP     HH2      4.147   (#peak     467   #SUP       1
)
 &rst
  ixpk= 467, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 100, 109,
 &end
#
#   1134  LEU     H         1135  ASN     H        3.872   (#peak     473   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 473, nxpk= 0, iat= 697, 716, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   1103  PHE     QD        1164  TRP     HE3      4.477   (#peak     474   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 474, nxpk= 0, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr1= 195, 203,
 &end
#
#   1096  TYR     QD        1164  TRP     HZ3      3.773   (#peak     477   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 477, nxpk= 0, iat=  -1,1192, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 100, 109,
 &end
#
#   1103  PHE     QD        1103  PHE     HZ       4.235   (#peak     479   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 479, nxpk= 0, iat=  -1, 199, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 195, 203,
 &end
#
#   1105  ASP     HA        1106  PRO     QG       4.961   (#peak     495   #SUP      0.9   #QF         0.59
)
 &rst
  ixpk= 495, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 247, 248,
 &end
#
#   1115  PRO     HB2       1116  VAL     HA       5.599   (#peak     495   #SUP      0.9   #QF         0.59
)
 &rst
  ixpk= 495, nxpk= 0, iat= 388, 397, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#   1123  VAL     HA        1123  VAL     QG2      4.048   (#peak     499   #SUP      0.91  #QF         0.61
)
 &rst
  ixpk= 499, nxpk= 0, iat= 502,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 510, 511, 512,
 &end
#
#   1105  ASP     HA        1124  MET     QG        6.05   (#peak     502   #SUP      0.96  #QF         0.53
)
 &rst
  ixpk= 502, nxpk= 0, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 523, 524,
 &end
#
#   1112  MET     HG3       1114  ASP     HA        6.05   (#peak     502   #SUP      0.96  #QF         0.53
)
 &rst
  ixpk= 502, nxpk= 0, iat= 346, 371, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1124  MET     HA        1124  MET     QG        4.62   (#peak     508   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 508, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 523, 524,
 &end
#
#   1106  PRO     QG        1124  MET     HA        6.05   (#peak     509   #SUP      0.64  #QF         0.36
)
 &rst
  ixpk= 509, nxpk= 0, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 247, 248,
 &end
#
#   1124  MET     HA        1128  ILE     HB        6.05   (#peak     509   #SUP      0.64  #QF         0.36
)
 &rst
  ixpk= 509, nxpk= 0, iat= 518, 584, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1117  ARG     HA        1154  VAL     QG2      5.698   (#peak     513   #SUP      0.96  #QF          0.6
)
 &rst
  ixpk= 513, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr2=1021,1022,1023,
 &end
#
#   1146  LEU     HA        1146  LEU     QD2      3.432   (#peak     518   #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 518, nxpk= 0, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 900, 901, 902,
 &end
#
#   1108  MET     HA        1108  MET     QG       4.466   (#peak     526   #SUP      0.59  #QF         0.59
)
 &rst
  ixpk= 526, nxpk= 0, iat= 278,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 283, 284,
 &end
#
#   1103  PHE     HA        1112  MET     QE       3.938   (#peak     527   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 527, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 349, 350, 351,
 &end
#
#   1147  THR     HA        1147  THR     QG2      3.718   (#peak     528   #SUP      0.93  #QF         0.68
)
 &rst
  ixpk= 528, nxpk= 0, iat= 908,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 912, 913, 914,
 &end
#
#   1133  LEU     QD1       1147  THR     HA       4.543   (#peak     529   #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 529, nxpk= 0, iat=  -1, 908, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 687, 688, 689,
 &end
#
#   1133  LEU     QD2       1147  THR     HA       4.543   (#peak     531   #SUP      0.78  #QF         0.78
)
 &rst
  ixpk= 531, nxpk= 0, iat=  -1, 908, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1= 691, 692, 693,
 &end
#
#   1107  LEU     HA        1107  LEU     QD2      3.971   (#peak     534   #SUP      0.97  #QF         0.94
)
 &rst
  ixpk= 534, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 270, 271, 272,
 &end
#
#   1104  ARG     HB3       1109  ASP     HA       4.576   (#peak     541   #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 541, nxpk= 0, iat= 212, 295, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#   1154  VAL     HA        1154  VAL     QG1      3.674   (#peak     542   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 542, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1017,1018,1019,
 &end
#
#   1154  VAL     HA        1154  VAL     QG2      3.674   (#peak     543   #SUP      0.98  #QF         0.22
)
 &rst
  ixpk= 543, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1021,1022,1023,
 &end
#
#   1116  VAL     QG2       1153  PRO     HA        3.96   (#peak     544   #SUP      0.53  #QF         0.53
)
 &rst
  ixpk= 544, nxpk= 0, iat=  -1,1007, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 405, 406, 407,
 &end
#
#   1133  LEU     HA        1133  LEU     HG       4.653   (#peak     548   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 548, nxpk= 0, iat= 680, 685, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1133  LEU     HA        1133  LEU     QD2       4.62   (#peak     552   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 552, nxpk= 0, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 691, 692, 693,
 &end
#
#   1133  LEU     HA        1135  ASN     QB       5.841   (#peak     555   #SUP      0.29  #QF         0.29
)
 &rst
  ixpk= 555, nxpk= 0, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr2= 720, 721,
 &end
#
#   1129  ILE     HA        1129  ILE     QD1      3.377   (#peak     559   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 559, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 612, 613, 614,
 &end
#
#   1117  ARG     HB3       1118  LEU     HA       5.533   (#peak     567   #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 567, nxpk= 0, iat= 416, 437, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#   1118  LEU     HA        1151  LEU     QD2      4.158   (#peak     570   #SUP      0.54  #QF         0.54
)
 &rst
  ixpk= 570, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2= 976, 977, 978,
 &end
#
#   1113  THR     HA        1113  THR     QG2      3.432   (#peak     574   #SUP      0.93  #QF         0.71
)
 &rst
  ixpk= 574, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 361, 362, 363,
 &end
#
#   1104  ARG     QG        1110  THR     HA       4.785   (#peak     575   #SUP      0.92  #QF          0.7
)
 &rst
  ixpk= 575, nxpk= 0, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 214, 215,
 &end
#
#   1113  THR     HA        1161  ILE     QG2      5.038   (#peak     575   #SUP      0.92  #QF          0.7
)
 &rst
  ixpk= 575, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1135,1136,1137,
 &end
#
#   1157  LEU     HA        1160  GLN     HB2      4.488   (#peak     577   #SUP      0.97  #QF         0.48
)
 &rst
  ixpk= 577, nxpk= 0, iat=1058,1116, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   1112  MET     HG3       1113  THR     HA       5.247   (#peak     578   #SUP      0.97  #QF         0.35
)
 &rst
  ixpk= 578, nxpk= 0, iat= 346, 357, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#   1104  ARG     HB3       1110  THR     HA       4.862   (#peak     584   #SUP      0.61  #QF         0.51
)
 &rst
  ixpk= 584, nxpk= 0, iat= 212, 307, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   1157  LEU     HA        1157  LEU     HG       4.136   (#peak     586   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 586, nxpk= 0, iat=1058,1063, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
#   1150  MET     HA        1150  MET     QG       4.235   (#peak     589   #SUP      0.99  #QF         0.79
)
 &rst
  ixpk= 589, nxpk= 0, iat= 948,  -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr2= 953, 954,
 &end
#
#   1116  VAL     HB        1151  LEU     HA       5.797   (#peak     594   #SUP      0.93  #QF         0.49
)
 &rst
  ixpk= 594, nxpk= 0, iat= 399, 965, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
#   1117  ARG     HB3       1151  LEU     HA        6.05   (#peak     594   #SUP      0.93  #QF         0.49
)
 &rst
  ixpk= 594, nxpk= 0, iat= 416, 965, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1138  THR     QG2       1144  GLN     HA       4.829   (#peak     597   #SUP      0.98  #QF         0.38
)
 &rst
  ixpk= 597, nxpk= 0, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 761, 762, 763,
 &end
#
#   1155  PRO     HA        1158  LYS     HB3      4.158   (#peak     600   #SUP      0.6   #QF          0.6
)
 &rst
  ixpk= 600, nxpk= 0, iat=1037,1080, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#   1155  PRO     HA        1158  LYS     HB2      4.433   (#peak     602   #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 602, nxpk= 0, iat=1037,1079, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,  &end
#
#   1144  GLN     HA        1144  GLN     HG2      4.576   (#peak     603   #SUP      0.58  #QF         0.58
)
 &rst
  ixpk= 603, nxpk= 0, iat= 855, 860, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#   1105  ASP     QB        1106  PRO     HD2      4.763   (#peak     606   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 606, nxpk= 0, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 235, 236,
 &end
#
#   1111  LEU     QD2       1112  MET     HA       5.225   (#peak     609   #SUP      0.47  #QF         0.26
)
 &rst
  ixpk= 609, nxpk= 0, iat=  -1, 340, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 332, 333, 334,
 &end
#
#   1111  LEU     QD2       1113  THR     HB       5.467   (#peak     609   #SUP      0.47  #QF         0.26
)
 &rst
  ixpk= 609, nxpk= 0, iat=  -1, 359, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 332, 333, 334,
 &end
#
#   1112  MET     HB2       1125  ASP     HA        5.06   (#peak     614   #SUP       1    #QF         0.98
)
 &rst
  ixpk= 614, nxpk= 0, iat= 342, 535, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1169  GLN     HA        1169  GLN     QG       4.202   (#peak     617   #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 617, nxpk= 0, iat=1279,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1284,1285,
 &end
#
#   1094  ILE     QD1       1169  GLN     HA       4.323   (#peak     621   #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 621, nxpk= 0, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1=  74,  75,  76,
 &end
#
#   1102  GLU     HA        1112  MET     QE       4.884   (#peak     624   #SUP      0.77  #QF         0.77
)
 &rst
  ixpk= 624, nxpk= 0, iat= 174,  -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr2= 349, 350, 351,
 &end
#
#   1129  ILE     QG2       1130  LEU     HA       4.378   (#peak     635   #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 635, nxpk= 0, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 605, 606, 607,
 &end
#
#   1099  ALA     QB        1100  PRO     HA       5.764   (#peak     636   #SUP      0.99  #QF         0.95
)
 &rst
  ixpk= 636, nxpk= 0, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 140, 141, 142,
 &end
#
#   1130  LEU     HA        1133  LEU     QD1       6.05   (#peak     636   #SUP      0.99  #QF         0.95
)
 &rst
  ixpk= 636, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 687, 688, 689,
 &end
#
#   1104  ARG     QG        1111  LEU     HA       3.971   (#peak     637   #SUP      0.99  #QF         0.67
)
 &rst
  ixpk= 637, nxpk= 0, iat=  -1, 321, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 214, 215,
 &end
#
#   1130  LEU     HA        1133  LEU     HB3      4.774   (#peak     639   #SUP      0.96  #QF         0.94
)
 &rst
  ixpk= 639, nxpk= 0, iat= 620, 683, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1130  LEU     HA        1133  LEU     QD2       6.05   (#peak     643   #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 643, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 691, 692, 693,
 &end
#
#   1159  GLU     HA        1162  GLN     HG3      4.686   (#peak     644   #SUP      0.3   #QF          0.3
)
 &rst
  ixpk= 644, nxpk= 0, iat=1099,1156, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
#   1126  ARG     HB3       1127  SER     HA       5.401   (#peak     656   #SUP      0.55  #QF         0.22
)
 &rst
  ixpk= 656, nxpk= 0, iat= 550, 571, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#   1127  SER     HA        1130  LEU     HG       5.577   (#peak     656   #SUP      0.55  #QF         0.22
)
 &rst
  ixpk= 656, nxpk= 0, iat= 571, 625, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#   1127  SER     HA        1130  LEU     HB3      4.367   (#peak     657   #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 657, nxpk= 0, iat= 571, 623, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#   1127  SER     HA        1130  LEU     QD2      3.927   (#peak     659   #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 659, nxpk= 0, iat= 571,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 631, 632, 633,
 &end
#
#   1118  LEU     HB3       1119  PRO     HD2       4.51   (#peak     662   #SUP      0.97  #QF         0.94
)
 &rst
  ixpk= 662, nxpk= 0, iat= 440, 455, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   1161  ILE     HB        1162  GLN     HA       4.917   (#peak     666   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 666, nxpk= 0, iat=1133,1150, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#   1101  ASP     HA        1104  ARG     HB3      5.896   (#peak     667   #SUP      0.74  #QF         0.26
)
 &rst
  ixpk= 667, nxpk= 0, iat= 162, 212, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1101  ASP     HA        1104  ARG     HB2      4.719   (#peak     671   #SUP      0.22  #QF         0.22
)
 &rst
  ixpk= 671, nxpk= 0, iat= 162, 211, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#   1118  LEU     HB2       1120  SER     QB       5.335   (#peak     672   #SUP      0.94  #QF         0.88
)
 &rst
  ixpk= 672, nxpk= 0, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 472, 473,
 &end
#
#   1119  PRO     HD2       1146  LEU     QD2      3.861   (#peak     674   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 674, nxpk= 0, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 900, 901, 902,
 &end
#
#   1154  VAL     QG1       1155  PRO     HD2      5.148   (#peak     675   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 675, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1017,1018,1019,
 &end
#
#   1154  VAL     QG2       1155  PRO     HD2      5.148   (#peak     676   #SUP      0.72  #QF         0.53
)
 &rst
  ixpk= 676, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1021,1022,1023,
 &end
#
#   1138  THR     QG2       1143  ARG     HA       4.312   (#peak     677   #SUP      0.98  #QF         0.91
)
 &rst
  ixpk= 677, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 761, 762, 763,
 &end
#
#   1122  THR     HA        1123  VAL     HB       5.181   (#peak     683   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 683, nxpk= 0, iat= 488, 504, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#   1122  THR     HA        1122  THR     QG2      3.476   (#peak     684   #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 684, nxpk= 0, iat= 488,  -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
 igr2= 492, 493, 494,
 &end
#
#   1127  SER     QB        1130  LEU     QD2      4.939   (#peak     700   #SUP      0.49  #QF         0.49
)
 &rst
  ixpk= 700, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 573, 574,
 igr2= 631, 632, 633,
 &end
#
#   1128  ILE     HA        1128  ILE     HG12      4.4    (#peak     701   #SUP      0.98  #QF         0.97
)
 &rst
  ixpk= 701, nxpk= 0, iat= 582, 590, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   1128  ILE     HA        1128  ILE     HG13      4.4    (#peak     702   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 702, nxpk= 0, iat= 582, 591, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   1161  ILE     QG2       1164  TRP     HB3      5.148   (#peak     703   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 703, nxpk= 0, iat=  -1,1180, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1135,1136,1137,
 &end
#
#   1138  THR     HB        1143  ARG     QG       5.335   (#peak     706   #SUP       1    #QF         0.98
)
 &rst
  ixpk= 706, nxpk= 0, iat= 759,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2= 836, 837,
 &end
#
#   1126  ARG     HA        1126  ARG     HG3      4.653   (#peak     707   #SUP       1
)
 &rst
  ixpk= 707, nxpk= 0, iat= 547, 553, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1148  GLU     HA        1151  LEU     QD1      3.905   (#peak     709   #SUP      0.96  #QF         0.92
)
 &rst
  ixpk= 709, nxpk= 0, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr2= 972, 973, 974,
 &end
#
#   1148  GLU     HA        1151  LEU     HB3       6.05   (#peak     718   #SUP      0.99  #QF         0.92
)
 &rst
  ixpk= 718, nxpk= 0, iat= 922, 968, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1096  TYR     HB3       1111  LEU     HG       4.532   (#peak     722   #SUP      0.6   #QF          0.6
)
 &rst
  ixpk= 722, nxpk= 0, iat=  97, 326, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#   1119  PRO     HD3       1146  LEU     QD2      3.861   (#peak     723   #SUP      0.5   #QF          0.5
)
 &rst
  ixpk= 723, nxpk= 0, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 900, 901, 902,
 &end
#
#   1118  LEU     HB3       1119  PRO     HD3       4.51   (#peak     725   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 725, nxpk= 0, iat= 440, 456, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#   1112  MET     HG3       1115  PRO     HD2       4.95   (#peak     726   #SUP       1
)
 &rst
  ixpk= 726, nxpk= 0, iat= 346, 382, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#   1115  PRO     HD2       1158  LYS     HB2      4.488   (#peak     729   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 729, nxpk= 0, iat= 382,1079, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   1115  PRO     HD2       1158  LYS     HG2      5.258   (#peak     732   #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 732, nxpk= 0, iat= 382,1082, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   1158  LYS     HA        1161  ILE     QG2      5.159   (#peak     747   #SUP      0.82  #QF         0.82
)
 &rst
  ixpk= 747, nxpk= 0, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr2=1135,1136,1137,
 &end
#
#   1153  PRO     HB2       1155  PRO     HD3      5.115   (#peak     756   #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 756, nxpk= 0, iat=1004,1029, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1099  ALA     QB        1103  PHE     HB3      4.653   (#peak     757   #SUP      0.94  #QF          0.9
)
 &rst
  ixpk= 757, nxpk= 0, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1= 140, 141, 142,
 &end
#
#   1103  PHE     HB3       1104  ARG     QG       4.576   (#peak     761   #SUP      0.99  #QF         0.45
)
 &rst
  ixpk= 761, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 214, 215,
 &end
#
#   1126  ARG     HD2       1130  LEU     QD2      4.367   (#peak     763   #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 763, nxpk= 0, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 631, 632, 633,
 &end
#
#   1112  MET     HB2       1115  PRO     HD3      4.664   (#peak     785   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 785, nxpk= 0, iat= 342, 383, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1126  ARG     HD3       1130  LEU     QD2      4.367   (#peak     795   #SUP      0.72  #QF         0.72
)
 &rst
  ixpk= 795, nxpk= 0, iat= 556,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 631, 632, 633,
 &end
#
#   1100  PRO     HD2       1102  GLU     QG       4.939   (#peak     802   #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 802, nxpk= 0, iat= 147,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 179, 180,
 &end
#
#   1161  ILE     QG2       1165  MET     HG3      4.081   (#peak     805   #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 805, nxpk= 0, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1=1135,1136,1137,
 &end
#
#   1114  ASP     HA        1115  PRO     HD3      3.982   (#peak     813   #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 813, nxpk= 0, iat= 371, 383, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#   1154  VAL     HA        1155  PRO     HD3      3.905   (#peak     818   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 818, nxpk= 0, iat=1013,1029, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1139  ASP     HA        1140  PRO     HD2      3.872   (#peak     822   #SUP      0.98  #QF         0.79
)
 &rst
  ixpk= 822, nxpk= 0, iat= 771, 782, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
#   1099  ALA     HA        1100  PRO     HD2      3.696   (#peak     829   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 829, nxpk= 0, iat= 138, 147, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#   1161  ILE     HA        1164  TRP     HB3       4.4    (#peak     830   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 830, nxpk= 0, iat=1131,1180, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#   1165  MET     HA        1165  MET     HG3      4.334   (#peak     833   #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 833, nxpk= 0, iat=1201,1207, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   1161  ILE     HA        1164  TRP     HB2      4.554   (#peak     834   #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 834, nxpk= 0, iat=1131,1179, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#   1139  ASP     HA        1140  PRO     HD3      3.828   (#peak     838   #SUP      0.99  #QF         0.87
)
 &rst
  ixpk= 838, nxpk= 0, iat= 771, 783, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   1161  ILE     QG2       1161  ILE     HG12     4.147   (#peak     846   #SUP      0.82  #QF         0.34
)
 &rst
  ixpk= 846, nxpk= 0, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1135,1136,1137,
 &end
#
#   1124  MET     HB2       1124  MET     QE       3.674   (#peak     889   #SUP      0.91  #QF         0.38
)
 &rst
  ixpk= 889, nxpk= 0, iat= 520,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 527, 528, 529,
 &end
#
#   1099  ALA     QB        1100  PRO     HG3      5.181   (#peak     914   #SUP      0.65  #QF         0.52
)
 &rst
  ixpk= 914, nxpk= 0, iat=  -1, 151, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 140, 141, 142,
 &end
#
#   1161  ILE     QG2       1162  GLN     HA        3.74   (#peak     946   #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 946, nxpk= 0, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1135,1136,1137,
 &end
#
#   1130  LEU     QD1       1131  ARG     HA       4.312   (#peak     947   #SUP       1    #QF          0.9
)
 &rst
  ixpk= 947, nxpk= 0, iat=  -1, 639, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr1= 627, 628, 629,
 &end
#
#   1161  ILE     HA        1161  ILE     QG2      3.696   (#peak     948   #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 948, nxpk= 0, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2=1135,1136,1137,
 &end
#
#   1124  MET     QG        1140  PRO     HG2      3.993   (#peak     950   #SUP      0.2   #QF          0.2
)
 &rst
  ixpk= 950, nxpk= 0, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 523, 524,
 &end
#
#   1105  ASP     QB        1108  MET     HB2      3.641   (#peak     974   #SUP      0.7   #QF          0.7
)
 &rst
  ixpk= 974, nxpk= 0, iat=  -1, 280, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
 igr1= 235, 236,
 &end
#
#   1096  TYR     HA        1164  TRP     HH2      4.268   (#peak     1011  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 1011, nxpk= 0, iat=  94,1190, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   1096  TYR     HA        1096  TYR     QD       3.707   (#peak     1012  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 1012, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 100, 109,
 &end
#
#   1117  ARG     HA        1124  MET     H        5.016   (#peak     1016  #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 1016, nxpk= 0, iat= 413, 516, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   1103  PHE     HA        1103  PHE     QD       3.707   (#peak     1024  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1024, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 195, 203,
 &end
#
#   1107  LEU     HA        1141  PHE     HZ       4.334   (#peak     1026  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1026, nxpk= 0, iat= 259, 807, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,  &end
#
#   1133  LEU     HA        1136  SER     H        4.664   (#peak     1035  #SUP       1    #QF         0.81
)
 &rst
  ixpk= 1035, nxpk= 0, iat= 680, 730, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1095  ASP     HA        1096  TYR     QD       5.324   (#peak     1039  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1039, nxpk= 0, iat=  82,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 100, 109,
 &end
#
#   1147  THR     HB        1148  GLU     H        4.224   (#peak     1044  #SUP      0.94  #QF         0.78
)
 &rst
  ixpk= 1044, nxpk= 0, iat= 910, 920, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1141  PHE     HA        1141  PHE     QD       3.751   (#peak     1046  #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 1046, nxpk= 0, iat= 797,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2= 803, 811,
 &end
#
#   1110  THR     HB        1111  LEU     H        4.202   (#peak     1073  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1073, nxpk= 0, iat= 309, 319, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   1160  GLN     HA        1164  TRP     H        5.423   (#peak     1082  #SUP      0.99  #QF          0.7
)
 &rst
  ixpk= 1082, nxpk= 0, iat=1114,1175, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#   1111  LEU     HA        1113  THR     H         4.95   (#peak     1083  #SUP       1    #QF         0.56
)
 &rst
  ixpk= 1083, nxpk= 0, iat= 321, 355, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#   1167  GLU     HA        1170  SER     H        4.697   (#peak     1097  #SUP      0.52  #QF         0.52
)
 &rst
  ixpk= 1097, nxpk= 0, iat=1242,1294, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   1166  ARG     HA        1169  GLN     H        4.455   (#peak     1102  #SUP      0.44  #QF         0.44
)
 &rst
  ixpk= 1102, nxpk= 0, iat=1218,1277, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1127  SER     HA        1130  LEU     H         4.62   (#peak     1103  #SUP      0.73  #QF         0.73
)
 &rst
  ixpk= 1103, nxpk= 0, iat= 571, 618, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#   1120  SER     H         1120  SER     QB       3.839   (#peak     1108  #SUP       1    #QF         0.39
)
 &rst
  ixpk= 1108, nxpk= 0, iat= 468,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2= 472, 473,
 &end
#
#   1091  SER     QB        1092  ALA     H         4.18   (#peak     1110  #SUP       1    #QF         0.36
)
 &rst
  ixpk= 1110, nxpk= 0, iat=  -1,  36, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1=  29,  30,
 &end
#
#   1168  LYS     HA        1170  SER     H        4.829   (#peak     1113  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1113, nxpk= 0, iat=1257,1294, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#   1099  ALA     HA        1164  TRP     HZ2      3.784   (#peak     1124  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1124, nxpk= 0, iat= 138,1188, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#   1099  ALA     HA        1164  TRP     HH2      4.543   (#peak     1125  #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 1125, nxpk= 0, iat= 138,1190, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#   1127  SER     QB        1128  ILE     H        4.543   (#peak     1126  #SUP      0.98  #QF         0.39
)
 &rst
  ixpk= 1126, nxpk= 0, iat=  -1, 580, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 573, 574,
 &end
#
#   1164  TRP     HB3       1164  TRP     HE3       4.18   (#peak     1129  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1129, nxpk= 0, iat=1180,1194, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#   1103  PHE     QE        1164  TRP     HB3       4.18   (#peak     1131  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1131, nxpk= 0, iat=  -1,1180, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 197, 201,
 &end
#
#   1148  GLU     HA        1151  LEU     H        4.873   (#peak     1134  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1134, nxpk= 0, iat= 922, 963, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#   1096  TYR     HB3       1164  TRP     HH2      4.543   (#peak     1137  #SUP       1
)
 &rst
  ixpk= 1137, nxpk= 0, iat=  97,1190, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#   1096  TYR     HB3       1164  TRP     HZ3      4.741   (#peak     1139  #SUP       1
)
 &rst
  ixpk= 1139, nxpk= 0, iat=  97,1192, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#   1133  LEU     H         1133  LEU     HG       4.598   (#peak     1142  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1142, nxpk= 0, iat= 678, 685, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   1112  MET     HG3       1115  PRO     HB3       4.29   (#peak     1149  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 1149, nxpk= 0, iat= 346, 389, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,  &end
#
#   1114  ASP     HB3       1126  ARG     HB2      3.245   (#peak     1191  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 1191, nxpk= 0, iat= 374, 549, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#   1118  LEU     HB3       1119  PRO     HG2      4.092   (#peak     1208  #SUP      0.74  #QF         0.74
)
 &rst
  ixpk= 1208, nxpk= 0, iat= 440, 458, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#   1119  PRO     HB3       1150  MET     HB3      4.257   (#peak     1216  #SUP      0.96  #QF         0.86
)
 &rst
  ixpk= 1216, nxpk= 0, iat= 462, 951, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#   1112  MET     HB3       1112  MET     QE        4.51   (#peak     1223  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1223, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 349, 350, 351,
 &end
#
#   1114  ASP     HB3       1126  ARG     HB3       4.62   (#peak     1236  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 1236, nxpk= 0, iat= 374, 550, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#   1125  ASP     HB3       1128  ILE     HB       3.861   (#peak     1238  #SUP      0.88  #QF         0.81
)
 &rst
  ixpk= 1238, nxpk= 0, iat= 538, 584, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#   1112  MET     HG2       1112  MET     QE       3.938   (#peak     1242  #SUP       1
)
 &rst
  ixpk= 1242, nxpk= 0, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 349, 350, 351,
 &end
#
#   1146  LEU     QD2       1150  MET     HB2       3.96   (#peak     1252  #SUP      0.92  #QF         0.64
)
 &rst
  ixpk= 1252, nxpk= 0, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 900, 901, 902,
 &end
#
#   1147  THR     QG2       1148  GLU     QG       3.861   (#peak     1254  #SUP      0.46  #QF         0.46
)
 &rst
  ixpk= 1254, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 912, 913, 914,
 igr2= 927, 928,
 &end
#
#   1108  MET     HB3       1110  THR     QG2       3.96   (#peak     1257  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1257, nxpk= 0, iat= 281,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2= 311, 312, 313,
 &end
#
#   1108  MET     HB2       1128  ILE     QD1      4.224   (#peak     1260  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1260, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 593, 594, 595,
 &end
#
#   1150  MET     HB2       1151  LEU     HG       4.444   (#peak     1261  #SUP      0.42  #QF         0.42
)
 &rst
  ixpk= 1261, nxpk= 0, iat= 950, 970, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   1161  ILE     QG2       1165  MET     HG2      3.927   (#peak     1266  #SUP      0.64  #QF         0.64
)
 &rst
  ixpk= 1266, nxpk= 0, iat=  -1,1206, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1135,1136,1137,
 &end
#
#   1160  GLN     HB2       1161  ILE     HG13     4.642   (#peak     1267  #SUP      0.68  #QF         0.48
)
 &rst
  ixpk= 1267, nxpk= 0, iat=1116,1140, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   1151  LEU     HB2       1151  LEU     QD1      3.696   (#peak     1268  #SUP      0.76  #QF         0.35
)
 &rst
  ixpk= 1268, nxpk= 0, iat= 967,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr2= 972, 973, 974,
 &end
#
#   1116  VAL     HB        1129  ILE     QG2      4.224   (#peak     1279  #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 1279, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 605, 606, 607,
 &end
#
#   1129  ILE     QG2       1130  LEU     HG       4.829   (#peak     1280  #SUP      0.95  #QF         0.63
)
 &rst
  ixpk= 1280, nxpk= 0, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr1= 605, 606, 607,
 &end
#
#   1129  ILE     QG2       1129  ILE     HG12     3.982   (#peak     1295  #SUP      0.99  #QF         0.93
)
 &rst
  ixpk= 1295, nxpk= 0, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 605, 606, 607,
 &end
#
#   1146  LEU     HB2       1146  LEU     QD2      4.246   (#peak     1298  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1298, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 900, 901, 902,
 &end
#
#   1129  ILE     QG2       1129  ILE     HG13     3.982   (#peak     1301  #SUP      0.96  #QF         0.56
)
 &rst
  ixpk= 1301, nxpk= 0, iat=  -1, 610, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 605, 606, 607,
 &end
#
#   1146  LEU     HB3       1146  LEU     QD2      4.246   (#peak     1308  #SUP       1    #QF         0.27
)
 &rst
  ixpk= 1308, nxpk= 0, iat= 892,  -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr2= 900, 901, 902,
 &end
#
#   1107  LEU     HG        1128  ILE     QG2      4.125   (#peak     1314  #SUP      0.46  #QF         0.28
)
 &rst
  ixpk= 1314, nxpk= 0, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 586, 587, 588,
 &end
#
#   1115  PRO     HB3       1123  VAL     QG1      3.553   (#peak     1320  #SUP      0.64  #QF         0.64
)
 &rst
  ixpk= 1320, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 506, 507, 508,
 &end
#
#   1151  LEU     HB2       1151  LEU     QD2      3.509   (#peak     1326  #SUP      0.37  #QF         0.37
)
 &rst
  ixpk= 1326, nxpk= 0, iat= 967,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2= 976, 977, 978,
 &end
#
#   1167  GLU     QB        1168  LYS     HG2      4.257   (#peak     1327  #SUP      0.67  #QF         0.57
)
 &rst
  ixpk= 1327, nxpk= 0, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1=1244,1245,
 &end
#
#   1094  ILE     HB        1094  ILE     QD1      3.718   (#peak     1330  #SUP      0.74  #QF         0.74
)
 &rst
  ixpk= 1330, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2=  74,  75,  76,
 &end
#
#   1111  LEU     HB3       1111  LEU     QD2      4.279   (#peak     1336  #SUP      0.96  #QF         0.42
)
 &rst
  ixpk= 1336, nxpk= 0, iat= 324,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 332, 333, 334,
 &end
#
#   1128  ILE     QG2       1128  ILE     HG13     3.916   (#peak     1341  #SUP      0.97  #QF         0.93
)
 &rst
  ixpk= 1341, nxpk= 0, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 586, 587, 588,
 &end
#
#   1130  LEU     HB2       1130  LEU     QD1       3.52   (#peak     1342  #SUP      0.99  #QF         0.95
)
 &rst
  ixpk= 1342, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 627, 628, 629,
 &end
#
#   1130  LEU     HB2       1130  LEU     QD2      3.971   (#peak     1342  #SUP      0.99  #QF         0.95
)
 &rst
  ixpk= 1342, nxpk= 0, iat= 622,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2= 631, 632, 633,
 &end
#
#   1111  LEU     HB2       1111  LEU     QD2      4.279   (#peak     1344  #SUP      0.99  #QF         0.42
)
 &rst
  ixpk= 1344, nxpk= 0, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 332, 333, 334,
 &end
#
#   1128  ILE     QG2       1140  PRO     HG3      3.597   (#peak     1357  #SUP      0.99  #QF         0.46
)
 &rst
  ixpk= 1357, nxpk= 0, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 586, 587, 588,
 &end
#
#   1107  LEU     QD1       1128  ILE     QD1       4.84   (#peak     1381  #SUP      0.91  #QF         0.86
)
 &rst
  ixpk= 1381, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 266, 267, 268,
 igr2= 593, 594, 595,
 &end
#
#   1107  LEU     QD2       1128  ILE     QD1       4.84   (#peak     1381  #SUP      0.91  #QF         0.86
)
 &rst
  ixpk= 1381, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 270, 271, 272,
 igr2= 593, 594, 595,
 &end
#
#   1111  LEU     HG        1161  ILE     QD1      5.412   (#peak     1385  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 1385, nxpk= 0, iat= 326,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2=1142,1143,1144,
 &end
#
#   1146  LEU     QD2       1151  LEU     QD2       3.52   (#peak     1391  #SUP      0.82  #QF         0.52
)
 &rst
  ixpk= 1391, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 900, 901, 902,
 igr2= 976, 977, 978,
 &end
#
#   1103  PHE     QD        1161  ILE     HG12     4.741   (#peak     1395  #SUP      0.83  #QF         0.83
)
 &rst
  ixpk= 1395, nxpk= 0, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 195, 203,
 &end
#
#   1099  ALA     HA        1100  PRO     HD3      3.905   (#peak     1405  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1405, nxpk= 0, iat= 138, 148, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1123  VAL     HA        1123  VAL     QG1      3.729   (#peak     1413  #SUP      0.82  #QF         0.41
)
 &rst
  ixpk= 1413, nxpk= 0, iat= 502,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2= 506, 507, 508,
 &end
#
#   1124  MET     HB3       1129  ILE     QG2      5.126   (#peak     1414  #SUP      0.83  #QF         0.26
)
 &rst
  ixpk= 1414, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2= 605, 606, 607,
 &end
#
#   1124  MET     HB3       1129  ILE     QD1      5.203   (#peak     1414  #SUP      0.83  #QF         0.26
)
 &rst
  ixpk= 1414, nxpk= 0, iat= 521,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr2= 612, 613, 614,
 &end
#
#   1116  VAL     QG2       1117  ARG     H        4.466   (#peak     1431  #SUP      0.59  #QF         0.59
)
 &rst
  ixpk= 1431, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 405, 406, 407,
 &end
#
#   1109  ASP     H         1128  ILE     QD1      5.258   (#peak     1441  #SUP      0.96  #QF         0.38
)
 &rst
  ixpk= 1441, nxpk= 0, iat= 293,  -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr2= 593, 594, 595,
 &end
#
#   1130  LEU     H         1130  LEU     QD2       4.95   (#peak     1442  #SUP      0.87  #QF         0.37
)
 &rst
  ixpk= 1442, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 631, 632, 633,
 &end
#
#   1123  VAL     QG2       1124  MET     H        4.422   (#peak     1463  #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 1463, nxpk= 0, iat=  -1, 516, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 510, 511, 512,
 &end
#
#   1112  MET     H         1112  MET     QE       4.532   (#peak     1481  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1481, nxpk= 0, iat= 338,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 349, 350, 351,
 &end
#
#   1112  MET     QE        1113  THR     H         4.62   (#peak     1562  #SUP      0.76  #QF         0.76
)
 &rst
  ixpk= 1562, nxpk= 0, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 349, 350, 351,
 &end
#
#   1136  SER     H         1136  SER     HB3      4.488   (#peak     1568  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1568, nxpk= 0, iat= 730, 735, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#   1168  LYS     H         1168  LYS     HB3       4.07   (#peak     1594  #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 1594, nxpk= 0, iat=1255,1260, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#   1104  ARG     H         1112  MET     QE       4.389   (#peak     1615  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1615, nxpk= 0, iat= 207,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2= 349, 350, 351,
 &end
#
#   1157  LEU     HB3       1160  GLN     H        5.698   (#peak     1617  #SUP      0.75  #QF         0.75
)
 &rst
  ixpk= 1617, nxpk= 0, iat=1061,1112, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#   1111  LEU     HG        1164  TRP     HE3       5.61   (#peak     1621  #SUP      0.63  #QF         0.63
)
 &rst
  ixpk= 1621, nxpk= 0, iat= 326,1194, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,  &end
#
#   1164  TRP     HZ2       1168  LYS     HE3      5.159   (#peak     1628  #SUP      0.37  #QF         0.37
)
 &rst
  ixpk= 1628, nxpk= 0, iat=1188,1269, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1140  PRO     HB3       1141  PHE     QE       5.027   (#peak     1648  #SUP      0.34  #QF         0.34
)
 &rst
  ixpk= 1648, nxpk= 0, iat= 789,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 805, 809,
 &end
#
#   1134  LEU     H         1134  LEU     HG       5.731   (#peak     1655  #SUP      0.98  #QF         0.33
)
 &rst
  ixpk= 1655, nxpk= 0, iat= 697, 704, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#   1130  LEU     HB3       1131  ARG     H        4.389   (#peak     1658  #SUP      0.69  #QF         0.33
)
 &rst
  ixpk= 1658, nxpk= 0, iat= 623, 637, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#   1151  LEU     H         1151  LEU     QD1      5.313   (#peak     1661  #SUP      0.54  #QF         0.36
)
 &rst
  ixpk= 1661, nxpk= 0, iat= 963,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2= 972, 973, 974,
 &end
#
#   1164  TRP     HZ3       1168  LYS     HG2      6.039   (#peak     1679  #SUP      0.99  #QF         0.97
)
 &rst
  ixpk= 1679, nxpk= 0, iat=1192,1262, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,  &end
#
#   1103  PHE     QE        1161  ILE     HA       4.455   (#peak     1692  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1692, nxpk= 0, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1= 197, 201,
 &end
#
#   1106  PRO     HB2       1141  PHE     HZ       4.224   (#peak     1699  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1699, nxpk= 0, iat= 250, 807, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#   1140  PRO     HB2       1141  PHE     HZ       4.598   (#peak     1702  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 1702, nxpk= 0, iat= 788, 807, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#   1094  ILE     QD1       1096  TYR     QE       5.137   (#peak     1711  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1711, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1=  74,  75,  76,
 igr2= 102, 107,
 &end
#
#   1097  SER     H         1098  ASP     H        4.323   (#peak     1814  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 1814, nxpk= 0, iat= 113, 124, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#   1096  TYR     H         1097  SER     H        4.103   (#peak     1817  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1817, nxpk= 0, iat=  92, 113, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#   1126  ARG     H         1127  SER     H        4.455   (#peak     1818  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1818, nxpk= 0, iat= 545, 569, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#   1143  ARG     H         1144  GLN     H        4.202   (#peak     1827  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1827, nxpk= 0, iat= 829, 853, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#   1169  GLN     H         1170  SER     H        3.905   (#peak     1838  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 1838, nxpk= 0, iat=1277,1294, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#   1167  GLU     H         1168  LYS     H        3.828   (#peak     1839  #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 1839, nxpk= 0, iat=1240,1255, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#   1103  PHE     H         1104  ARG     H        3.553   (#peak     1846  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 1846, nxpk= 0, iat= 187, 207, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#   1100  PRO     HG2       1103  PHE     HB2      4.851   (#peak     1861  #SUP       1    #QF         0.48
)
 &rst
  ixpk= 1861, nxpk= 0, iat= 150, 191, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   1163  ALA     QB        1164  TRP     HA       4.895   (#peak     1870  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1870, nxpk= 0, iat=  -1,1177, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1169,1170,1171,
 &end
#
#   1115  PRO     HD2       1161  ILE     QD1      5.082   (#peak     1874  #SUP       1
)
 &rst
  ixpk= 1874, nxpk= 0, iat= 382,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2=1142,1143,1144,
 &end
#
#   1096  TYR     HB3       1099  ALA     QB       4.785   (#peak     1876  #SUP      0.97  #QF         0.96
)
 &rst
  ixpk= 1876, nxpk= 0, iat=  97,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 140, 141, 142,
 &end
#
#   1117  ARG     HA        1123  VAL     QG2       4.62   (#peak     1877  #SUP      0.79  #QF         0.79
)
 &rst
  ixpk= 1877, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 510, 511, 512,
 &end
#
#   1165  MET     HA        1168  LYS     HB2      4.774   (#peak     1884  #SUP      0.4   #QF          0.4
)
 &rst
  ixpk= 1884, nxpk= 0, iat=1201,1259, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,  &end
#
#   1132  HIS     HB2       1140  PRO     HG3      4.807   (#peak     1886  #SUP      0.43  #QF         0.43
)
 &rst
  ixpk= 1886, nxpk= 0, iat= 665, 786, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   1094  ILE     HG13      1169  GLN     HA       5.291   (#peak     1888  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 1888, nxpk= 0, iat=  72,1279, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#   1096  TYR     HA        1168  LYS     HE3      5.236   (#peak     1891  #SUP      0.65  #QF         0.65
)
 &rst
  ixpk= 1891, nxpk= 0, iat=  94,1269, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   1115  PRO     HA        1126  ARG     HB2      5.676   (#peak     1892  #SUP      0.49  #QF         0.49
)
 &rst
  ixpk= 1892, nxpk= 0, iat= 391, 549, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
#   1112  MET     QE        1115  PRO     HA       4.895   (#peak     1893  #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 1893, nxpk= 0, iat=  -1, 391, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 349, 350, 351,
 &end
#
#   1104  ARG     HB2       1109  ASP     HA        6.05   (#peak     1895  #SUP      0.91  #QF         0.86
)
 &rst
  ixpk= 1895, nxpk= 0, iat= 211, 295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1154  VAL     HA        1157  LEU     HB2       6.05   (#peak     1895  #SUP      0.91  #QF         0.86
)
 &rst
  ixpk= 1895, nxpk= 0, iat=1013,1060, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1159  GLU     HA        1162  GLN     HG2      4.796   (#peak     1899  #SUP      0.99  #QF         0.78
)
 &rst
  ixpk= 1899, nxpk= 0, iat=1099,1155, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1149  SER     QB        1150  MET     QG       5.027   (#peak     1900  #SUP      0.98  #QF          0.8
)
 &rst
  ixpk= 1900, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 939, 940,
 igr2= 953, 954,
 &end
#
#   1118  LEU     HB2       1122  THR     HB       4.752   (#peak     1904  #SUP      0.86  #QF         0.86
)
 &rst
  ixpk= 1904, nxpk= 0, iat= 439, 490, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#   1161  ILE     HA        1162  GLN     HA       5.555   (#peak     1905  #SUP      0.87  #QF         0.87
)
 &rst
  ixpk= 1905, nxpk= 0, iat=1131,1150, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
#   1103  PHE     HB2       1104  ARG     QD       5.137   (#peak     1906  #SUP      0.7   #QF          0.6
)
 &rst
  ixpk= 1906, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2= 217, 218,
 &end
#
#   1162  GLN     HA        1165  MET     HG3      4.697   (#peak     1916  #SUP      0.71  #QF         0.71
)
 &rst
  ixpk= 1916, nxpk= 0, iat=1150,1207, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#   1143  ARG     HA        1143  ARG     QD       4.807   (#peak     1917  #SUP       1
)
 &rst
  ixpk= 1917, nxpk= 0, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 839, 840,
 &end
#
#   1117  ARG     QD        1155  PRO     HD2      5.544   (#peak     1918  #SUP      0.66  #QF         0.22
)
 &rst
  ixpk= 1918, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 421, 422,
 &end
#
#   1166  ARG     HA        1166  ARG     QD       5.764   (#peak     1918  #SUP      0.66  #QF         0.22
)
 &rst
  ixpk= 1918, nxpk= 0, iat=1218,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2=1226,1227,
 &end
#
#   1139  ASP     HB3       1143  ARG     HA       5.005   (#peak     1919  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1919, nxpk= 0, iat= 774, 831, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#   1115  PRO     HD3       1158  LYS     HA       4.653   (#peak     1927  #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 1927, nxpk= 0, iat= 383,1077, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   1117  ARG     QD        1121  GLY     HA2      5.577   (#peak     1930  #SUP      0.63  #QF         0.63
)
 &rst
  ixpk= 1930, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1= 421, 422,
 &end
#
#   1114  ASP     HB2       1126  ARG     HB2      5.742   (#peak     1939  #SUP      0.67  #QF         0.56
)
 &rst
  ixpk= 1939, nxpk= 0, iat= 373, 549, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1103  PHE     QD        1161  ILE     HA       4.928   (#peak     1954  #SUP       1
)
 &rst
  ixpk= 1954, nxpk= 0, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 195, 203,
 &end
#
#   1093  GLU     QG        1096  TYR     QE       5.742   (#peak     1955  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1955, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1=  53,  54,
 igr2= 102, 107,
 &end
#
#   1096  TYR     QE        1165  MET     HG3      5.929   (#peak     1957  #SUP      0.95  #QF         0.86
)
 &rst
  ixpk= 1957, nxpk= 0, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 102, 107,
 &end
#
#   1096  TYR     QE        1168  LYS     HE2      5.577   (#peak     1958  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 1958, nxpk= 0, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1= 102, 107,
 &end
#
#   1164  TRP     HZ3       1165  MET     HA       5.104   (#peak     1966  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 1966, nxpk= 0, iat=1192,1201, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   1103  PHE     HZ        1164  TRP     HB2      4.796   (#peak     1967  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1967, nxpk= 0, iat= 199,1179, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1140  PRO     HD2       1141  PHE     QD       4.752   (#peak     1968  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1968, nxpk= 0, iat= 782,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2= 803, 811,
 &end
#
#   1096  TYR     HB2       1164  TRP     HZ3      5.148   (#peak     1973  #SUP      0.88  #QF         0.72
)
 &rst
  ixpk= 1973, nxpk= 0, iat=  96,1192, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#   1164  TRP     HZ3       1165  MET     HG3      5.632   (#peak     1973  #SUP      0.88  #QF         0.72
)
 &rst
  ixpk= 1973, nxpk= 0, iat=1192,1207, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#   1104  ARG     H         1112  MET     HG2       6.05   (#peak     1976  #SUP      0.81  #QF         0.53
)
 &rst
  ixpk= 1976, nxpk= 0, iat= 207, 345, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1164  TRP     HH2       1168  LYS     HE3      5.214   (#peak     1979  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 1979, nxpk= 0, iat=1190,1269, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1164  TRP     HH2       1168  LYS     HE2      4.939   (#peak     1980  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1980, nxpk= 0, iat=1190,1268, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#   1134  LEU     H         1135  ASN     QB       5.643   (#peak     1981  #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 1981, nxpk= 0, iat= 697,  -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr2= 720, 721,
 &end
#
#   1096  TYR     QD        1168  LYS     HE2      4.895   (#peak     1983  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 1983, nxpk= 0, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 100, 109,
 &end
#
#   1125  ASP     HB2       1128  ILE     H        5.126   (#peak     1984  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1984, nxpk= 0, iat= 537, 580, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#   1103  PHE     HZ        1160  GLN     HB2      4.895   (#peak     1986  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 1986, nxpk= 0, iat= 199,1116, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1164  TRP     HZ3       1165  MET     HG2      4.862   (#peak     1987  #SUP       1
)
 &rst
  ixpk= 1987, nxpk= 0, iat=1192,1206, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   1108  MET     QG        1110  THR     H        5.819   (#peak     1988  #SUP      0.95  #QF         0.92
)
 &rst
  ixpk= 1988, nxpk= 0, iat=  -1, 305, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 283, 284,
 &end
#
#   1103  PHE     HZ        1161  ILE     HA       5.071   (#peak     1990  #SUP       1
)
 &rst
  ixpk= 1990, nxpk= 0, iat= 199,1131, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#   1127  SER     HA        1131  ARG     H        4.994   (#peak     1993  #SUP      0.7   #QF          0.7
)
 &rst
  ixpk= 1993, nxpk= 0, iat= 571, 637, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,  &end
#
#   1155  PRO     HA        1160  GLN     H         6.05   (#peak     1995  #SUP      0.96  #QF         0.21
)
 &rst
  ixpk= 1995, nxpk= 0, iat=1037,1112, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1164  TRP     HA        1164  TRP     HE3       6.05   (#peak     1995  #SUP      0.96  #QF         0.21
)
 &rst
  ixpk= 1995, nxpk= 0, iat=1177,1194, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1148  GLU     HA        1150  MET     H        4.829   (#peak     1999  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 1999, nxpk= 0, iat= 922, 946, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#   1147  THR     H         1150  MET     HB2      4.961   (#peak     2001  #SUP      0.91  #QF         0.91
)
 &rst
  ixpk= 2001, nxpk= 0, iat= 906, 950, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   1169  GLN     H         1169  GLN     QG       4.741   (#peak     2003  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 2003, nxpk= 0, iat=1277,  -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr2=1284,1285,
 &end
#
#   1115  PRO     HB2       1124  MET     H        6.039   (#peak     2019  #SUP      0.96  #QF         0.95
)
 &rst
  ixpk= 2019, nxpk= 0, iat= 388, 516, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,  &end
#
#   1124  MET     H         1129  ILE     HB        6.05   (#peak     2019  #SUP      0.96  #QF         0.95
)
 &rst
  ixpk= 2019, nxpk= 0, iat= 516, 603, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1101  ASP     H         1102  GLU     QG       5.203   (#peak     2022  #SUP      0.39  #QF         0.39
)
 &rst
  ixpk= 2022, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2= 179, 180,
 &end
#
#   1095  ASP     HB2       1096  TYR     H        5.203   (#peak     2023  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 2023, nxpk= 0, iat=  84,  92, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#   1114  ASP     H         1115  PRO     HD3      4.939   (#peak     2026  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2026, nxpk= 0, iat= 369, 383, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#   1139  ASP     HB3       1142  ASN     H        5.082   (#peak     2028  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2028, nxpk= 0, iat= 774, 815, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   1127  SER     QB        1129  ILE     H         6.05   (#peak     2036  #SUP      0.87  #QF         0.81
)
 &rst
  ixpk= 2036, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 573, 574,
 &end
#
#   1140  PRO     HA        1143  ARG     H         6.05   (#peak     2036  #SUP      0.87  #QF         0.81
)
 &rst
  ixpk= 2036, nxpk= 0, iat= 791, 829, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1169  GLN     HB2       1170  SER     H        4.763   (#peak     2038  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2038, nxpk= 0, iat=1281,1294, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#   1117  ARG     H         1154  VAL     HB        6.05   (#peak     2044  #SUP      0.97  #QF         0.95
)
 &rst
  ixpk= 2044, nxpk= 0, iat= 411,1015, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1124  MET     QG        1125  ASP     H        4.774   (#peak     2045  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2045, nxpk= 0, iat=  -1, 533, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr1= 523, 524,
 &end
#
#   1106  PRO     QG        1108  MET     H         6.05   (#peak     2049  #SUP      0.58  #QF         0.29
)
 &rst
  ixpk= 2049, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 247, 248,
 &end
#
#   1108  MET     H         1128  ILE     HB        6.05   (#peak     2049  #SUP      0.58  #QF         0.29
)
 &rst
  ixpk= 2049, nxpk= 0, iat= 276, 584, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1105  ASP     H         1112  MET     HG3      5.995   (#peak     2050  #SUP      0.36  #QF         0.36
)
 &rst
  ixpk= 2050, nxpk= 0, iat= 231, 346, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#   1106  PRO     HD3       1107  LEU     H        4.851   (#peak     2051  #SUP      0.76  #QF         0.42
)
 &rst
  ixpk= 2051, nxpk= 0, iat= 245, 257, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#   1117  ARG     H         1151  LEU     HB3      5.929   (#peak     2059  #SUP      0.95  #QF         0.65
)
 &rst
  ixpk= 2059, nxpk= 0, iat= 411, 968, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
#   1107  LEU     H         1128  ILE     QG2      5.082   (#peak     2060  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2060, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2= 586, 587, 588,
 &end
#
#   1133  LEU     QD1       1148  GLU     H         5.39   (#peak     2061  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2061, nxpk= 0, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 687, 688, 689,
 &end
#
#   1148  GLU     H         1151  LEU     QD2       6.05   (#peak     2063  #SUP      0.72  #QF         0.72
)
 &rst
  ixpk= 2063, nxpk= 0, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 976, 977, 978,
 &end
#
#   1126  ARG     H         1126  ARG     HG3      5.137   (#peak     2067  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2067, nxpk= 0, iat= 545, 553, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1163  ALA     QB        1165  MET     H        5.467   (#peak     2069  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2069, nxpk= 0, iat=  -1,1199, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1=1169,1170,1171,
 &end
#
#   1117  ARG     HB2       1118  LEU     H        5.159   (#peak     2072  #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 2072, nxpk= 0, iat= 415, 435, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1111  LEU     HB2       1112  MET     H        5.115   (#peak     2073  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 2073, nxpk= 0, iat= 323, 338, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1111  LEU     HG        1112  MET     H        4.961   (#peak     2077  #SUP      0.57  #QF         0.57
)
 &rst
  ixpk= 2077, nxpk= 0, iat= 326, 338, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   1139  ASP     H         1146  LEU     HB3      5.137   (#peak     2082  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2082, nxpk= 0, iat= 769, 892, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1111  LEU     HB3       1112  MET     H        5.115   (#peak     2083  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 2083, nxpk= 0, iat= 324, 338, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1138  THR     H         1146  LEU     HB3      5.478   (#peak     2084  #SUP      0.96  #QF          0.7
)
 &rst
  ixpk= 2084, nxpk= 0, iat= 755, 892, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1099  ALA     QB        1111  LEU     H         6.05   (#peak     2085  #SUP      0.27  #QF         0.27
)
 &rst
  ixpk= 2085, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 140, 141, 142,
 &end
#
#   1130  LEU     QD1       1133  LEU     H        5.346   (#peak     2086  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2086, nxpk= 0, iat=  -1, 678, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
 igr1= 627, 628, 629,
 &end
#
#   1115  PRO     QG        1159  GLU     H         6.05   (#peak     2094  #SUP      0.95  #QF         0.86
)
 &rst
  ixpk= 2094, nxpk= 0, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 385, 386,
 &end
#
#   1124  MET     HB2       1129  ILE     H         6.05   (#peak     2094  #SUP      0.95  #QF         0.86
)
 &rst
  ixpk= 2094, nxpk= 0, iat= 520, 599, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1159  GLU     H         1161  ILE     HB        6.05   (#peak     2094  #SUP      0.95  #QF         0.86
)
 &rst
  ixpk= 2094, nxpk= 0, iat=1097,1133, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1157  LEU     HB2       1158  LYS     H        4.532   (#peak     2095  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 2095, nxpk= 0, iat=1060,1075, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#   1157  LEU     HB3       1158  LYS     H        4.906   (#peak     2096  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2096, nxpk= 0, iat=1061,1075, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#   1100  PRO     HG2       1103  PHE     H        5.456   (#peak     2098  #SUP      0.98  #QF         0.59
)
 &rst
  ixpk= 2098, nxpk= 0, iat= 150, 187, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#   1168  LYS     H         1168  LYS     QD       5.929   (#peak     2098  #SUP      0.98  #QF         0.59
)
 &rst
  ixpk= 2098, nxpk= 0, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr2=1265,1266,
 &end
#
#   1164  TRP     HE3       1168  LYS     QD       5.819   (#peak     2099  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 2099, nxpk= 0, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr2=1265,1266,
 &end
#
#   1094  ILE     HB        1096  TYR     QD       5.324   (#peak     2108  #SUP       1
)
 &rst
  ixpk= 2108, nxpk= 0, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2= 100, 109,
 &end
#
#   1096  TYR     QD        1168  LYS     HB3      5.687   (#peak     2108  #SUP       1
)
 &rst
  ixpk= 2108, nxpk= 0, iat=  -1,1260, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr1= 100, 109,
 &end
#
#   1107  LEU     HG        1141  PHE     QE       5.753   (#peak     2109  #SUP      0.99  #QF         0.82
)
 &rst
  ixpk= 2109, nxpk= 0, iat= 264,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2= 805, 809,
 &end
#
#   1096  TYR     QD        1168  LYS     HB2      5.126   (#peak     2110  #SUP      0.5   #QF          0.5
)
 &rst
  ixpk= 2110, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 100, 109,
 &end
#
#   1164  TRP     HZ3       1168  LYS     QD        6.05   (#peak     2116  #SUP      0.49  #QF         0.25
)
 &rst
  ixpk= 2116, nxpk= 0, iat=1192,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2=1265,1266,
 &end
#
#   1096  TYR     QD        1168  LYS     QD       5.016   (#peak     2117  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2117, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 100, 109,
 igr2=1265,1266,
 &end
#
#   1164  TRP     HH2       1168  LYS     QD       5.005   (#peak     2118  #SUP       1
)
 &rst
  ixpk= 2118, nxpk= 0, iat=1190,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2=1265,1266,
 &end
#
#   1096  TYR     QD        1168  LYS     HG3      4.928   (#peak     2120  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 2120, nxpk= 0, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 100, 109,
 &end
#
#   1100  PRO     HG3       1103  PHE     HZ       5.896   (#peak     2121  #SUP      0.97  #QF         0.87
)
 &rst
  ixpk= 2121, nxpk= 0, iat= 151, 199, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1103  PHE     HZ        1161  ILE     QD1       6.05   (#peak     2121  #SUP      0.97  #QF         0.87
)
 &rst
  ixpk= 2121, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2=1142,1143,1144,
 &end
#
#   1096  TYR     QE        1168  LYS     HG3      5.071   (#peak     2122  #SUP      0.8   #QF          0.8
)
 &rst
  ixpk= 2122, nxpk= 0, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 102, 107,
 &end
#
#   1096  TYR     QE        1168  LYS     QD       5.115   (#peak     2123  #SUP       1
)
 &rst
  ixpk= 2123, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 102, 107,
 igr2=1265,1266,
 &end
#
#   1103  PHE     QD        1161  ILE     HB        6.05   (#peak     2124  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 2124, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 195, 203,
 &end
#
#   1103  PHE     QD        1111  LEU     HG       4.763   (#peak     2126  #SUP      0.55  #QF         0.55
)
 &rst
  ixpk= 2126, nxpk= 0, iat=  -1, 326, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 195, 203,
 &end
#
#   1103  PHE     QE        1112  MET     QE       5.599   (#peak     2127  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2127, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
 igr1= 197, 201,
 igr2= 349, 350, 351,
 &end
#
#   1103  PHE     QE        1161  ILE     HB       5.951   (#peak     2128  #SUP      0.93  #QF         0.89
)
 &rst
  ixpk= 2128, nxpk= 0, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr1= 197, 201,
 &end
#
#   1103  PHE     QE        1163  ALA     QB        6.05   (#peak     2128  #SUP      0.93  #QF         0.89
)
 &rst
  ixpk= 2128, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
 igr1= 197, 201,
 igr2=1169,1170,1171,
 &end
#
#   1129  ILE     QD1       1132  HIS     HB2      4.433   (#peak     2135  #SUP       1
)
 &rst
  ixpk= 2135, nxpk= 0, iat=  -1, 665, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 612, 613, 614,
 &end
#
#   1112  MET     HB2       1114  ASP     HB2      4.763   (#peak     2144  #SUP      0.73  #QF         0.73
)
 &rst
  ixpk= 2144, nxpk= 0, iat= 342, 373, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#   1163  ALA     QB        1166  ARG     QD       5.082   (#peak     2147  #SUP      0.34  #QF         0.34
)
 &rst
  ixpk= 2147, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1=1169,1170,1171,
 igr2=1226,1227,
 &end
#
#   1127  SER     HA        1130  LEU     HB2       6.05   (#peak     2170  #SUP      0.77  #QF         0.24
)
 &rst
  ixpk= 2170, nxpk= 0, iat= 571, 622, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1168  LYS     HB3       1168  LYS     HE3       5.06   (#peak     2187  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2187, nxpk= 0, iat=1260,1269, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1114  ASP     HB2       1126  ARG     HB3      4.356   (#peak     2190  #SUP      0.61  #QF         0.61
)
 &rst
  ixpk= 2190, nxpk= 0, iat= 373, 550, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#   1116  VAL     HB        1126  ARG     HB2      5.753   (#peak     2193  #SUP      0.84  #QF         0.72
)
 &rst
  ixpk= 2193, nxpk= 0, iat= 399, 549, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,  &end
#
#   1117  ARG     HB3       1152  GLU     QG       6.017   (#peak     2193  #SUP      0.84  #QF         0.72
)
 &rst
  ixpk= 2193, nxpk= 0, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
 igr2= 989, 990,
 &end
#
#   1125  ASP     HB3       1128  ILE     HG12     4.884   (#peak     2195  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2195, nxpk= 0, iat= 538, 590, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   1167  GLU     QB        1168  LYS     QD       5.082   (#peak     2198  #SUP      0.96  #QF         0.95
)
 &rst
  ixpk= 2198, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1=1244,1245,
 igr2=1265,1266,
 &end
#
#   1100  PRO     HG2       1102  GLU     QG       4.521   (#peak     2201  #SUP      0.98  #QF         0.62
)
 &rst
  ixpk= 2201, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 179, 180,
 &end
#
#   1125  ASP     HB3       1128  ILE     HG13     4.884   (#peak     2209  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2209, nxpk= 0, iat= 538, 591, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   1161  ILE     HA        1161  ILE     HG13     4.081   (#peak     2213  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2213, nxpk= 0, iat=1131,1140, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#   1112  MET     HG2       1161  ILE     QD1      5.225   (#peak     2221  #SUP       1
)
 &rst
  ixpk= 2221, nxpk= 0, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=1142,1143,1144,
 &end
#
#   1103  PHE     HB2       1111  LEU     HG       5.159   (#peak     2225  #SUP      0.67  #QF         0.67
)
 &rst
  ixpk= 2225, nxpk= 0, iat= 191, 326, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#   1108  MET     QG        1128  ILE     QD1      3.916   (#peak     2226  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2226, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 283, 284,
 igr2= 593, 594, 595,
 &end
#
#   1125  ASP     HB2       1128  ILE     QD1      4.598   (#peak     2227  #SUP      0.94  #QF         0.64
)
 &rst
  ixpk= 2227, nxpk= 0, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr2= 593, 594, 595,
 &end
#
#   1124  MET     HB3       1140  PRO     HG3       6.05   (#peak     2228  #SUP      0.8   #QF         0.55
)
 &rst
  ixpk= 2228, nxpk= 0, iat= 521, 786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1100  PRO     HG3       1102  GLU     QG       5.027   (#peak     2229  #SUP      0.99  #QF         0.58
)
 &rst
  ixpk= 2229, nxpk= 0, iat= 151,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr2= 179, 180,
 &end
#
#   1115  PRO     HB3       1161  ILE     QD1      5.005   (#peak     2230  #SUP       1    #QF         0.67
)
 &rst
  ixpk= 2230, nxpk= 0, iat= 389,  -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr2=1142,1143,1144,
 &end
#
#   1157  LEU     HB2       1161  ILE     QD1      5.775   (#peak     2230  #SUP       1    #QF         0.67
)
 &rst
  ixpk= 2230, nxpk= 0, iat=1060,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2=1142,1143,1144,
 &end
#
#   1112  MET     HB2       1161  ILE     QD1      5.071   (#peak     2231  #SUP       1
)
 &rst
  ixpk= 2231, nxpk= 0, iat= 342,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr2=1142,1143,1144,
 &end
#
#   1094  ILE     QG2       1168  LYS     HB2      4.609   (#peak     2233  #SUP      0.49  #QF         0.49
)
 &rst
  ixpk= 2233, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1=  67,  68,  69,
 &end
#
#   1094  ILE     QG2       1168  LYS     QD       5.104   (#peak     2240  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 2240, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr1=  67,  68,  69,
 igr2=1265,1266,
 &end
#
#   1139  ASP     H         1146  LEU     HG       5.126   (#peak     2257  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2257, nxpk= 0, iat= 769, 894, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#   1091  SER     H         1092  ALA     QB       5.082   (#peak     2264  #SUP      0.31  #QF         0.31
)
 &rst
  ixpk= 2264, nxpk= 0, iat=  25,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2=  40,  41,  42,
 &end
#
#   1129  ILE     H         1129  ILE     HG12     5.478   (#peak     2265  #SUP      0.96  #QF         0.95
)
 &rst
  ixpk= 2265, nxpk= 0, iat= 599, 609, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,  &end
#
#   1129  ILE     QD1       1132  HIS     H        5.291   (#peak     2277  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 2277, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 612, 613, 614,
 &end
#
#   1146  LEU     QD2       1150  MET     H         5.5    (#peak     2278  #SUP      0.67  #QF          0.3
)
 &rst
  ixpk= 2278, nxpk= 0, iat=  -1, 946, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 900, 901, 902,
 &end
#
#   1164  TRP     HE3       1168  LYS     HB2       6.05   (#peak     2285  #SUP      0.99  #QF         0.36
)
 &rst
  ixpk= 2285, nxpk= 0, iat=1194,1259, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1105  ASP     H         1112  MET     HG2      5.511   (#peak     2295  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 2295, nxpk= 0, iat= 231, 345, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
#   1156  GLU     QG        1158  LYS     H        4.785   (#peak     2304  #SUP      0.68  #QF         0.68
)
 &rst
  ixpk= 2304, nxpk= 0, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=1048,1049,
 &end
#
#   1119  PRO     HB3       1120  SER     H        4.829   (#peak     2307  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 2307, nxpk= 0, iat= 462, 468, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#   1161  ILE     HA        1164  TRP     HE3      4.796   (#peak     2309  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2309, nxpk= 0, iat=1131,1194, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#   1131  ARG     H         1132  HIS     HB2      5.896   (#peak     2311  #SUP      0.92  #QF         0.63
)
 &rst
  ixpk= 2311, nxpk= 0, iat= 637, 665, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#   1096  TYR     HB2       1164  TRP     HH2       6.05   (#peak     2311  #SUP      0.92  #QF         0.63
)
 &rst
  ixpk= 2311, nxpk= 0, iat=  96,1190, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1100  PRO     HD2       1164  TRP     HH2       6.05   (#peak     2311  #SUP      0.92  #QF         0.63
)
 &rst
  ixpk= 2311, nxpk= 0, iat= 147,1190, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1096  TYR     QD        1168  LYS     HE3      5.016   (#peak     2332  #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 2332, nxpk= 0, iat=  -1,1269, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 100, 109,
 &end
#
#   1164  TRP     H         1164  TRP     HE3      5.236   (#peak     2373  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2373, nxpk= 0, iat=1175,1194, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#   1107  LEU     H         1141  PHE     HZ       5.126   (#peak     2377  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2377, nxpk= 0, iat= 257, 807, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#   1171  SER     H         1172  ASP     H        4.664   (#peak     2383  #SUP      0.95  #QF         0.47
)
 &rst
  ixpk= 2383, nxpk= 0, iat=1305,1316, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#   1093  GLU     H         1094  ILE     H        5.555   (#peak     2384  #SUP      0.99  #QF         0.96
)
 &rst
  ixpk= 2384, nxpk= 0, iat=  46,  61, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
#   1094  ILE     H         1095  ASP     H        6.039   (#peak     2384  #SUP      0.99  #QF         0.96
)
 &rst
  ixpk= 2384, nxpk= 0, iat=  61,  80, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,  &end
#
#   1162  GLN     H         1165  MET     H        5.874   (#peak     2393  #SUP      0.98  #QF         0.69
)
 &rst
  ixpk= 2393, nxpk= 0, iat=1148,1199, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,  &end
#
#   1163  ALA     H         1165  MET     H         6.05   (#peak     2393  #SUP      0.98  #QF         0.69
)
 &rst
  ixpk= 2393, nxpk= 0, iat=1165,1199, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1154  VAL     HA        1156  GLU     H        4.961   (#peak     2399  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2399, nxpk= 0, iat=1013,1041, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#   1114  ASP     H         1115  PRO     HD2      5.192   (#peak     2413  #SUP      0.99  #QF         0.77
)
 &rst
  ixpk= 2413, nxpk= 0, iat= 369, 382, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#   1142  ASN     H         1143  ARG     QG       5.698   (#peak     2420  #SUP      0.67  #QF         0.29
)
 &rst
  ixpk= 2420, nxpk= 0, iat= 815,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 836, 837,
 &end
#
#   1146  LEU     H         1146  LEU     QD2      5.192   (#peak     2423  #SUP       1    #QF         0.99
)
 &rst
  ixpk= 2423, nxpk= 0, iat= 887,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 900, 901, 902,
 &end
#
#   1146  LEU     H         1146  LEU     QD1      5.566   (#peak     2423  #SUP       1    #QF         0.99
)
 &rst
  ixpk= 2423, nxpk= 0, iat= 887,  -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr2= 896, 897, 898,
 &end
#
#   1096  TYR     HB2       1111  LEU     HG       4.928   (#peak     2425  #SUP      0.51  #QF         0.51
)
 &rst
  ixpk= 2425, nxpk= 0, iat=  96, 326, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#   1124  MET     QE        1140  PRO     HD2       4.62   (#peak     2432  #SUP      0.43  #QF         0.43
)
 &rst
  ixpk= 2432, nxpk= 0, iat=  -1, 782, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 527, 528, 529,
 &end
#
#   1129  ILE     HB        1140  PRO     HG3      5.423   (#peak     2443  #SUP      0.66  #QF         0.54
)
 &rst
  ixpk= 2443, nxpk= 0, iat= 603, 786, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#   1107  LEU     HB2       1107  LEU     QD1      4.664   (#peak     2445  #SUP       1    #QF         0.98
)
 &rst
  ixpk= 2445, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 266, 267, 268,
 &end
#
#   1107  LEU     HB2       1107  LEU     QD2      4.664   (#peak     2445  #SUP       1    #QF         0.98
)
 &rst
  ixpk= 2445, nxpk= 0, iat= 261,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 270, 271, 272,
 &end
#
#   1115  PRO     HA        1123  VAL     QG1      4.774   (#peak     2464  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2464, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2= 506, 507, 508,
 &end
#
#   1168  LYS     H         1170  SER     H        4.884   (#peak     2466  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 2466, nxpk= 0, iat=1255,1294, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#   1158  LYS     H         1160  GLN     H        5.016   (#peak     2467  #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 2467, nxpk= 0, iat=1075,1112, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#   1099  ALA     H         1164  TRP     HZ2      4.862   (#peak     2468  #SUP       1
)
 &rst
  ixpk= 2468, nxpk= 0, iat= 136,1188, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#   1168  LYS     H         1169  GLN     H        3.773   (#peak     2470  #SUP      0.88  #QF         0.88
)
 &rst
  ixpk= 2470, nxpk= 0, iat=1255,1277, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#   1103  PHE     QE        1161  ILE     H        5.137   (#peak     2473  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2473, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 197, 201,
 &end
#
#   1103  PHE     QE        1164  TRP     H        4.818   (#peak     2474  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2474, nxpk= 0, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 197, 201,
 &end
#
#   1144  GLN     H         1145  MET     H        5.082   (#peak     2479  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2479, nxpk= 0, iat= 853, 870, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   1170  SER     H         1171  SER     H        4.895   (#peak     2480  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2480, nxpk= 0, iat=1294,1305, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   1142  ASN     H         1144  GLN     H         5.06   (#peak     2483  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2483, nxpk= 0, iat= 815, 853, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1122  THR     H         1123  VAL     H         5.06   (#peak     2485  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2485, nxpk= 0, iat= 486, 500, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#   1096  TYR     QD        1099  ALA     H        5.423   (#peak     2488  #SUP      0.51  #QF         0.51
)
 &rst
  ixpk= 2488, nxpk= 0, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 100, 109,
 &end
#
#   1096  TYR     QD        1164  TRP     HE3      5.225   (#peak     2489  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2489, nxpk= 0, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 100, 109,
 &end
#
#   1096  TYR     QD        1164  TRP     HZ2      5.346   (#peak     2490  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2490, nxpk= 0, iat=  -1,1188, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 100, 109,
 &end
#
#   1103  PHE     HZ        1160  GLN     H         6.05   (#peak     2491  #SUP      0.46  #QF         0.46
)
 &rst
  ixpk= 2491, nxpk= 0, iat= 199,1112, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1157  LEU     H         1160  GLN     H        5.258   (#peak     2492  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2492, nxpk= 0, iat=1056,1112, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
#   1114  ASP     H         1126  ARG     H        5.148   (#peak     2494  #SUP      0.89  #QF         0.89
)
 &rst
  ixpk= 2494, nxpk= 0, iat= 369, 545, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
#   1096  TYR     QE        1164  TRP     HH2      5.676   (#peak     2500  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2500, nxpk= 0, iat=  -1,1190, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
 igr1= 102, 107,
 &end
#
#   1105  ASP     H         1112  MET     QE       5.192   (#peak     2505  #SUP      0.81  #QF         0.81
)
 &rst
  ixpk= 2505, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 349, 350, 351,
 &end
#
#   1149  SER     HA        1151  LEU     H        5.104   (#peak     2507  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 2507, nxpk= 0, iat= 937, 963, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#   1124  MET     HA        1124  MET     QE        5.17   (#peak     2508  #SUP      0.9   #QF          0.2
)
 &rst
  ixpk= 2508, nxpk= 0, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr2= 527, 528, 529,
 &end
#
#   1112  MET     QE        1125  ASP     HA       5.489   (#peak     2509  #SUP      0.53  #QF         0.53
)
 &rst
  ixpk= 2509, nxpk= 0, iat=  -1, 535, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 349, 350, 351,
 &end
#
#   1103  PHE     HB3       1112  MET     QE       5.236   (#peak     2510  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2510, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2= 349, 350, 351,
 &end
#
#   1100  PRO     HB3       1103  PHE     HB2       6.05   (#peak     2511  #SUP       1    #QF          0.9
)
 &rst
  ixpk= 2511, nxpk= 0, iat= 154, 191, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1103  PHE     HB2       1112  MET     QE        6.05   (#peak     2511  #SUP       1    #QF          0.9
)
 &rst
  ixpk= 2511, nxpk= 0, iat= 191,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 349, 350, 351,
 &end
#
#   1103  PHE     HB3       1161  ILE     QD1      4.862   (#peak     2516  #SUP       1
)
 &rst
  ixpk= 2516, nxpk= 0, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1142,1143,1144,
 &end
#
#   1116  VAL     HA        1152  GLU     H        5.115   (#peak     2518  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2518, nxpk= 0, iat= 397, 982, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#   1141  PHE     H         1141  PHE     QE       5.753   (#peak     2522  #SUP       1    #QF         0.99
)
 &rst
  ixpk= 2522, nxpk= 0, iat= 795,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr2= 805, 809,
 &end
#
#   1139  ASP     H         1146  LEU     H        5.214   (#peak     2523  #SUP       1
)
 &rst
  ixpk= 2523, nxpk= 0, iat= 769, 887, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#   1117  ARG     HA        1154  VAL     H         6.05   (#peak     2530  #SUP      0.72  #QF         0.72
)
 &rst
  ixpk= 2530, nxpk= 0, iat= 413,1011, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1135  ASN     H         1136  SER     HA       5.786   (#peak     2531  #SUP      0.92  #QF         0.92
)
 &rst
  ixpk= 2531, nxpk= 0, iat= 716, 732, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,  &end
#
#   1106  PRO     HA        1141  PHE     HZ        6.05   (#peak     2534  #SUP      0.99  #QF         0.99
)
 &rst
  ixpk= 2534, nxpk= 0, iat= 253, 807, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1096  TYR     HA        1096  TYR     QE        5.17   (#peak     2535  #SUP      0.84  #QF         0.84
)
 &rst
  ixpk= 2535, nxpk= 0, iat=  94,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 102, 107,
 &end
#
#   1096  TYR     HA        1164  TRP     HZ3      5.137   (#peak     2536  #SUP      0.85  #QF         0.85
)
 &rst
  ixpk= 2536, nxpk= 0, iat=  94,1192, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1094  ILE     HA        1096  TYR     QE        6.05   (#peak     2538  #SUP      0.99  #QF         0.84
)
 &rst
  ixpk= 2538, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 102, 107,
 &end
#
#   1096  TYR     QE        1168  LYS     HA        6.05   (#peak     2538  #SUP      0.99  #QF         0.84
)
 &rst
  ixpk= 2538, nxpk= 0, iat=  -1,1257, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 102, 107,
 &end
#
#   1115  PRO     HD2       1158  LYS     H        5.247   (#peak     2539  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2539, nxpk= 0, iat= 382,1075, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#   1136  SER     H         1137  PRO     HD3      5.335   (#peak     2540  #SUP       1
)
 &rst
  ixpk= 2540, nxpk= 0, iat= 730, 743, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#   1105  ASP     QB        1141  PHE     HZ       5.654   (#peak     2548  #SUP      0.29  #QF         0.29
)
 &rst
  ixpk= 2548, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1= 235, 236,
 &end
#
#   1100  PRO     HG2       1103  PHE     QE       5.291   (#peak     2551  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2551, nxpk= 0, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 197, 201,
 &end
#
#   1164  TRP     HE3       1168  LYS     HG3       5.28   (#peak     2553  #SUP      0.44  #QF         0.44
)
 &rst
  ixpk= 2553, nxpk= 0, iat=1194,1263, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#   1139  ASP     H         1146  LEU     HB2      5.137   (#peak     2584  #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 2584, nxpk= 0, iat= 769, 891, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#   1146  LEU     H         1146  LEU     HG       5.588   (#peak     2597  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 2597, nxpk= 0, iat= 887, 894, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
#   1100  PRO     HB2       1103  PHE     QE        6.05   (#peak     2606  #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 2606, nxpk= 0, iat= 153,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 197, 201,
 &end
#
#   1110  THR     H         1128  ILE     QD1       6.05   (#peak     2606  #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 2606, nxpk= 0, iat= 305,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr2= 593, 594, 595,
 &end
#
#   1096  TYR     QE        1099  ALA     QB        6.05   (#peak     2608  #SUP      0.96  #QF         0.96
)
 &rst
  ixpk= 2608, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
 igr1= 102, 107,
 igr2= 140, 141, 142,
 &end
#
#   1103  PHE     QE        1160  GLN     HB2      5.005   (#peak     2611  #SUP      0.98  #QF         0.98
)
 &rst
  ixpk= 2611, nxpk= 0, iat=  -1,1116, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1= 197, 201,
 &end
#
#   1104  ARG     QD        1109  ASP     HA        6.05   (#peak     2615  #SUP      0.95  #QF         0.95
)
 &rst
  ixpk= 2615, nxpk= 0, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 217, 218,
 &end
#
#   1117  ARG     HA        1118  LEU     HB2      5.269   (#peak     2617  #SUP      0.93  #QF         0.93
)
 &rst
  ixpk= 2617, nxpk= 0, iat= 413, 439, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#   1138  THR     HA        1146  LEU     HB2      5.181   (#peak     2618  #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 2618, nxpk= 0, iat= 757, 891, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#   1138  THR     HA        1146  LEU     HB3      5.181   (#peak     2619  #SUP      0.6   #QF          0.6
)
 &rst
  ixpk= 2619, nxpk= 0, iat= 757, 892, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#   1116  VAL     QG2       1152  GLU     H        5.181   (#peak     2625  #SUP      0.58  #QF         0.58
)
 &rst
  ixpk= 2625, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 405, 406, 407,
 &end
#
#   1117  ARG     HA        1154  VAL     QG1      5.698   (#peak     2630  #SUP      0.99  #QF         0.98
)
 &rst
  ixpk= 2630, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr2=1017,1018,1019,
 &end
#
#   1123  VAL     QG1       1124  MET     HA       4.884   (#peak     2631  #SUP      0.96  #QF         0.21
)
 &rst
  ixpk= 2631, nxpk= 0, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 506, 507, 508,
 &end
#
#   1094  ILE     HG12      1169  GLN     HA       5.291   (#peak     2632  #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 2632, nxpk= 0, iat=  71,1279, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#   1151  LEU     HB3       1152  GLU     HA        6.05   (#peak     2633  #SUP      0.73  #QF         0.56
)
 &rst
  ixpk= 2633, nxpk= 0, iat= 968, 984, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1140  PRO     HD2       1141  PHE     QE        6.05   (#peak     2634  #SUP       1
)
 &rst
  ixpk= 2634, nxpk= 0, iat= 782,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr2= 805, 809,
 &end
#
#   1129  ILE     H         1130  LEU     HG       5.742   (#peak     2635  #SUP      0.9   #QF          0.9
)
 &rst
  ixpk= 2635, nxpk= 0, iat= 599, 625, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   1138  THR     HA        1145  MET     HA       5.346   (#peak     2641  #SUP      0.66  #QF         0.66
)
 &rst
  ixpk= 2641, nxpk= 0, iat= 757, 872, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,  &end
#
#   1129  ILE     HA        1132  HIS     HB2      4.378   (#peak     2645  #SUP      0.97  #QF         0.97
)
 &rst
  ixpk= 2645, nxpk= 0, iat= 601, 665, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#   1106  PRO     HD2       1124  MET     HA       5.918   (#peak     2646  #SUP      0.85  #QF         0.39
)
 &rst
  ixpk= 2646, nxpk= 0, iat= 244, 518, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,  &end
#
#   1124  MET     HA        1125  ASP     HA        6.05   (#peak     2646  #SUP      0.85  #QF         0.39
)
 &rst
  ixpk= 2646, nxpk= 0, iat= 518, 535, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#   1103  PHE     QD        1164  TRP     HB2      5.643   (#peak     2647  #SUP       1
)
 &rst
  ixpk= 2647, nxpk= 0, iat=  -1,1179, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 195, 203,
 &end
#
#   1096  TYR     QD        1168  LYS     H         6.05   (#peak     2649  #SUP      0.6   #QF          0.6
)
 &rst
  ixpk= 2649, nxpk= 0, iat=  -1,1255, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 100, 109,
 &end
#
#   1161  ILE     HA        1165  MET     H         5.39   (#peak     2650  #SUP      0.94  #QF         0.94
)
 &rst
  ixpk= 2650, nxpk= 0, iat=1131,1199, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#   1106  PRO     HD3       1124  MET     HA       5.918   (#peak     2651  #SUP      0.56  #QF         0.56
)
 &rst
  ixpk= 2651, nxpk= 0, iat= 245, 518, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,  &end
#
#   1092  ALA     HA        1093  GLU     QB       5.874   (#peak     1234
)
 &rst
  ixpk= 1234, nxpk= 0, iat=  38,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2=  50,  51,
 &end
#
#   1093  GLU     H         1093  GLU     QB       3.883   (#peak     1162
)
 &rst
  ixpk= 1162, nxpk= 0, iat=  46,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2=  50,  51,
 &end
#
#   1093  GLU     QB        1094  ILE     H        3.773   (#peak     200
)
 &rst
  ixpk= 200, nxpk= 0, iat=  -1,  61, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  50,  51,
 &end
#
#   1093  GLU     QB        1094  ILE     HB        4.73   (#peak     965
)
 &rst
  ixpk= 965, nxpk= 0, iat=  -1,  65, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=  50,  51,
 &end
#
#   1093  GLU     QB        1094  ILE     QG2      5.874   (#peak     1347
)
 &rst
  ixpk= 1347, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.92, r4= 8.42,
 igr1=  50,  51,
 igr2=  67,  68,  69,
 &end
#
#   1093  GLU     QB        1096  TYR     QD       5.401   (#peak     208
)
 &rst
  ixpk= 208, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=  50,  51,
 igr2= 100, 109,
 &end
#
#   1093  GLU     QB        1096  TYR     QE       4.312   (#peak     1709
)
 &rst
  ixpk= 1709, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=  50,  51,
 igr2= 102, 107,
 &end
#
#   1094  ILE     H         1094  ILE     QG1       3.52   (#peak     270
)
 &rst
  ixpk= 270, nxpk= 0, iat=  61,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2=  71,  72,
 &end
#
#   1094  ILE     HA        1094  ILE     QG1      4.103   (#peak     367
)
 &rst
  ixpk= 367, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2=  71,  72,
 &end
#
#   1094  ILE     HA        1095  ASP     QB       5.302   (#peak     1208
)
 &rst
  ixpk= 1208, nxpk= 0, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
 igr2=  84,  85,
 &end
#
#   1094  ILE     QG2       1095  ASP     QB       4.532   (#peak     1348
)
 &rst
  ixpk= 1348, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=  67,  68,  69,
 igr2=  84,  85,
 &end
#
#   1094  ILE     QG1       1095  ASP     H        4.972   (#peak     592
)
 &rst
  ixpk= 592, nxpk= 0, iat=  -1,  80, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=  71,  72,
 &end
#
#   1094  ILE     QG1       1168  LYS     HB2      4.576   (#peak     1291
)
 &rst
  ixpk= 1291, nxpk= 0, iat=  -1,1259, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1=  71,  72,
 &end
#
#   1094  ILE     QG1       1169  GLN     HA        4.62   (#peak     1888
)
 &rst
  ixpk= 1888, nxpk= 0, iat=  -1,1279, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1=  71,  72,
 &end
#
#   1094  ILE     QD1       1169  GLN     QB       5.687   (#peak     1271
)
 &rst
  ixpk= 1271, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
 igr1=  74,  75,  76,
 igr2=1281,1282,
 &end
#
#   1095  ASP     H         1095  ASP     QB       3.212   (#peak     236
)
 &rst
  ixpk= 236, nxpk= 0, iat=  80,  -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
 igr2=  84,  85,
 &end
#
#   1095  ASP     QB        1096  TYR     H         4.4    (#peak     203
)
 &rst
  ixpk= 203, nxpk= 0, iat=  -1,  92, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=  84,  85,
 &end
#
#   1095  ASP     QB        1097  SER     H        5.214   (#peak     706
)
 &rst
  ixpk= 706, nxpk= 0, iat=  -1, 113, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
 igr1=  84,  85,
 &end
#
#   1096  TYR     QD        1111  LEU     QB       5.126   (#peak     2115
)
 &rst
  ixpk= 2115, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
 igr1= 100, 109,
 igr2= 323, 324,
 &end
#
#   1098  ASP     H         1098  ASP     QB       3.608   (#peak     150
)
 &rst
  ixpk= 150, nxpk= 0, iat= 124,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2= 128, 129,
 &end
#
#   1098  ASP     QB        1099  ALA     H        4.213   (#peak     254
)
 &rst
  ixpk= 254, nxpk= 0, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1= 128, 129,
 &end
#
#   1098  ASP     QB        1164  TRP     HZ2       4.29   (#peak      82
)
 &rst
  ixpk= 82, nxpk= 0, iat=  -1,1188, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 128, 129,
 &end
#
#   1101  ASP     H         1101  ASP     QB       3.168   (#peak     262
)
 &rst
  ixpk= 262, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
 igr2= 164, 165,
 &end
#
#   1101  ASP     QB        1102  GLU     H        3.729   (#peak      56
)
 &rst
  ixpk= 56, nxpk= 0, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 164, 165,
 &end
#
#   1101  ASP     QB        1103  PHE     H        5.852   (#peak     1597
)
 &rst
  ixpk= 1597, nxpk= 0, iat=  -1, 187, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 164, 165,
 &end
#
#   1103  PHE     QD        1157  LEU     QQD      4.037   (#peak     843
)
 &rst
  ixpk= 843, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 195, 203,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1103  PHE     QE        1157  LEU     QQD      3.674   (#peak     1695
)
 &rst
  ixpk= 1695, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 197, 201,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1103  PHE     HZ        1157  LEU     QQD      5.379   (#peak     291
)
 &rst
  ixpk= 291, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1103  PHE     HZ        1160  GLN     QG       5.137   (#peak     1985
)
 &rst
  ixpk= 1985, nxpk= 0, iat= 199,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr2=1119,1120,
 &end
#
#   1104  ARG     QG        1111  LEU     QB       4.906   (#peak     178
)
 &rst
  ixpk= 178, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1= 214, 215,
 igr2= 323, 324,
 &end
#
#   1105  ASP     H         1106  PRO     QD       5.819   (#peak      92
)
 &rst
  ixpk= 92, nxpk= 0, iat= 231,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr2= 244, 245,
 &end
#
#   1105  ASP     QB        1106  PRO     QD       4.081   (#peak     606
)
 &rst
  ixpk= 606, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 235, 236,
 igr2= 244, 245,
 &end
#
#   1105  ASP     QB        1107  LEU     QQD      5.984   (#peak     2228
)
 &rst
  ixpk= 2228, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.05, r4= 9.55,
 igr1= 235, 236,
 igr2= 266, 267, 268, 270, 271, 272,
 &end
#
#   1106  PRO     QD        1107  LEU     H        4.224   (#peak      81
)
 &rst
  ixpk= 81, nxpk= 0, iat=  -1, 257, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
 igr1= 244, 245,
 &end
#
#   1106  PRO     QD        1124  MET     HA       5.027   (#peak     2651
)
 &rst
  ixpk= 2651, nxpk= 0, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 244, 245,
 &end
#
#   1107  LEU     H         1107  LEU     QB       3.487   (#peak      85
)
 &rst
  ixpk= 85, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr2= 261, 262,
 &end
#
#   1107  LEU     H         1107  LEU     QQD      4.246   (#peak      86
)
 &rst
  ixpk= 86, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 266, 267, 268, 270, 271, 272,
 &end
#
#   1107  LEU     HA        1107  LEU     QQD      3.234   (#peak     815
)
 &rst
  ixpk= 815, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 266, 267, 268, 270, 271, 272,
 &end
#
#   1107  LEU     QB        1108  MET     HB2       5.28   (#peak     1147
)
 &rst
  ixpk= 1147, nxpk= 0, iat=  -1, 280, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 261, 262,
 &end
#
#   1107  LEU     QB        1128  ILE     QG2      3.597   (#peak     1314
)
 &rst
  ixpk= 1314, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 261, 262,
 igr2= 586, 587, 588,
 &end
#
#   1107  LEU     QB        1128  ILE     QD1      3.916   (#peak     1346
)
 &rst
  ixpk= 1346, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 261, 262,
 igr2= 593, 594, 595,
 &end
#
#   1107  LEU     QB        1141  PHE     QE        4.51   (#peak     1635
)
 &rst
  ixpk= 1635, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 261, 262,
 igr2= 805, 809,
 &end
#
#   1107  LEU     QB        1141  PHE     HZ       4.191   (#peak     257
)
 &rst
  ixpk= 257, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 261, 262,
 &end
#
#   1107  LEU     QQD       1108  MET     H        4.796   (#peak      51
)
 &rst
  ixpk= 51, nxpk= 0, iat=  -1, 276, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 266, 267, 268, 270, 271, 272,
 &end
#
#   1107  LEU     QQD       1108  MET     HB2      5.676   (#peak     1275
)
 &rst
  ixpk= 1275, nxpk= 0, iat=  -1, 280, r1= 1.30, r2= 1.80, r3= 7.65, r4= 8.15,
 igr1= 266, 267, 268, 270, 271, 272,
 &end
#
#   1107  LEU     QQD       1108  MET     QG       5.137   (#peak     2439
)
 &rst
  ixpk= 2439, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr1= 266, 267, 268, 270, 271, 272,
 igr2= 283, 284,
 &end
#
#   1107  LEU     QQD       1128  ILE     QG2      4.059   (#peak     471
)
 &rst
  ixpk= 471, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 266, 267, 268, 270, 271, 272,
 igr2= 586, 587, 588,
 &end
#
#   1107  LEU     QQD       1128  ILE     QD1      4.136   (#peak     1381
)
 &rst
  ixpk= 1381, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr1= 266, 267, 268, 270, 271, 272,
 igr2= 593, 594, 595,
 &end
#
#   1107  LEU     QQD       1140  PRO     HB2       4.07   (#peak     1361
)
 &rst
  ixpk= 1361, nxpk= 0, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1= 266, 267, 268, 270, 271, 272,
 &end
#
#   1107  LEU     QQD       1141  PHE     QD        4.84   (#peak     377
)
 &rst
  ixpk= 377, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
 igr1= 266, 267, 268, 270, 271, 272,
 igr2= 803, 811,
 &end
#
#   1107  LEU     QQD       1141  PHE     QE       4.026   (#peak     376
)
 &rst
  ixpk= 376, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1= 266, 267, 268, 270, 271, 272,
 igr2= 805, 809,
 &end
#
#   1107  LEU     QQD       1141  PHE     HZ       3.806   (#peak     378
)
 &rst
  ixpk= 378, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 266, 267, 268, 270, 271, 272,
 &end
#
#   1108  MET     HB2       1128  ILE     QG1      4.675   (#peak     2437
)
 &rst
  ixpk= 2437, nxpk= 0, iat= 280,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 590, 591,
 &end
#
#   1110  THR     HA        1111  LEU     QB       5.874   (#peak     1220
)
 &rst
  ixpk= 1220, nxpk= 0, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 323, 324,
 &end
#
#   1110  THR     QG2       1111  LEU     QB       5.599   (#peak     1285
)
 &rst
  ixpk= 1285, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
 igr1= 311, 312, 313,
 igr2= 323, 324,
 &end
#
#   1111  LEU     QB        1111  LEU     QD2       3.63   (#peak     1344
)
 &rst
  ixpk= 1344, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
 igr1= 323, 324,
 igr2= 332, 333, 334,
 &end
#
#   1111  LEU     QB        1112  MET     H        4.499   (#peak     2073
)
 &rst
  ixpk= 2073, nxpk= 0, iat=  -1, 338, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 323, 324,
 &end
#
#   1111  LEU     QB        1113  THR     QG2      4.675   (#peak     1286
)
 &rst
  ixpk= 1286, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 323, 324,
 igr2= 361, 362, 363,
 &end
#
#   1112  MET     QE        1157  LEU     QQD      4.345   (#peak     1284
)
 &rst
  ixpk= 1284, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
 igr1= 349, 350, 351,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1114  ASP     H         1116  VAL     QQG      5.984   (#peak     750
)
 &rst
  ixpk= 750, nxpk= 0, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr2= 401, 402, 403, 405, 406, 407,
 &end
#
#   1114  ASP     HB3       1126  ARG     QG       4.576   (#peak     1866
)
 &rst
  ixpk= 1866, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 552, 553,
 &end
#
#   1114  ASP     HB3       1126  ARG     QD       5.368   (#peak     2621
)
 &rst
  ixpk= 2621, nxpk= 0, iat= 374,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2= 555, 556,
 &end
#
#   1115  PRO     HA        1116  VAL     QQG       4.29   (#peak     525
)
 &rst
  ixpk= 525, nxpk= 0, iat= 391,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr2= 401, 402, 403, 405, 406, 407,
 &end
#
#   1115  PRO     HD2       1158  LYS     QG       4.433   (#peak     1120
)
 &rst
  ixpk= 1120, nxpk= 0, iat= 382,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2=1082,1083,
 &end
#
#   1116  VAL     H         1116  VAL     QQG      3.223   (#peak      25
)
 &rst
  ixpk= 25, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     H         1154  VAL     QQG      5.467   (#peak     325
)
 &rst
  ixpk= 325, nxpk= 0, iat= 395,  -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1116  VAL     QQG       1117  ARG     H        3.586   (#peak     1019
)
 &rst
  ixpk= 1019, nxpk= 0, iat=  -1, 411, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1117  ARG     HB2      5.071   (#peak     889
)
 &rst
  ixpk= 889, nxpk= 0, iat=  -1, 415, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1126  ARG     H        3.674   (#peak     116
)
 &rst
  ixpk= 116, nxpk= 0, iat=  -1, 545, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1126  ARG     HA       3.641   (#peak     710
)
 &rst
  ixpk= 710, nxpk= 0, iat=  -1, 547, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1126  ARG     HB2      3.971   (#peak     1328
)
 &rst
  ixpk= 1328, nxpk= 0, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1126  ARG     QG       4.301   (#peak     890
)
 &rst
  ixpk= 890, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1= 401, 402, 403, 405, 406, 407,
 igr2= 552, 553,
 &end
#
#   1116  VAL     QQG       1126  ARG     QD       5.104   (#peak     2424
)
 &rst
  ixpk= 2424, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
 igr1= 401, 402, 403, 405, 406, 407,
 igr2= 555, 556,
 &end
#
#   1116  VAL     QQG       1127  SER     H        5.247   (#peak     2076
)
 &rst
  ixpk= 2076, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1129  ILE     H        5.621   (#peak     1343
)
 &rst
  ixpk= 1343, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1129  ILE     HB       5.984   (#peak     1271
)
 &rst
  ixpk= 1271, nxpk= 0, iat=  -1, 603, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1129  ILE     QG2      3.322   (#peak     1390
)
 &rst
  ixpk= 1390, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 401, 402, 403, 405, 406, 407,
 igr2= 605, 606, 607,
 &end
#
#   1116  VAL     QQG       1129  ILE     QG1       5.17   (#peak     889
)
 &rst
  ixpk= 889, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
 igr1= 401, 402, 403, 405, 406, 407,
 igr2= 609, 610,
 &end
#
#   1116  VAL     QQG       1151  LEU     HA       4.059   (#peak     598
)
 &rst
  ixpk= 598, nxpk= 0, iat=  -1, 965, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1151  LEU     HB3      3.784   (#peak     1354
)
 &rst
  ixpk= 1354, nxpk= 0, iat=  -1, 968, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1152  GLU     H         3.85   (#peak     248
)
 &rst
  ixpk= 248, nxpk= 0, iat=  -1, 982, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1153  PRO     HA       3.476   (#peak     544
)
 &rst
  ixpk= 544, nxpk= 0, iat=  -1,1007, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1116  VAL     QQG       1154  VAL     H        4.983   (#peak     365
)
 &rst
  ixpk= 365, nxpk= 0, iat=  -1,1011, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1= 401, 402, 403, 405, 406, 407,
 &end
#
#   1117  ARG     H         1117  ARG     QG       5.082   (#peak     763
)
 &rst
  ixpk= 763, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2= 418, 419,
 &end
#
#   1117  ARG     H         1152  GLU     QB       4.301   (#peak     762
)
 &rst
  ixpk= 762, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2= 986, 987,
 &end
#
#   1117  ARG     H         1154  VAL     QQG      3.608   (#peak     764
)
 &rst
  ixpk= 764, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1117  ARG     HA        1118  LEU     QQD      4.235   (#peak     513
)
 &rst
  ixpk= 513, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr2= 444, 445, 446, 448, 449, 450,
 &end
#
#   1117  ARG     HA        1154  VAL     QQG      4.268   (#peak     513
)
 &rst
  ixpk= 513, nxpk= 0, iat= 413,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1117  ARG     HB2       1154  VAL     QQG       3.41   (#peak     1316
)
 &rst
  ixpk= 1316, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1117  ARG     QG        1118  LEU     H         3.96   (#peak      9
)
 &rst
  ixpk= 9, nxpk= 0, iat=  -1, 435, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 418, 419,
 &end
#
#   1117  ARG     QG        1121  GLY     HA2      5.137   (#peak     2559
)
 &rst
  ixpk= 2559, nxpk= 0, iat=  -1, 481, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 418, 419,
 &end
#
#   1117  ARG     QG        1122  THR     H        5.874   (#peak     771
)
 &rst
  ixpk= 771, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 418, 419,
 &end
#
#   1117  ARG     QG        1154  VAL     QQG      3.729   (#peak     1340
)
 &rst
  ixpk= 1340, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
 igr1= 418, 419,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1117  ARG     QD        1154  VAL     QQG      4.213   (#peak     775
)
 &rst
  ixpk= 775, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
 igr1= 421, 422,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1118  LEU     H         1118  LEU     QQD      3.487   (#peak      10
)
 &rst
  ixpk= 10, nxpk= 0, iat= 435,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 444, 445, 446, 448, 449, 450,
 &end
#
#   1118  LEU     H         1119  PRO     QD       5.885   (#peak      5
)
 &rst
  ixpk= 5, nxpk= 0, iat= 435,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 455, 456,
 &end
#
#   1118  LEU     HA        1118  LEU     QQD      3.707   (#peak     562
)
 &rst
  ixpk= 562, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr2= 444, 445, 446, 448, 449, 450,
 &end
#
#   1118  LEU     HA        1119  PRO     QD       3.531   (#peak     277
)
 &rst
  ixpk= 277, nxpk= 0, iat= 437,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 455, 456,
 &end
#
#   1118  LEU     HB2       1119  PRO     QD       4.664   (#peak     672
)
 &rst
  ixpk= 672, nxpk= 0, iat= 439,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2= 455, 456,
 &end
#
#   1118  LEU     HB3       1119  PRO     QD        3.85   (#peak     662
)
 &rst
  ixpk= 662, nxpk= 0, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 455, 456,
 &end
#
#   1118  LEU     QQD       1119  PRO     QD       4.301   (#peak     676
)
 &rst
  ixpk= 676, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1= 444, 445, 446, 448, 449, 450,
 igr2= 455, 456,
 &end
#
#   1118  LEU     QQD       1120  SER     H        5.643   (#peak     2270
)
 &rst
  ixpk= 2270, nxpk= 0, iat=  -1, 468, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 444, 445, 446, 448, 449, 450,
 &end
#
#   1118  LEU     QQD       1124  MET     HB2      4.312   (#peak     566
)
 &rst
  ixpk= 566, nxpk= 0, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 444, 445, 446, 448, 449, 450,
 &end
#
#   1118  LEU     QQD       1124  MET     HB3      4.191   (#peak     1867
)
 &rst
  ixpk= 1867, nxpk= 0, iat=  -1, 521, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1= 444, 445, 446, 448, 449, 450,
 &end
#
#   1119  PRO     QD        1120  SER     H        3.883   (#peak     504
)
 &rst
  ixpk= 504, nxpk= 0, iat=  -1, 468, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 455, 456,
 &end
#
#   1119  PRO     QD        1146  LEU     QD2      3.311   (#peak     723
)
 &rst
  ixpk= 723, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr1= 455, 456,
 igr2= 900, 901, 902,
 &end
#
#   1119  PRO     QD        1150  MET     HB2      4.675   (#peak     724
)
 &rst
  ixpk= 724, nxpk= 0, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr1= 455, 456,
 &end
#
#   1119  PRO     QD        1150  MET     HB3      4.521   (#peak     728
)
 &rst
  ixpk= 728, nxpk= 0, iat=  -1, 951, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 455, 456,
 &end
#
#   1119  PRO     QD        1151  LEU     QD2      4.499   (#peak     733
)
 &rst
  ixpk= 733, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 455, 456,
 igr2= 976, 977, 978,
 &end
#
#   1123  VAL     QG2       1154  VAL     QQG      3.531   (#peak     1356
)
 &rst
  ixpk= 1356, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1= 510, 511, 512,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1124  MET     H         1154  VAL     QQG      5.984   (#peak     2062
)
 &rst
  ixpk= 2062, nxpk= 0, iat= 516,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1125  ASP     HB2       1128  ILE     QG1      5.258   (#peak     949
)
 &rst
  ixpk= 949, nxpk= 0, iat= 537,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 590, 591,
 &end
#
#   1126  ARG     H         1126  ARG     QD       5.874   (#peak     687
)
 &rst
  ixpk= 687, nxpk= 0, iat= 545,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 555, 556,
 &end
#
#   1126  ARG     HA        1126  ARG     QG       3.982   (#peak     707
)
 &rst
  ixpk= 707, nxpk= 0, iat= 547,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 552, 553,
 &end
#
#   1126  ARG     HA        1126  ARG     QD        5.06   (#peak     1218
)
 &rst
  ixpk= 1218, nxpk= 0, iat= 547,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 555, 556,
 &end
#
#   1126  ARG     HA        1129  ILE     QG1      5.412   (#peak     1882
)
 &rst
  ixpk= 1882, nxpk= 0, iat= 547,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 609, 610,
 &end
#
#   1126  ARG     QG        1127  SER     H        4.697   (#peak     663
)
 &rst
  ixpk= 663, nxpk= 0, iat=  -1, 569, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1= 552, 553,
 &end
#
#   1126  ARG     QG        1129  ILE     QG2      4.015   (#peak     1303
)
 &rst
  ixpk= 1303, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr1= 552, 553,
 igr2= 605, 606, 607,
 &end
#
#   1126  ARG     QG        1130  LEU     HG       4.059   (#peak     485
)
 &rst
  ixpk= 485, nxpk= 0, iat=  -1, 625, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 552, 553,
 &end
#
#   1126  ARG     QG        1130  LEU     QD2      4.147   (#peak     1334
)
 &rst
  ixpk= 1334, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1= 552, 553,
 igr2= 631, 632, 633,
 &end
#
#   1126  ARG     QD        1127  SER     HA        4.84   (#peak     216
)
 &rst
  ixpk= 216, nxpk= 0, iat=  -1, 571, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 555, 556,
 &end
#
#   1126  ARG     QD        1130  LEU     HB3      5.863   (#peak     2510
)
 &rst
  ixpk= 2510, nxpk= 0, iat=  -1, 623, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
 igr1= 555, 556,
 &end
#
#   1126  ARG     QD        1130  LEU     QD2      3.817   (#peak     763
)
 &rst
  ixpk= 763, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1= 555, 556,
 igr2= 631, 632, 633,
 &end
#
#   1127  SER     QB        1128  ILE     QG1      5.082   (#peak     995
)
 &rst
  ixpk= 995, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 573, 574,
 igr2= 590, 591,
 &end
#
#   1128  ILE     H         1128  ILE     QG1      3.454   (#peak     288
)
 &rst
  ixpk= 288, nxpk= 0, iat= 580,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 590, 591,
 &end
#
#   1128  ILE     HA        1128  ILE     QG1      3.806   (#peak     702
)
 &rst
  ixpk= 702, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 590, 591,
 &end
#
#   1128  ILE     HA        1131  ARG     QB       4.323   (#peak     344
)
 &rst
  ixpk= 344, nxpk= 0, iat= 582,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 641, 642,
 &end
#
#   1128  ILE     QG2       1128  ILE     QG1      3.388   (#peak     472
)
 &rst
  ixpk= 472, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 586, 587, 588,
 igr2= 590, 591,
 &end
#
#   1128  ILE     QG1       1129  ILE     H        4.532   (#peak     619
)
 &rst
  ixpk= 619, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 590, 591,
 &end
#
#   1129  ILE     H         1129  ILE     QG1      4.697   (#peak     622
)
 &rst
  ixpk= 622, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2= 609, 610,
 &end
#
#   1129  ILE     QG2       1129  ILE     QG1      3.366   (#peak     1295
)
 &rst
  ixpk= 1295, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr1= 605, 606, 607,
 igr2= 609, 610,
 &end
#
#   1129  ILE     QG1       1130  LEU     H        5.841   (#peak     2084
)
 &rst
  ixpk= 2084, nxpk= 0, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 609, 610,
 &end
#
#   1129  ILE     QG1       1133  LEU     QQD      4.059   (#peak     1333
)
 &rst
  ixpk= 1333, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 609, 610,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1129  ILE     QG1       1146  LEU     QD1       4.51   (#peak     1294
)
 &rst
  ixpk= 1294, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1= 609, 610,
 igr2= 896, 897, 898,
 &end
#
#   1129  ILE     QD1       1133  LEU     QQD      4.708   (#peak     981
)
 &rst
  ixpk= 981, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
 igr1= 612, 613, 614,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1130  LEU     H         1133  LEU     QQD      5.984   (#peak     2589
)
 &rst
  ixpk= 2589, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1130  LEU     HA        1133  LEU     QB       4.103   (#peak     639
)
 &rst
  ixpk= 639, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 682, 683,
 &end
#
#   1130  LEU     HA        1133  LEU     QQD      4.389   (#peak     643
)
 &rst
  ixpk= 643, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1131  ARG     H         1131  ARG     QB       2.926   (#peak     421
)
 &rst
  ixpk= 421, nxpk= 0, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 641, 642,
 &end
#
#   1131  ARG     QB        1131  ARG     QD       3.432   (#peak     224
)
 &rst
  ixpk= 224, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 641, 642,
 igr2= 647, 648,
 &end
#
#   1131  ARG     QB        1132  HIS     H        3.267   (#peak     323
)
 &rst
  ixpk= 323, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
 igr1= 641, 642,
 &end
#
#   1133  LEU     H         1133  LEU     QB       3.454   (#peak     404
)
 &rst
  ixpk= 404, nxpk= 0, iat= 678,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 682, 683,
 &end
#
#   1133  LEU     HA        1133  LEU     QQD      3.311   (#peak     886
)
 &rst
  ixpk= 886, nxpk= 0, iat= 680,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QB        1133  LEU     QQD      3.069   (#peak     1331
)
 &rst
  ixpk= 1331, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr1= 682, 683,
 igr2= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QB        1134  LEU     H        3.685   (#peak     430
)
 &rst
  ixpk= 430, nxpk= 0, iat=  -1, 697, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr1= 682, 683,
 &end
#
#   1133  LEU     QB        1134  LEU     HA       5.225   (#peak     184
)
 &rst
  ixpk= 184, nxpk= 0, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 682, 683,
 &end
#
#   1133  LEU     QB        1136  SER     H        5.874   (#peak     2097
)
 &rst
  ixpk= 2097, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 682, 683,
 &end
#
#   1133  LEU     QQD       1136  SER     H        5.544   (#peak     598
)
 &rst
  ixpk= 598, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1137  PRO     HA        3.41   (#peak     506
)
 &rst
  ixpk= 506, nxpk= 0, iat=  -1, 751, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1137  PRO     QB       5.324   (#peak     1305
)
 &rst
  ixpk= 1305, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
 igr1= 687, 688, 689, 691, 692, 693,
 igr2= 748, 749,
 &end
#
#   1133  LEU     QQD       1138  THR     H        3.652   (#peak     809
)
 &rst
  ixpk= 809, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1138  THR     HA       5.742   (#peak     2633
)
 &rst
  ixpk= 2633, nxpk= 0, iat=  -1, 757, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1146  LEU     H         5.28   (#peak     2594
)
 &rst
  ixpk= 2594, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1146  LEU     HA       5.984   (#peak     2630
)
 &rst
  ixpk= 2630, nxpk= 0, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1146  LEU     QB        4.29   (#peak     1341
)
 &rst
  ixpk= 1341, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 687, 688, 689, 691, 692, 693,
 igr2= 891, 892,
 &end
#
#   1133  LEU     QQD       1148  GLU     H        4.257   (#peak     372
)
 &rst
  ixpk= 372, nxpk= 0, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1133  LEU     QQD       1148  GLU     HA       3.916   (#peak     716
)
 &rst
  ixpk= 716, nxpk= 0, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 687, 688, 689, 691, 692, 693,
 &end
#
#   1134  LEU     H         1134  LEU     QB       3.069   (#peak     429
)
 &rst
  ixpk= 429, nxpk= 0, iat= 697,  -1, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,
 igr2= 701, 702,
 &end
#
#   1134  LEU     H         1134  LEU     QQD       3.96   (#peak     803
)
 &rst
  ixpk= 803, nxpk= 0, iat= 697,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2= 706, 707, 708, 710, 711, 712,
 &end
#
#   1134  LEU     HA        1134  LEU     QQD      4.202   (#peak     1010
)
 &rst
  ixpk= 1010, nxpk= 0, iat= 699,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2= 706, 707, 708, 710, 711, 712,
 &end
#
#   1134  LEU     QB        1135  ASN     H         3.96   (#peak     470
)
 &rst
  ixpk= 470, nxpk= 0, iat=  -1, 716, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 701, 702,
 &end
#
#   1134  LEU     QB        1135  ASN     QB       4.972   (#peak     2186
)
 &rst
  ixpk= 2186, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
 igr1= 701, 702,
 igr2= 720, 721,
 &end
#
#   1134  LEU     QB        1136  SER     H        5.874   (#peak     599
)
 &rst
  ixpk= 599, nxpk= 0, iat=  -1, 730, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 701, 702,
 &end
#
#   1134  LEU     QQD       1135  ASN     H        5.181   (#peak     805
)
 &rst
  ixpk= 805, nxpk= 0, iat=  -1, 716, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
 igr1= 706, 707, 708, 710, 711, 712,
 &end
#
#   1135  ASN     H         1136  SER     QB       5.874   (#peak     804
)
 &rst
  ixpk= 804, nxpk= 0, iat= 716,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 734, 735,
 &end
#
#   1135  ASN     QB        1136  SER     QB        4.73   (#peak     1207
)
 &rst
  ixpk= 1207, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
 igr1= 720, 721,
 igr2= 734, 735,
 &end
#
#   1136  SER     H         1136  SER     QB       3.872   (#peak     462
)
 &rst
  ixpk= 462, nxpk= 0, iat= 730,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 734, 735,
 &end
#
#   1136  SER     QB        1137  PRO     QG       4.213   (#peak     2192
)
 &rst
  ixpk= 2192, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 734, 735,
 igr2= 745, 746,
 &end
#
#   1136  SER     QB        1137  PRO     QD       5.258   (#peak     1376
)
 &rst
  ixpk= 1376, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 734, 735,
 igr2= 742, 743,
 &end
#
#   1136  SER     QB        1138  THR     H        5.181   (#peak     769
)
 &rst
  ixpk= 769, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr1= 734, 735,
 &end
#
#   1137  PRO     HA        1146  LEU     QB       5.511   (#peak     1045
)
 &rst
  ixpk= 1045, nxpk= 0, iat= 751,  -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
 igr2= 891, 892,
 &end
#
#   1137  PRO     QB        1138  THR     H        4.444   (#peak     160
)
 &rst
  ixpk= 160, nxpk= 0, iat=  -1, 755, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr1= 748, 749,
 &end
#
#   1137  PRO     QB        1146  LEU     H        5.082   (#peak     225
)
 &rst
  ixpk= 225, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 748, 749,
 &end
#
#   1138  THR     H         1146  LEU     QB       4.565   (#peak     652
)
 &rst
  ixpk= 652, nxpk= 0, iat= 755,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 891, 892,
 &end
#
#   1138  THR     HA        1146  LEU     QB       4.477   (#peak     2618
)
 &rst
  ixpk= 2618, nxpk= 0, iat= 757,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 891, 892,
 &end
#
#   1138  THR     HB        1143  ARG     QB       5.467   (#peak     235
)
 &rst
  ixpk= 235, nxpk= 0, iat= 759,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2= 833, 834,
 &end
#
#   1138  THR     QG2       1143  ARG     QB       4.202   (#peak     1345
)
 &rst
  ixpk= 1345, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 761, 762, 763,
 igr2= 833, 834,
 &end
#
#   1139  ASP     H         1143  ARG     QB       5.852   (#peak     187
)
 &rst
  ixpk= 187, nxpk= 0, iat= 769,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr2= 833, 834,
 &end
#
#   1139  ASP     H         1146  LEU     QB       4.466   (#peak     2082
)
 &rst
  ixpk= 2082, nxpk= 0, iat= 769,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 891, 892,
 &end
#
#   1139  ASP     HB2       1146  LEU     QB       5.544   (#peak     1250
)
 &rst
  ixpk= 1250, nxpk= 0, iat= 773,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr2= 891, 892,
 &end
#
#   1142  ASN     H         1143  ARG     QB       5.555   (#peak     178
)
 &rst
  ixpk= 178, nxpk= 0, iat= 815,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 833, 834,
 &end
#
#   1142  ASN     QB        1143  ARG     HA       5.346   (#peak     1935
)
 &rst
  ixpk= 1935, nxpk= 0, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr1= 819, 820,
 &end
#
#   1143  ARG     H         1143  ARG     QB       3.883   (#peak     479
)
 &rst
  ixpk= 479, nxpk= 0, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 833, 834,
 &end
#
#   1143  ARG     QB        1143  ARG     QD       3.938   (#peak     225
)
 &rst
  ixpk= 225, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr1= 833, 834,
 igr2= 839, 840,
 &end
#
#   1145  MET     H         1145  MET     QB       2.915   (#peak     565
)
 &rst
  ixpk= 565, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
 igr2= 874, 875,
 &end
#
#   1145  MET     HA        1146  LEU     QB       5.093   (#peak     2164
)
 &rst
  ixpk= 2164, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 891, 892,
 &end
#
#   1145  MET     QB        1146  LEU     H        4.301   (#peak     693
)
 &rst
  ixpk= 693, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 874, 875,
 &end
#
#   1145  MET     QG        1146  LEU     H         5.06   (#peak     2302
)
 &rst
  ixpk= 2302, nxpk= 0, iat=  -1, 887, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1= 877, 878,
 &end
#
#   1146  LEU     H         1146  LEU     QB       3.586   (#peak     227
)
 &rst
  ixpk= 227, nxpk= 0, iat= 887,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr2= 891, 892,
 &end
#
#   1146  LEU     QB        1146  LEU     QD1      3.674   (#peak     1308
)
 &rst
  ixpk= 1308, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 891, 892,
 igr2= 896, 897, 898,
 &end
#
#   1146  LEU     QB        1146  LEU     QD2      3.608   (#peak     1298
)
 &rst
  ixpk= 1298, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr1= 891, 892,
 igr2= 900, 901, 902,
 &end
#
#   1152  GLU     H         1152  GLU     QB       3.476   (#peak     245
)
 &rst
  ixpk= 245, nxpk= 0, iat= 982,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2= 986, 987,
 &end
#
#   1152  GLU     QB        1153  PRO     HD2      4.653   (#peak     697
)
 &rst
  ixpk= 697, nxpk= 0, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 986, 987,
 &end
#
#   1154  VAL     H         1154  VAL     QQG      3.553   (#peak     350
)
 &rst
  ixpk= 350, nxpk= 0, iat=1011,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     HA        1154  VAL     QQG      3.212   (#peak     542
)
 &rst
  ixpk= 542, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
 igr2=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     HA        1155  PRO     QG       4.774   (#peak     539
)
 &rst
  ixpk= 539, nxpk= 0, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
 igr2=1031,1032,
 &end
#
#   1154  VAL     QQG       1155  PRO     HD2       4.51   (#peak     675
)
 &rst
  ixpk= 675, nxpk= 0, iat=  -1,1028, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1156  GLU     H        4.455   (#peak     1447
)
 &rst
  ixpk= 1447, nxpk= 0, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1156  GLU     HA       5.984   (#peak     1887
)
 &rst
  ixpk= 1887, nxpk= 0, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1156  GLU     QG       4.675   (#peak     1144
)
 &rst
  ixpk= 1144, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1017,1018,1019,1021,1022,1023,
 igr2=1048,1049,
 &end
#
#   1154  VAL     QQG       1157  LEU     H        3.157   (#peak     299
)
 &rst
  ixpk= 299, nxpk= 0, iat=  -1,1056, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1157  LEU     HB2      3.509   (#peak     1278
)
 &rst
  ixpk= 1278, nxpk= 0, iat=  -1,1060, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1158  LYS     H        4.191   (#peak     333
)
 &rst
  ixpk= 333, nxpk= 0, iat=  -1,1075, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1159  GLU     H        5.984   (#peak     846
)
 &rst
  ixpk= 846, nxpk= 0, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1017,1018,1019,1021,1022,1023,
 &end
#
#   1154  VAL     QQG       1161  ILE     QD1      5.742   (#peak     914
)
 &rst
  ixpk= 914, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.30, r4= 9.80,
 igr1=1017,1018,1019,1021,1022,1023,
 igr2=1142,1143,1144,
 &end
#
#   1155  PRO     HA        1158  LYS     QG       5.335   (#peak     1209
)
 &rst
  ixpk= 1209, nxpk= 0, iat=1037,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr2=1082,1083,
 &end
#
#   1155  PRO     QB        1156  GLU     H        4.433   (#peak     1114
)
 &rst
  ixpk= 1114, nxpk= 0, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr1=1034,1035,
 &end
#
#   1155  PRO     QB        1158  LYS     HB3      4.609   (#peak     1199
)
 &rst
  ixpk= 1199, nxpk= 0, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
 igr1=1034,1035,
 &end
#
#   1155  PRO     QG        1156  GLU     H        4.191   (#peak     155
)
 &rst
  ixpk= 155, nxpk= 0, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1=1031,1032,
 &end
#
#   1157  LEU     H         1160  GLN     QG       5.588   (#peak     1383
)
 &rst
  ixpk= 1383, nxpk= 0, iat=1056,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr2=1119,1120,
 &end
#
#   1157  LEU     HA        1157  LEU     QQD      3.454   (#peak     887
)
 &rst
  ixpk= 887, nxpk= 0, iat=1058,  -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     HA        1160  GLN     QG       5.126   (#peak     2616
)
 &rst
  ixpk= 2616, nxpk= 0, iat=1058,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2=1119,1120,
 &end
#
#   1157  LEU     HB3       1157  LEU     QQD      3.432   (#peak     1282
)
 &rst
  ixpk= 1282, nxpk= 0, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
 igr2=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1160  GLN     H        5.225   (#peak     315
)
 &rst
  ixpk= 315, nxpk= 0, iat=  -1,1112, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1160  GLN     HA       5.984   (#peak     1217
)
 &rst
  ixpk= 1217, nxpk= 0, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1160  GLN     HB2      3.993   (#peak     1007
)
 &rst
  ixpk= 1007, nxpk= 0, iat=  -1,1116, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1161  ILE     H        5.049   (#peak     2090
)
 &rst
  ixpk= 2090, nxpk= 0, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1161  ILE     HG12      5.17   (#peak     2242
)
 &rst
  ixpk= 2242, nxpk= 0, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr1=1065,1066,1067,1069,1070,1071,
 &end
#
#   1157  LEU     QQD       1161  ILE     QD1      4.224   (#peak     913
)
 &rst
  ixpk= 913, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
 igr1=1065,1066,1067,1069,1070,1071,
 igr2=1142,1143,1144,
 &end
#
#   1158  LYS     H         1160  GLN     QG       5.874   (#peak     876
)
 &rst
  ixpk= 876, nxpk= 0, iat=1075,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2=1119,1120,
 &end
#
#   1158  LYS     HA        1158  LYS     QG       3.751   (#peak     374
)
 &rst
  ixpk= 374, nxpk= 0, iat=1077,  -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
 igr2=1082,1083,
 &end
#
#   1158  LYS     QG        1159  GLU     H        4.598   (#peak     533
)
 &rst
  ixpk= 533, nxpk= 0, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr1=1082,1083,
 &end
#
#   1158  LYS     QG        1159  GLU     HA       4.499   (#peak     638
)
 &rst
  ixpk= 638, nxpk= 0, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1082,1083,
 &end
#
#   1158  LYS     QG        1160  GLN     H        5.874   (#peak     2285
)
 &rst
  ixpk= 2285, nxpk= 0, iat=  -1,1112, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1=1082,1083,
 &end
#
#   1158  LYS     QG        1162  GLN     HG2      4.906   (#peak     1148
)
 &rst
  ixpk= 1148, nxpk= 0, iat=  -1,1155, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=1082,1083,
 &end
#
#   1159  GLU     H         1160  GLN     QG       5.324   (#peak     845
)
 &rst
  ixpk= 845, nxpk= 0, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr2=1119,1120,
 &end
#
#   1160  GLN     H         1160  GLN     QG       3.575   (#peak     311
)
 &rst
  ixpk= 311, nxpk= 0, iat=1112,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=1119,1120,
 &end
#
#   1160  GLN     HA        1160  GLN     QG       3.894   (#peak     819
)
 &rst
  ixpk= 819, nxpk= 0, iat=1114,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2=1119,1120,
 &end
#
#   1167  GLU     H         1167  GLU     QG       4.664   (#peak     125
)
 &rst
  ixpk= 125, nxpk= 0, iat=1240,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1247,1248,
 &end
#
#   1167  GLU     HA        1167  GLU     QG       4.026   (#peak     540
)
 &rst
  ixpk= 540, nxpk= 0, iat=1242,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2=1247,1248,
 &end
#
#   1169  GLN     H         1169  GLN     QB       3.091   (#peak     435
)
 &rst
  ixpk= 435, nxpk= 0, iat=1277,  -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
 igr2=1281,1282,
 &end
#
#   1169  GLN     QB        1170  SER     H        3.927   (#peak     459
)
 &rst
  ixpk= 459, nxpk= 0, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1281,1282,
 &end
# 1344 atoms read from pdb file 01.amb.pdb.
# 1090 GLY PSI:  (1090 GLY N)-(1090 GLY CA)-(1090 GLY C)-(1091 SER N) -30.0  26.0
 &rst     iat =    17,    19,    22,    24,
   r1 = -60.0, r2 = -30.0, r3 =  26.0, r4 =  56.0,
   rk2 =   50.0, rk3 =  50.0,    &end

# 1097 SER PHI:  (1096 TYR C)-(1097 SER N)-(1097 SER CA)-(1097 SER C) -87.0 -27.0
 &rst     iat =   110,   112,   114,   121,
   r1 = -117.0, r2 = -87.0, r3 = -27.0, r4 =   3.0,
 &end

# 1097 SER PSI:  (1097 SER N)-(1097 SER CA)-(1097 SER C)-(1098 ASP N) -61.0   7.0
 &rst     iat =   112,   114,   121,   123,
   r1 = -91.0, r2 = -61.0, r3 =   7.0, r4 =  37.0,
 &end

# 1098 ASP PHI:  (1097 SER C)-(1098 ASP N)-(1098 ASP CA)-(1098 ASP C) -123.0 -71.0
 &rst     iat =   121,   123,   125,   133,
   r1 = -153.0, r2 = -123.0, r3 = -71.0, r4 = -41.0,
 &end

# 1098 ASP PSI:  (1098 ASP N)-(1098 ASP CA)-(1098 ASP C)-(1099 ALA N) -33.0  35.0
 &rst     iat =   123,   125,   133,   135,
   r1 = -63.0, r2 = -33.0, r3 =  35.0, r4 =  65.0,
 &end

# 1099 ALA PHI:  (1098 ASP C)-(1099 ALA N)-(1099 ALA CA)-(1099 ALA C) -100.0 -48.0
 &rst     iat =   133,   135,   137,   143,
   r1 = -130.0, r2 = -100.0, r3 = -48.0, r4 = -18.0,
 &end

# 1099 ALA PSI:  (1099 ALA N)-(1099 ALA CA)-(1099 ALA C)-(1100 PRO N) 108.0 168.0
 &rst     iat =   135,   137,   143,   145,
   r1 =  78.0, r2 = 108.0, r3 = 168.0, r4 = 198.0,
 &end

# 1100 PRO PSI:  (1100 PRO N)-(1100 PRO CA)-(1100 PRO C)-(1101 ASP N) 136.0 156.0
 &rst     iat =   145,   155,   157,   159,
   r1 = 106.0, r2 = 136.0, r3 = 156.0, r4 = 186.0,
 &end

# 1101 ASP PHI:  (1100 PRO C)-(1101 ASP N)-(1101 ASP CA)-(1101 ASP C) -68.0 -40.0
 &rst     iat =   157,   159,   161,   169,
   r1 = -98.0, r2 = -68.0, r3 = -40.0, r4 = -10.0,
 &end

# 1101 ASP PSI:  (1101 ASP N)-(1101 ASP CA)-(1101 ASP C)-(1102 GLU N) -64.0 -12.0
 &rst     iat =   159,   161,   169,   171,
   r1 = -94.0, r2 = -64.0, r3 = -12.0, r4 =  18.0,
 &end

# 1102 GLU PHI:  (1101 ASP C)-(1102 GLU N)-(1102 GLU CA)-(1102 GLU C) -87.0 -43.0
 &rst     iat =   169,   171,   173,   184,
   r1 = -117.0, r2 = -87.0, r3 = -43.0, r4 = -13.0,
 &end

# 1102 GLU PSI:  (1102 GLU N)-(1102 GLU CA)-(1102 GLU C)-(1103 PHE N) -72.0   4.0
 &rst     iat =   171,   173,   184,   186,
   r1 = -102.0, r2 = -72.0, r3 =   4.0, r4 =  34.0,
 &end

# 1104 ARG PHI:  (1103 PHE C)-(1104 ARG N)-(1104 ARG CA)-(1104 ARG C) -147.0 -51.0
 &rst     iat =   204,   206,   208,   228,
   r1 = -177.0, r2 = -147.0, r3 = -51.0, r4 = -21.0,
 &end

# 1104 ARG PSI:  (1104 ARG N)-(1104 ARG CA)-(1104 ARG C)-(1105 ASP N) 114.0 154.0
 &rst     iat =   206,   208,   228,   230,
   r1 =  84.0, r2 = 114.0, r3 = 154.0, r4 = 184.0,
 &end

# 1105 ASP PHI:  (1104 ARG C)-(1105 ASP N)-(1105 ASP CA)-(1105 ASP C) -171.0 -79.0
 &rst     iat =   228,   230,   232,   240,
   r1 = -201.0, r2 = -171.0, r3 = -79.0, r4 = -49.0,
 &end

# 1105 ASP PSI:  (1105 ASP N)-(1105 ASP CA)-(1105 ASP C)-(1106 PRO N)  95.0 191.0
 &rst     iat =   230,   232,   240,   242,
   r1 =  65.0, r2 =  95.0, r3 = 191.0, r4 = 221.0,
 &end

# 1110 THR PHI:  (1109 ASP C)-(1110 THR N)-(1110 THR CA)-(1110 THR C) -183.0 -91.0
 &rst     iat =   302,   304,   306,   316,
   r1 = -213.0, r2 = -183.0, r3 = -91.0, r4 = -61.0,
 &end

# 1110 THR PSI:  (1110 THR N)-(1110 THR CA)-(1110 THR C)-(1111 LEU N) 135.0 191.0
 &rst     iat =   304,   306,   316,   318,
   r1 = 105.0, r2 = 135.0, r3 = 191.0, r4 = 221.0,
 &end

# 1111 LEU PHI:  (1110 THR C)-(1111 LEU N)-(1111 LEU CA)-(1111 LEU C) -89.0 -57.0
 &rst     iat =   316,   318,   320,   335,
   r1 = -119.0, r2 = -89.0, r3 = -57.0, r4 = -27.0,
 &end

# 1111 LEU PSI:  (1111 LEU N)-(1111 LEU CA)-(1111 LEU C)-(1112 MET N)  85.0 149.0
 &rst     iat =   318,   320,   335,   337,
   r1 =  55.0, r2 =  85.0, r3 = 149.0, r4 = 179.0,
 &end

# 1112 MET PHI:  (1111 LEU C)-(1112 MET N)-(1112 MET CA)-(1112 MET C) -106.0 -58.0
 &rst     iat =   335,   337,   339,   352,
   r1 = -136.0, r2 = -106.0, r3 = -58.0, r4 = -28.0,
 &end

# 1112 MET PSI:  (1112 MET N)-(1112 MET CA)-(1112 MET C)-(1113 THR N) -68.0  -8.0
 &rst     iat =   337,   339,   352,   354,
   r1 = -98.0, r2 = -68.0, r3 =  -8.0, r4 =  22.0,
 &end

# 1115 PRO PSI:  (1115 PRO N)-(1115 PRO CA)-(1115 PRO C)-(1116 VAL N) 137.0 155.0
 &rst     iat =   380,   390,   392,   394,
   r1 = 107.0, r2 = 137.0, r3 = 155.0, r4 = 185.0,
 &end

# 1116 VAL PHI:  (1115 PRO C)-(1116 VAL N)-(1116 VAL CA)-(1116 VAL C) -168.0 -100.0
 &rst     iat =   392,   394,   396,   408,
   r1 = -198.0, r2 = -168.0, r3 = -100.0, r4 = -70.0,
 &end

# 1116 VAL PSI:  (1116 VAL N)-(1116 VAL CA)-(1116 VAL C)-(1117 ARG N) 126.0 182.0
 &rst     iat =   394,   396,   408,   410,
   r1 =  96.0, r2 = 126.0, r3 = 182.0, r4 = 212.0,
 &end

# 1117 ARG PHI:  (1116 VAL C)-(1117 ARG N)-(1117 ARG CA)-(1117 ARG C) -159.0 -91.0
 &rst     iat =   408,   410,   412,   432,
   r1 = -189.0, r2 = -159.0, r3 = -91.0, r4 = -61.0,
 &end

# 1117 ARG PSI:  (1117 ARG N)-(1117 ARG CA)-(1117 ARG C)-(1118 LEU N) 103.0 143.0
 &rst     iat =   410,   412,   432,   434,
   r1 =  73.0, r2 = 103.0, r3 = 143.0, r4 = 173.0,
 &end

# 1119 PRO PSI:  (1119 PRO N)-(1119 PRO CA)-(1119 PRO C)-(1120 SER N) -47.0 -23.0
 &rst     iat =   453,   463,   465,   467,
   r1 = -77.0, r2 = -47.0, r3 = -23.0, r4 =   7.0,
 &end

# 1120 SER PHI:  (1119 PRO C)-(1120 SER N)-(1120 SER CA)-(1120 SER C) -125.0 -53.0
 &rst     iat =   465,   467,   469,   476,
   r1 = -155.0, r2 = -125.0, r3 = -53.0, r4 = -23.0,
 &end

# 1120 SER PSI:  (1120 SER N)-(1120 SER CA)-(1120 SER C)-(1121 GLY N) -29.0  11.0
 &rst     iat =   467,   469,   476,   478,
   r1 = -59.0, r2 = -29.0, r3 =  11.0, r4 =  41.0,
 &end

# 1122 THR PHI:  (1121 GLY C)-(1122 THR N)-(1122 THR CA)-(1122 THR C) -106.0 -50.0
 &rst     iat =   483,   485,   487,   497,
   r1 = -136.0, r2 = -106.0, r3 = -50.0, r4 = -20.0,
 &end

# 1122 THR PSI:  (1122 THR N)-(1122 THR CA)-(1122 THR C)-(1123 VAL N) 116.0 148.0
 &rst     iat =   485,   487,   497,   499,
   r1 =  86.0, r2 = 116.0, r3 = 148.0, r4 = 178.0,
 &end

# 1123 VAL PHI:  (1122 THR C)-(1123 VAL N)-(1123 VAL CA)-(1123 VAL C) -143.0 -75.0
 &rst     iat =   497,   499,   501,   513,
   r1 = -173.0, r2 = -143.0, r3 = -75.0, r4 = -45.0,
 &end

# 1123 VAL PSI:  (1123 VAL N)-(1123 VAL CA)-(1123 VAL C)-(1124 MET N)  93.0 185.0
 &rst     iat =   499,   501,   513,   515,
   r1 =  63.0, r2 =  93.0, r3 = 185.0, r4 = 215.0,
 &end

# 1124 MET PHI:  (1123 VAL C)-(1124 MET N)-(1124 MET CA)-(1124 MET C) -151.0 -115.0
 &rst     iat =   513,   515,   517,   530,
   r1 = -181.0, r2 = -151.0, r3 = -115.0, r4 = -85.0,
 &end

# 1124 MET PSI:  (1124 MET N)-(1124 MET CA)-(1124 MET C)-(1125 ASP N) 124.0 176.0
 &rst     iat =   515,   517,   530,   532,
   r1 =  94.0, r2 = 124.0, r3 = 176.0, r4 = 206.0,
 &end

# 1126 ARG PHI:  (1125 ASP C)-(1126 ARG N)-(1126 ARG CA)-(1126 ARG C) -60.0 -44.0
 &rst     iat =   542,   544,   546,   566,
   r1 = -90.0, r2 = -60.0, r3 = -44.0, r4 = -14.0,
 &end

# 1126 ARG PSI:  (1126 ARG N)-(1126 ARG CA)-(1126 ARG C)-(1127 SER N) -66.0 -34.0
 &rst     iat =   544,   546,   566,   568,
   r1 = -96.0, r2 = -66.0, r3 = -34.0, r4 =  -4.0,
 &end

# 1127 SER PHI:  (1126 ARG C)-(1127 SER N)-(1127 SER CA)-(1127 SER C) -70.0 -50.0
 &rst     iat =   566,   568,   570,   577,
   r1 = -100.0, r2 = -70.0, r3 = -50.0, r4 = -20.0,
 &end

# 1127 SER PSI:  (1127 SER N)-(1127 SER CA)-(1127 SER C)-(1128 ILE N) -55.0 -31.0
 &rst     iat =   568,   570,   577,   579,
   r1 = -85.0, r2 = -55.0, r3 = -31.0, r4 =  -1.0,
 &end

# 1128 ILE PHI:  (1127 SER C)-(1128 ILE N)-(1128 ILE CA)-(1128 ILE C) -80.0 -56.0
 &rst     iat =   577,   579,   581,   596,
   r1 = -110.0, r2 = -80.0, r3 = -56.0, r4 = -26.0,
 &end

# 1128 ILE PSI:  (1128 ILE N)-(1128 ILE CA)-(1128 ILE C)-(1129 ILE N) -49.0 -13.0
 &rst     iat =   579,   581,   596,   598,
   r1 = -79.0, r2 = -49.0, r3 = -13.0, r4 =  17.0,
 &end

# 1129 ILE PHI:  (1128 ILE C)-(1129 ILE N)-(1129 ILE CA)-(1129 ILE C) -132.0 -48.0
 &rst     iat =   596,   598,   600,   615,
   r1 = -162.0, r2 = -132.0, r3 = -48.0, r4 = -18.0,
 &end

# 1129 ILE PSI:  (1129 ILE N)-(1129 ILE CA)-(1129 ILE C)-(1130 LEU N) -54.0  38.0
 &rst     iat =   598,   600,   615,   617,
   r1 = -84.0, r2 = -54.0, r3 =  38.0, r4 =  68.0,
 &end

# 1131 ARG PHI:  (1130 LEU C)-(1131 ARG N)-(1131 ARG CA)-(1131 ARG C) -71.0 -55.0
 &rst     iat =   634,   636,   638,   658,
   r1 = -101.0, r2 = -71.0, r3 = -55.0, r4 = -25.0,
 &end

# 1131 ARG PSI:  (1131 ARG N)-(1131 ARG CA)-(1131 ARG C)-(1132 HID N) -50.0 -34.0
 &rst     iat =   636,   638,   658,   660,
   r1 = -80.0, r2 = -50.0, r3 = -34.0, r4 =  -4.0,
 &end

# 1132 HIS PHI:  (1131 ARG C)-(1132 HID N)-(1132 HID CA)-(1132 HID C) -86.0 -46.0
 &rst     iat =   658,   660,   662,   675,
   r1 = -116.0, r2 = -86.0, r3 = -46.0, r4 = -16.0,
 &end

# 1132 HIS PSI:  (1132 HID N)-(1132 HID CA)-(1132 HID C)-(1133 LEU N) -59.0 -31.0
 &rst     iat =   660,   662,   675,   677,
   r1 = -89.0, r2 = -59.0, r3 = -31.0, r4 =  -1.0,
 &end

# 1133 LEU PHI:  (1132 HID C)-(1133 LEU N)-(1133 LEU CA)-(1133 LEU C) -64.0 -56.0
 &rst     iat =   675,   677,   679,   694,
   r1 = -94.0, r2 = -64.0, r3 = -56.0, r4 = -26.0,
 &end

# 1133 LEU PSI:  (1133 LEU N)-(1133 LEU CA)-(1133 LEU C)-(1134 LEU N) -49.0 -37.0
 &rst     iat =   677,   679,   694,   696,
   r1 = -79.0, r2 = -49.0, r3 = -37.0, r4 =  -7.0,
 &end

# 1134 LEU PHI:  (1133 LEU C)-(1134 LEU N)-(1134 LEU CA)-(1134 LEU C) -77.0 -49.0
 &rst     iat =   694,   696,   698,   713,
   r1 = -107.0, r2 = -77.0, r3 = -49.0, r4 = -19.0,
 &end

# 1134 LEU PSI:  (1134 LEU N)-(1134 LEU CA)-(1134 LEU C)-(1135 ASN N) -70.0 -18.0
 &rst     iat =   696,   698,   713,   715,
   r1 = -100.0, r2 = -70.0, r3 = -18.0, r4 =  12.0,
 &end

# 1135 ASN PHI:  (1134 LEU C)-(1135 ASN N)-(1135 ASN CA)-(1135 ASN C) -110.0 -42.0
 &rst     iat =   713,   715,   717,   727,
   r1 = -140.0, r2 = -110.0, r3 = -42.0, r4 = -12.0,
 &end

# 1135 ASN PSI:  (1135 ASN N)-(1135 ASN CA)-(1135 ASN C)-(1136 SER N) -80.0  32.0
 &rst     iat =   715,   717,   727,   729,
   r1 = -110.0, r2 = -80.0, r3 =  32.0, r4 =  62.0,
 &end

# 1138 THR PHI:  (1137 PRO C)-(1138 THR N)-(1138 THR CA)-(1138 THR C) -174.0 -78.0
 &rst     iat =   752,   754,   756,   766,
   r1 = -204.0, r2 = -174.0, r3 = -78.0, r4 = -48.0,
 &end

# 1138 THR PSI:  (1138 THR N)-(1138 THR CA)-(1138 THR C)-(1139 ASP N) 133.0 173.0
 &rst     iat =   754,   756,   766,   768,
   r1 = 103.0, r2 = 133.0, r3 = 173.0, r4 = 203.0,
 &end

# 1139 ASP PHI:  (1138 THR C)-(1139 ASP N)-(1139 ASP CA)-(1139 ASP C) -176.0 -52.0
 &rst     iat =   766,   768,   770,   778,
   r1 = -206.0, r2 = -176.0, r3 = -52.0, r4 = -22.0,
 &end

# 1139 ASP PSI:  (1139 ASP N)-(1139 ASP CA)-(1139 ASP C)-(1140 PRO N)  88.0 192.0
 &rst     iat =   768,   770,   778,   780,
   r1 =  58.0, r2 =  88.0, r3 = 192.0, r4 = 222.0,
 &end

# 1140 PRO PSI:  (1140 PRO N)-(1140 PRO CA)-(1140 PRO C)-(1141 PHE N) -31.0 -11.0
 &rst     iat =   780,   790,   792,   794,
   r1 = -61.0, r2 = -31.0, r3 = -11.0, r4 =  19.0,
 &end

# 1142 ASN PSI:  (1142 ASN N)-(1142 ASN CA)-(1142 ASN C)-(1143 ARG N) -33.0  43.0
 &rst     iat =   814,   816,   826,   828,
   r1 = -63.0, r2 = -33.0, r3 =  43.0, r4 =  73.0,
 &end

# 1145 MET PHI:  (1144 GLN C)-(1145 MET N)-(1145 MET CA)-(1145 MET C) -160.0 -44.0
 &rst     iat =   867,   869,   871,   884,
   r1 = -190.0, r2 = -160.0, r3 = -44.0, r4 = -14.0,
 &end

# 1145 MET PSI:  (1145 MET N)-(1145 MET CA)-(1145 MET C)-(1146 LEU N)  60.0 172.0
 &rst     iat =   869,   871,   884,   886,
   r1 =  30.0, r2 =  60.0, r3 = 172.0, r4 = 202.0,
 &end

# 1147 THR PSI:  (1147 THR N)-(1147 THR CA)-(1147 THR C)-(1148 GLU N) 152.0 184.0
 &rst     iat =   905,   907,   917,   919,
   r1 = 122.0, r2 = 152.0, r3 = 184.0, r4 = 214.0,
 &end

# 1148 GLU PHI:  (1147 THR C)-(1148 GLU N)-(1148 GLU CA)-(1148 GLU C) -68.0 -48.0
 &rst     iat =   917,   919,   921,   932,
   r1 = -98.0, r2 = -68.0, r3 = -48.0, r4 = -18.0,
 &end

# 1148 GLU PSI:  (1148 GLU N)-(1148 GLU CA)-(1148 GLU C)-(1149 SER N) -55.0 -23.0
 &rst     iat =   919,   921,   932,   934,
   r1 = -85.0, r2 = -55.0, r3 = -23.0, r4 =   7.0,
 &end

# 1149 SER PHI:  (1148 GLU C)-(1149 SER N)-(1149 SER CA)-(1149 SER C) -76.0 -48.0
 &rst     iat =   932,   934,   936,   943,
   r1 = -106.0, r2 = -76.0, r3 = -48.0, r4 = -18.0,
 &end

# 1152 GLU PHI:  (1151 LEU C)-(1152 GLU N)-(1152 GLU CA)-(1152 GLU C) -173.0 -57.0
 &rst     iat =   979,   981,   983,   994,
   r1 = -203.0, r2 = -173.0, r3 = -57.0, r4 = -27.0,
 &end

# 1152 GLU PSI:  (1152 GLU N)-(1152 GLU CA)-(1152 GLU C)-(1153 PRO N)  80.0 180.0
 &rst     iat =   981,   983,   994,   996,
   r1 =  50.0, r2 =  80.0, r3 = 180.0, r4 = 210.0,
 &end

# 1155 PRO PSI:  (1155 PRO N)-(1155 PRO CA)-(1155 PRO C)-(1156 GLU N) -47.0 -33.0
 &rst     iat =  1026,  1036,  1038,  1040,
   r1 = -77.0, r2 = -47.0, r3 = -33.0, r4 =  -3.0,
 &end

# 1156 GLU PHI:  (1155 PRO C)-(1156 GLU N)-(1156 GLU CA)-(1156 GLU C) -75.0 -55.0
 &rst     iat =  1038,  1040,  1042,  1053,
   r1 = -105.0, r2 = -75.0, r3 = -55.0, r4 = -25.0,
 &end

# 1156 GLU PSI:  (1156 GLU N)-(1156 GLU CA)-(1156 GLU C)-(1157 LEU N) -53.0 -17.0
 &rst     iat =  1040,  1042,  1053,  1055,
   r1 = -83.0, r2 = -53.0, r3 = -17.0, r4 =  13.0,
 &end

# 1157 LEU PSI:  (1157 LEU N)-(1157 LEU CA)-(1157 LEU C)-(1158 LYS N) -46.0 -30.0
 &rst     iat =  1055,  1057,  1072,  1074,
   r1 = -76.0, r2 = -46.0, r3 = -30.0, r4 =   0.0,
 &end

# 1158 LYS PHI:  (1157 LEU C)-(1158 LYS N)-(1158 LYS CA)-(1158 LYS C) -80.0 -36.0
 &rst     iat =  1072,  1074,  1076,  1094,
   r1 = -110.0, r2 = -80.0, r3 = -36.0, r4 =  -6.0,
 &end

# 1158 LYS PSI:  (1158 LYS N)-(1158 LYS CA)-(1158 LYS C)-(1159 GLU N) -68.0 -20.0
 &rst     iat =  1074,  1076,  1094,  1096,
   r1 = -98.0, r2 = -68.0, r3 = -20.0, r4 =  10.0,
 &end

# 1159 GLU PHI:  (1158 LYS C)-(1159 GLU N)-(1159 GLU CA)-(1159 GLU C) -70.0 -58.0
 &rst     iat =  1094,  1096,  1098,  1109,
   r1 = -100.0, r2 = -70.0, r3 = -58.0, r4 = -28.0,
 &end

# 1159 GLU PSI:  (1159 GLU N)-(1159 GLU CA)-(1159 GLU C)-(1160 GLN N) -55.0 -19.0
 &rst     iat =  1096,  1098,  1109,  1111,
   r1 = -85.0, r2 = -55.0, r3 = -19.0, r4 =  11.0,
 &end

# 1160 GLN PHI:  (1159 GLU C)-(1160 GLN N)-(1160 GLN CA)-(1160 GLN C) -72.0 -56.0
 &rst     iat =  1109,  1111,  1113,  1126,
   r1 = -102.0, r2 = -72.0, r3 = -56.0, r4 = -26.0,
 &end

# 1160 GLN PSI:  (1160 GLN N)-(1160 GLN CA)-(1160 GLN C)-(1161 ILE N) -55.0 -27.0
 &rst     iat =  1111,  1113,  1126,  1128,
   r1 = -85.0, r2 = -55.0, r3 = -27.0, r4 =   3.0,
 &end

# 1161 ILE PHI:  (1160 GLN C)-(1161 ILE N)-(1161 ILE CA)-(1161 ILE C) -73.0 -57.0
 &rst     iat =  1126,  1128,  1130,  1145,
   r1 = -103.0, r2 = -73.0, r3 = -57.0, r4 = -27.0,
 &end

# 1161 ILE PSI:  (1161 ILE N)-(1161 ILE CA)-(1161 ILE C)-(1162 GLN N) -53.0 -33.0
 &rst     iat =  1128,  1130,  1145,  1147,
   r1 = -83.0, r2 = -53.0, r3 = -33.0, r4 =  -3.0,
 &end

# 1162 GLN PHI:  (1161 ILE C)-(1162 GLN N)-(1162 GLN CA)-(1162 GLN C) -74.0 -54.0
 &rst     iat =  1145,  1147,  1149,  1162,
   r1 = -104.0, r2 = -74.0, r3 = -54.0, r4 = -24.0,
 &end

# 1162 GLN PSI:  (1162 GLN N)-(1162 GLN CA)-(1162 GLN C)-(1163 ALA N) -53.0 -33.0
 &rst     iat =  1147,  1149,  1162,  1164,
   r1 = -83.0, r2 = -53.0, r3 = -33.0, r4 =  -3.0,
 &end

# 1163 ALA PHI:  (1162 GLN C)-(1163 ALA N)-(1163 ALA CA)-(1163 ALA C) -70.0 -58.0
 &rst     iat =  1162,  1164,  1166,  1172,
   r1 = -100.0, r2 = -70.0, r3 = -58.0, r4 = -28.0,
 &end

# 1163 ALA PSI:  (1163 ALA N)-(1163 ALA CA)-(1163 ALA C)-(1164 TRP N) -49.0 -29.0
 &rst     iat =  1164,  1166,  1172,  1174,
   r1 = -79.0, r2 = -49.0, r3 = -29.0, r4 =   1.0,
 &end

# 1164 TRP PHI:  (1163 ALA C)-(1164 TRP N)-(1164 TRP CA)-(1164 TRP C) -73.0 -57.0
 &rst     iat =  1172,  1174,  1176,  1196,
   r1 = -103.0, r2 = -73.0, r3 = -57.0, r4 = -27.0,
 &end

# 1164 TRP PSI:  (1164 TRP N)-(1164 TRP CA)-(1164 TRP C)-(1165 MET N) -50.0 -38.0
 &rst     iat =  1174,  1176,  1196,  1198,
   r1 = -80.0, r2 = -50.0, r3 = -38.0, r4 =  -8.0,
 &end

# 1165 MET PHI:  (1164 TRP C)-(1165 MET N)-(1165 MET CA)-(1165 MET C) -68.0 -56.0
 &rst     iat =  1196,  1198,  1200,  1213,
   r1 = -98.0, r2 = -68.0, r3 = -56.0, r4 = -26.0,
 &end

# 1165 MET PSI:  (1165 MET N)-(1165 MET CA)-(1165 MET C)-(1166 ARG N) -52.0 -36.0
 &rst     iat =  1198,  1200,  1213,  1215,
   r1 = -82.0, r2 = -52.0, r3 = -36.0, r4 =  -6.0,
 &end

# 1166 ARG PHI:  (1165 MET C)-(1166 ARG N)-(1166 ARG CA)-(1166 ARG C) -72.0 -56.0
 &rst     iat =  1213,  1215,  1217,  1237,
   r1 = -102.0, r2 = -72.0, r3 = -56.0, r4 = -26.0,
 &end

# 1166 ARG PSI:  (1166 ARG N)-(1166 ARG CA)-(1166 ARG C)-(1167 GLU N) -48.0 -32.0
 &rst     iat =  1215,  1217,  1237,  1239,
   r1 = -78.0, r2 = -48.0, r3 = -32.0, r4 =  -2.0,
 &end

# 1169 GLN PHI:  (1168 LYS C)-(1169 GLN N)-(1169 GLN CA)-(1169 GLN C) -105.0 -49.0
 &rst     iat =  1274,  1276,  1278,  1291,
   r1 = -135.0, r2 = -105.0, r3 = -49.0, r4 = -19.0,
 &end

# 1169 GLN PSI:  (1169 GLN N)-(1169 GLN CA)-(1169 GLN C)-(1170 SER N) -53.0   3.0
 &rst     iat =  1276,  1278,  1291,  1293,
   r1 = -83.0, r2 = -53.0, r3 =   3.0, r4 =  33.0,
 &end

1090 GLY PSI -30 26
1097 SER PHI -87 -27
1097 SER PSI -61 7
1098 ASP PHI -123 -71
1098 ASP PSI -33 35
1099 ALA PHI -100 -48
1099 ALA PSI 108 168
1100 PRO PSI 136 156
1101 ASP PHI -68 -40
1101 ASP PSI -64 -12
1102 GLU PHI -87 -43
1102 GLU PSI -72 4
1104 ARG PHI -147 -51
1104 ARG PSI 114 154
1105 ASP PHI -171 -79
1105 ASP PSI 95 191
1110 THR PHI -183 -91
1110 THR PSI 135 191
1111 LEU PHI -89 -57
1111 LEU PSI 85 149
1112 MET PHI -106 -58
1112 MET PSI -68 -8
1115 PRO PSI 137 155
1116 VAL PHI -168 -100
1116 VAL PSI 126 182
1117 ARG PHI -159 -91
1117 ARG PSI 103 143
1119 PRO PSI -47 -23
1120 SER PHI -125 -53
1120 SER PSI -29 11
1122 THR PHI -106 -50
1122 THR PSI 116 148
1123 VAL PHI -143 -75
1123 VAL PSI 93 185
1124 MET PHI -151 -115
1124 MET PSI 124 176
1126 ARG PHI -60 -44
1126 ARG PSI -66 -34
1127 SER PHI -70 -50
1127 SER PSI -55 -31
1128 ILE PHI -80 -56
1128 ILE PSI -49 -13
1129 ILE PHI -132 -48
1129 ILE PSI -54 38
1131 ARG PHI -71 -55
1131 ARG PSI -50 -34
1132 HIS PHI -86 -46
1132 HIS PSI -59 -31
1133 LEU PHI -64 -56
1133 LEU PSI -49 -37
1134 LEU PHI -77 -49
1134 LEU PSI -70 -18
1135 ASN PHI -110 -42
1135 ASN PSI -80 32
1138 THR PHI -174 -78
1138 THR PSI 133 173
1139 ASP PHI -176 -52
1139 ASP PSI 88 192
1140 PRO PSI -31 -11
1142 ASN PSI -33 43
1145 MET PHI -160 -44
1145 MET PSI 60 172
1147 THR PSI 152 184
1148 GLU PHI -68 -48
1148 GLU PSI -55 -23
1149 SER PHI -76 -48
1152 GLU PHI -173 -57
1152 GLU PSI 80 180
1155 PRO PSI -47 -33
1156 GLU PHI -75 -55
1156 GLU PSI -53 -17
1157 LEU PSI -46 -30
1158 LYS PHI -80 -36
1158 LYS PSI -68 -20
1159 GLU PHI -70 -58
1159 GLU PSI -55 -19
1160 GLN PHI -72 -56
1160 GLN PSI -55 -27
1161 ILE PHI -73 -57
1161 ILE PSI -53 -33
1162 GLN PHI -74 -54
1162 GLN PSI -53 -33
1163 ALA PHI -70 -58
1163 ALA PSI -49 -29
1164 TRP PHI -73 -57
1164 TRP PSI -50 -38
1165 MET PHI -68 -56
1165 MET PSI -52 -36
1166 ARG PHI -72 -56
1166 ARG PSI -48 -32
1169 GLN PHI -105 -49
1169    GLN     PSI     -53     3

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H2   PRO   1           H2       PRO   1  -3.687  -5.143  -2.388
    2    H3   PRO   1           H3       PRO   1  -5.091  -4.472  -1.829
    3    HA   PRO   1           HA       PRO   1  -3.977  -3.017  -0.402
    4    HB2  PRO   1           HB2      PRO   1  -1.313  -4.286  -0.972
    5    HB3  PRO   1           HB3      PRO   1  -1.923  -3.523   0.527
    6    HG2  PRO   1           HG2      PRO   1  -2.037  -6.324  -0.250
    7    HG3  PRO   1           HG3      PRO   1  -2.707  -5.603   1.241
    8    HD2  PRO   1           HD2      PRO   1  -4.309  -6.682  -0.727
    9    HD3  PRO   1           HD3      PRO   1  -4.808  -5.325   0.324
   10    H    GLY   2           H        GLY   2  -2.804  -1.088  -0.894
   11    HA2  GLY   2           HA2      GLY   2  -2.657  -0.466  -3.794
   12    HA3  GLY   2           HA3      GLY   2  -2.751   0.671  -2.429
   13    H    SER   3           H        SER   3  -0.355  -1.656  -1.838
   14    HA   SER   3           HA       SER   3   1.697   0.272  -1.673
   15    HB2  SER   3           HB2      SER   3   1.994  -2.742  -1.830
   16    HB3  SER   3           HB3      SER   3   3.140  -1.588  -1.126
   17    HG   SER   3           HG       SER   3   1.828  -2.586   0.488
   18    H    ALA   4           H        ALA   4   3.639   0.596  -2.799
   19    HA   ALA   4           HA       ALA   4   4.199  -0.591  -5.394
   20    HB1  ALA   4           HB1      ALA   4   3.856   1.507  -6.666
   21    HB2  ALA   4           HB2      ALA   4   2.332   0.946  -5.962
   22    HB3  ALA   4           HB3      ALA   4   3.217   2.291  -5.200
   23    H    GLU   5           H        GLU   5   6.059   0.615  -6.469
   24    HA   GLU   5           HA       GLU   5   8.003   1.771  -4.525
   25    HB2  GLU   5           HB2      GLU   5   8.489  -0.659  -6.314
   26    HB3  GLU   5           HB3      GLU   5   9.743   0.233  -5.449
   27    HG2  GLU   5           HG2      GLU   5   8.662  -0.330  -3.281
   28    HG3  GLU   5           HG3      GLU   5   7.433  -1.255  -4.134
   29    H    ILE   6           H        ILE   6   9.815   2.776  -5.501
   30    HA   ILE   6           HA       ILE   6   9.352   4.227  -7.997
   31    HB   ILE   6           HB       ILE   6  11.575   4.068  -5.946
   32   HG12  ILE   6          2HG1      ILE   6  11.172   6.485  -5.727
   33   HG13  ILE   6          3HG1      ILE   6   9.979   6.435  -7.027
   34   HG21  ILE   6          1HG2      ILE   6  12.828   5.815  -7.213
   35   HG22  ILE   6          2HG2      ILE   6  12.839   4.248  -8.010
   36   HG23  ILE   6          3HG2      ILE   6  11.765   5.542  -8.600
   37   HD11  ILE   6          3HD1      ILE   6   9.030   6.599  -4.709
   38   HD12  ILE   6          1HD1      ILE   6   8.415   5.211  -5.620
   39   HD13  ILE   6          2HD1      ILE   6   9.661   4.975  -4.365
   40    H    ASP   7           H        ASP   7  10.274   3.940  -9.988
   41    HA   ASP   7           HA       ASP   7  11.248   1.283 -10.692
   42    HB2  ASP   7           HB2      ASP   7  11.311   2.118 -12.959
   43    HB3  ASP   7           HB3      ASP   7   9.760   2.444 -12.191
   44    H    TYR   8           H        TYR   8  13.257   0.609 -10.587
   45    HA   TYR   8           HA       TYR   8  15.460   2.511 -10.105
   46    HB2  TYR   8           HB2      TYR   8  15.340  -0.504  -9.783
   47    HB3  TYR   8           HB3      TYR   8  16.663   0.545  -9.310
   48    HD1  TYR   8           HD2      TYR   8  15.750   2.731  -7.833
   49    HD2  TYR   8           HD1      TYR   8  14.082  -1.252  -7.945
   50    HE1  TYR   8           HE2      TYR   8  14.728   3.088  -5.585
   51    HE2  TYR   8           HE1      TYR   8  13.074  -0.897  -5.708
   52    HH   TYR   8           HH       TYR   8  12.767   0.577  -3.951
   53    H    SER   9           H        SER   9  14.428   2.131 -12.879
   54    HA   SER   9           HA       SER   9  16.282   0.782 -14.545
   55    HB2  SER   9           HB2      SER   9  14.792   3.376 -15.107
   56    HB3  SER   9           HB3      SER   9  15.464   2.266 -16.310
   57    HG   SER   9           HG       SER   9  13.188   1.936 -15.941
   58    H    ASP  10           H        ASP  10  16.772   3.693 -12.703
   59    HA   ASP  10           HA       ASP  10  19.043   4.740 -14.204
   60    HB2  ASP  10           HB2      ASP  10  17.412   6.077 -12.861
   61    HB3  ASP  10           HB3      ASP  10  18.030   5.316 -11.394
   62    H    ALA  11           H        ALA  11  18.784   1.995 -12.189
   63    HA   ALA  11           HA       ALA  11  21.093   2.231 -10.558
   64    HB1  ALA  11           HB1      ALA  11  20.844  -0.203 -10.252
   65    HB2  ALA  11           HB2      ALA  11  19.294   0.643 -10.111
   66    HB3  ALA  11           HB3      ALA  11  19.686  -0.253 -11.592
   67    HA   PRO  12           HA       PRO  12  24.378   1.523 -13.488
   68    HB2  PRO  12           HB2      PRO  12  26.441   0.843 -11.858
   69    HB3  PRO  12           HB3      PRO  12  25.746   2.483 -11.875
   70    HG2  PRO  12           HG2      PRO  12  25.087   0.209  -9.973
   71    HG3  PRO  12           HG3      PRO  12  25.516   1.900  -9.551
   72    HD2  PRO  12           HD2      PRO  12  22.928   1.103  -9.697
   73    HD3  PRO  12           HD3      PRO  12  23.422   2.716 -10.274
   74    H    ASP  13           H        ASP  13  25.677  -0.175 -14.420
   75    HA   ASP  13           HA       ASP  13  24.321  -2.650 -14.611
   76    HB2  ASP  13           HB2      ASP  13  25.753  -1.467 -16.338
   77    HB3  ASP  13           HB3      ASP  13  27.175  -2.015 -15.452
   78    H    GLU  14           H        GLU  14  26.799  -1.711 -12.388
   79    HA   GLU  14           HA       GLU  14  27.603  -4.424 -11.642
   80    HB2  GLU  14           HB2      GLU  14  28.967  -3.389  -9.958
   81    HB3  GLU  14           HB3      GLU  14  29.152  -2.530 -11.491
   82    HG2  GLU  14           HG2      GLU  14  27.530  -0.786 -10.626
   83    HG3  GLU  14           HG3      GLU  14  27.529  -1.617  -9.072
   84    H    PHE  15           H        PHE  15  24.906  -2.405 -10.799
   85    HA   PHE  15           HA       PHE  15  24.252  -4.002  -8.361
   86    HB2  PHE  15           HB2      PHE  15  22.971  -1.550  -9.629
   87    HB3  PHE  15           HB3      PHE  15  22.301  -2.425  -8.275
   88    HD1  PHE  15           HD2      PHE  15  25.759  -2.515  -7.541
   89    HD2  PHE  15           HD1      PHE  15  22.375   0.164  -7.682
   90    HE1  PHE  15           HE2      PHE  15  26.859  -1.041  -5.905
   91    HE2  PHE  15           HE1      PHE  15  23.502   1.655  -6.050
   92    HZ   PHE  15           HZ       PHE  15  25.739   1.053  -5.157
   93    H    ARG  16           H        ARG  16  23.451  -3.760 -11.797
   94    HA   ARG  16           HA       ARG  16  20.958  -5.241 -11.444
   95    HB2  ARG  16           HB2      ARG  16  22.346  -4.106 -13.883
   96    HB3  ARG  16           HB3      ARG  16  20.822  -5.008 -13.931
   97    HG2  ARG  16           HG2      ARG  16  19.796  -3.396 -12.337
   98    HG3  ARG  16           HG3      ARG  16  21.279  -2.439 -12.321
   99    HD2  ARG  16           HD2      ARG  16  19.658  -3.012 -14.820
  100    HD3  ARG  16           HD3      ARG  16  19.432  -1.610 -13.782
  101    HE   ARG  16           HE       ARG  16  21.485  -0.691 -14.401
  102   HH11  ARG  16          1HH1      ARG  16  20.915  -3.653 -16.298
  103   HH12  ARG  16          2HH1      ARG  16  22.175  -3.255 -17.425
  104   HH21  ARG  16          1HH2      ARG  16  22.995  -0.235 -15.928
  105   HH22  ARG  16          2HH2      ARG  16  23.300  -1.340 -17.238
  106    H    ASP  17           H        ASP  17  20.473  -7.247 -12.164
  107    HA   ASP  17           HA       ASP  17  22.635  -9.205 -12.532
  108    HB2  ASP  17           HB2      ASP  17  20.681 -10.827 -12.740
  109    HB3  ASP  17           HB3      ASP  17  20.997 -10.073 -11.188
  110    HA   PRO  18           HA       PRO  18  22.393  -9.150 -16.963
  111    HB2  PRO  18           HB2      PRO  18  23.544 -11.514 -17.654
  112    HB3  PRO  18           HB3      PRO  18  24.453 -10.220 -16.817
  113    HG2  PRO  18           HG2      PRO  18  23.123 -12.665 -15.594
  114    HG3  PRO  18           HG3      PRO  18  24.787 -12.074 -15.338
  115    HD2  PRO  18           HD2      PRO  18  22.741 -11.499 -13.624
  116    HD3  PRO  18           HD3      PRO  18  24.036 -10.309 -13.971
  117    H    LEU  19           H        LEU  19  20.869 -12.022 -15.417
  118    HA   LEU  19           HA       LEU  19  19.604 -12.910 -17.869
  119    HB2  LEU  19           HB2      LEU  19  20.383 -14.253 -15.756
  120    HB3  LEU  19           HB3      LEU  19  18.891 -13.725 -15.027
  121    HG   LEU  19           HG       LEU  19  18.797 -15.992 -15.813
  122   HD11  LEU  19          1HD1      LEU  19  16.919 -14.368 -17.555
  123   HD12  LEU  19          2HD1      LEU  19  16.722 -14.595 -15.798
  124   HD13  LEU  19          3HD1      LEU  19  16.678 -15.992 -16.886
  125   HD21  LEU  19          3HD2      LEU  19  18.821 -16.624 -18.165
  126   HD22  LEU  19          1HD2      LEU  19  20.342 -15.837 -17.733
  127   HD23  LEU  19          2HD2      LEU  19  19.112 -14.947 -18.662
  128    H    MET  20           H        MET  20  18.369 -11.412 -14.863
  129    HA   MET  20           HA       MET  20  15.673 -11.042 -15.988
  130    HB2  MET  20           HB2      MET  20  16.970 -10.798 -13.258
  131    HB3  MET  20           HB3      MET  20  15.404 -10.101 -13.537
  132    HG2  MET  20           HG2      MET  20  16.175 -13.011 -13.969
  133    HG3  MET  20           HG3      MET  20  15.290 -12.386 -12.593
  134    HE1  MET  20           HE1      MET  20  12.823 -11.529 -12.611
  135    HE2  MET  20           HE2      MET  20  13.141 -10.354 -13.902
  136    HE3  MET  20           HE3      MET  20  11.779 -11.488 -14.048
  137    H    ASP  21           H        ASP  21  18.491  -9.126 -15.817
  138    HA   ASP  21           HA       ASP  21  18.990  -7.026 -16.381
  139    HB2  ASP  21           HB2      ASP  21  17.803  -7.780 -18.440
  140    HB3  ASP  21           HB3      ASP  21  16.338  -6.988 -17.859
  141    H    THR  22           H        THR  22  17.932  -7.275 -13.819
  142    HA   THR  22           HA       THR  22  16.893  -4.529 -13.317
  143    HB   THR  22           HB       THR  22  14.957  -6.117 -13.560
  144    HG1  THR  22           HG1      THR  22  13.986  -5.220 -11.710
  145   HG21  THR  22          1HG2      THR  22  14.417  -7.648 -11.784
  146   HG22  THR  22          2HG2      THR  22  15.873  -7.222 -10.861
  147   HG23  THR  22          3HG2      THR  22  16.024  -8.092 -12.390
  148    H    LEU  23           H        LEU  23  16.765  -4.203 -10.831
  149    HA   LEU  23           HA       LEU  23  19.468  -4.454  -9.852
  150    HB2  LEU  23           HB2      LEU  23  17.500  -2.673  -9.394
  151    HB3  LEU  23           HB3      LEU  23  17.223  -3.690  -7.987
  152    HG   LEU  23           HG       LEU  23  19.823  -2.289  -8.752
  153   HD11  LEU  23          1HD1      LEU  23  17.825  -1.736  -6.529
  154   HD12  LEU  23          2HD1      LEU  23  18.029  -0.785  -8.004
  155   HD13  LEU  23          3HD1      LEU  23  19.339  -0.850  -6.805
  156   HD21  LEU  23          3HD2      LEU  23  20.630  -2.912  -6.510
  157   HD22  LEU  23          1HD2      LEU  23  20.340  -4.350  -7.469
  158   HD23  LEU  23          2HD2      LEU  23  19.161  -3.879  -6.228
  159    H    MET  24           H        MET  24  20.339  -6.259  -8.950
  160    HA   MET  24           HA       MET  24  18.746  -8.560  -8.380
  161    HB2  MET  24           HB2      MET  24  20.811  -9.598  -7.584
  162    HB3  MET  24           HB3      MET  24  21.004  -8.788  -9.150
  163    HG2  MET  24           HG2      MET  24  22.048  -6.852  -7.847
  164    HG3  MET  24           HG3      MET  24  22.039  -7.898  -6.430
  165    HE1  MET  24           HE1      MET  24  24.540  -6.680  -6.964
  166    HE2  MET  24           HE2      MET  24  25.710  -7.408  -8.087
  167    HE3  MET  24           HE3      MET  24  24.378  -6.433  -8.715
  168    H    THR  25           H        THR  25  20.104  -6.153  -6.238
  169    HA   THR  25           HA       THR  25  19.737  -5.502  -4.104
  170    HB   THR  25           HB       THR  25  17.397  -7.414  -3.887
  171    HG1  THR  25           HG1      THR  25  17.034  -6.249  -5.746
  172   HG21  THR  25          1HG2      THR  25  18.021  -4.660  -2.723
  173   HG22  THR  25          2HG2      THR  25  18.001  -6.190  -1.816
  174   HG23  THR  25          3HG2      THR  25  16.499  -5.530  -2.500
  175    H    ASP  26           H        ASP  26  19.674  -8.994  -4.517
  176    HA   ASP  26           HA       ASP  26  21.396  -9.340  -2.091
  177    HB2  ASP  26           HB2      ASP  26  19.278 -11.102  -3.324
  178    HB3  ASP  26           HB3      ASP  26  20.586 -11.782  -2.361
  179    HA   PRO  27           HA       PRO  27  24.211 -10.426  -5.589
  180    HB2  PRO  27           HB2      PRO  27  26.429  -9.158  -4.591
  181    HB3  PRO  27           HB3      PRO  27  25.212  -8.345  -5.604
  182    HG2  PRO  27           HG2      PRO  27  25.446  -8.292  -2.589
  183    HG3  PRO  27           HG3      PRO  27  25.119  -6.923  -3.708
  184    HD2  PRO  27           HD2      PRO  27  23.167  -8.202  -2.326
  185    HD3  PRO  27           HD3      PRO  27  22.899  -7.532  -3.962
  186    H    VAL  28           H        VAL  28  25.247 -12.333  -5.432
  187    HA   VAL  28           HA       VAL  28  26.435 -13.254  -2.840
  188    HB   VAL  28           HB       VAL  28  24.745 -14.951  -4.731
  189   HG11  VAL  28          1HG1      VAL  28  26.513 -16.225  -3.569
  190   HG12  VAL  28          2HG1      VAL  28  25.948 -15.604  -2.010
  191   HG13  VAL  28          3HG1      VAL  28  24.897 -16.652  -2.988
  192   HG21  VAL  28          3HG2      VAL  28  24.054 -13.872  -1.955
  193   HG22  VAL  28          1HG2      VAL  28  23.260 -13.438  -3.481
  194   HG23  VAL  28          2HG2      VAL  28  23.107 -15.078  -2.851
  195    H    ARG  29           H        ARG  29  28.418 -13.996  -3.013
  196    HA   ARG  29           HA       ARG  29  29.712 -14.022  -5.636
  197    HB2  ARG  29           HB2      ARG  29  30.544 -12.807  -3.603
  198    HB3  ARG  29           HB3      ARG  29  30.993 -14.362  -2.903
  199    HG2  ARG  29           HG2      ARG  29  32.582 -14.743  -4.738
  200    HG3  ARG  29           HG3      ARG  29  31.963 -13.330  -5.622
  201    HD2  ARG  29           HD2      ARG  29  32.694 -11.847  -3.768
  202    HD3  ARG  29           HD3      ARG  29  33.382 -13.235  -2.925
  203    HE   ARG  29           HE       ARG  29  34.286 -12.102  -5.561
  204   HH11  ARG  29          1HH1      ARG  29  35.103 -14.168  -2.788
  205   HH12  ARG  29          2HH1      ARG  29  36.769 -14.286  -3.279
  206   HH21  ARG  29          1HH2      ARG  29  36.442 -12.290  -6.097
  207   HH22  ARG  29          2HH2      ARG  29  37.503 -13.250  -5.109
  208    H    LEU  30           H        LEU  30  30.595 -15.716  -6.607
  209    HA   LEU  30           HA       LEU  30  30.021 -18.485  -5.687
  210    HB2  LEU  30           HB2      LEU  30  30.575 -17.090  -8.342
  211    HB3  LEU  30           HB3      LEU  30  30.821 -18.803  -8.216
  212    HG   LEU  30           HG       LEU  30  28.469 -19.103  -7.447
  213   HD11  LEU  30          1HD1      LEU  30  27.867 -16.883  -6.605
  214   HD12  LEU  30          2HD1      LEU  30  26.821 -17.298  -7.953
  215   HD13  LEU  30          3HD1      LEU  30  28.169 -16.155  -8.198
  216   HD21  LEU  30          3HD2      LEU  30  29.146 -19.472  -9.779
  217   HD22  LEU  30          1HD2      LEU  30  28.846 -17.750 -10.150
  218   HD23  LEU  30          2HD2      LEU  30  27.509 -18.823  -9.699
  219    HA   PRO  31           HA       PRO  31  34.232 -19.543  -4.839
  220    HB2  PRO  31           HB2      PRO  31  34.665 -21.982  -6.033
  221    HB3  PRO  31           HB3      PRO  31  33.615 -21.749  -4.608
  222    HG2  PRO  31           HG2      PRO  31  32.785 -21.848  -7.531
  223    HG3  PRO  31           HG3      PRO  31  32.099 -22.781  -6.162
  224    HD2  PRO  31           HD2      PRO  31  30.912 -20.528  -7.004
  225    HD3  PRO  31           HD3      PRO  31  31.061 -20.832  -5.253
  226    H    SER  32           H        SER  32  33.334 -19.333  -8.262
  227    HA   SER  32           HA       SER  32  36.001 -19.189  -9.386
  228    HB2  SER  32           HB2      SER  32  34.702 -18.203 -11.305
  229    HB3  SER  32           HB3      SER  32  34.099 -19.774 -10.748
  230    HG   SER  32           HG       SER  32  32.399 -18.243 -11.069
  231    H    GLY  33           H        GLY  33  34.320 -17.057  -7.327
  232    HA2  GLY  33           HA2      GLY  33  34.979 -14.989  -6.519
  233    HA3  GLY  33           HA3      GLY  33  36.086 -14.750  -7.903
  234    H    THR  34           H        THR  34  33.378 -15.670  -9.419
  235    HA   THR  34           HA       THR  34  32.512 -13.059 -10.267
  236    HB   THR  34           HB       THR  34  31.302 -15.833 -10.619
  237    HG1  THR  34           HG1      THR  34  32.406 -15.714 -12.595
  238   HG21  THR  34          1HG2      THR  34  30.239 -14.832 -12.681
  239   HG22  THR  34          2HG2      THR  34  30.737 -13.226 -12.121
  240   HG23  THR  34          3HG2      THR  34  29.572 -14.188 -11.173
  241    H    VAL  35           H        VAL  35  30.592 -11.961  -9.805
  242    HA   VAL  35           HA       VAL  35  29.028 -12.869  -7.413
  243    HB   VAL  35           HB       VAL  35  29.315 -10.050  -8.522
  244   HG11  VAL  35          1HG1      VAL  35  27.068 -10.364  -7.551
  245   HG12  VAL  35          2HG1      VAL  35  27.780 -11.099  -6.089
  246   HG13  VAL  35          3HG1      VAL  35  28.051  -9.387  -6.478
  247   HG21  VAL  35          3HG2      VAL  35  30.448  -9.609  -6.339
  248   HG22  VAL  35          1HG2      VAL  35  30.371 -11.335  -5.961
  249   HG23  VAL  35          2HG2      VAL  35  31.347 -10.771  -7.319
  250    H    MET  36           H        MET  36  26.954 -13.316  -7.624
  251    HA   MET  36           HA       MET  36  25.428 -12.596 -10.081
  252    HB2  MET  36           HB2      MET  36  26.417 -14.931 -10.226
  253    HB3  MET  36           HB3      MET  36  25.485 -15.361  -8.805
  254    HG2  MET  36           HG2      MET  36  24.476 -16.091 -10.963
  255    HG3  MET  36           HG3      MET  36  23.404 -15.121  -9.969
  256    HE1  MET  36           HE1      MET  36  25.839 -15.182 -13.009
  257    HE2  MET  36           HE2      MET  36  25.543 -13.607 -13.792
  258    HE3  MET  36           HE3      MET  36  26.371 -13.675 -12.233
  259    H    ASP  37           H        ASP  37  23.105 -12.961  -9.758
  260    HA   ASP  37           HA       ASP  37  22.067 -11.948  -7.213
  261    HB2  ASP  37           HB2      ASP  37  20.996 -11.225  -9.227
  262    HB3  ASP  37           HB3      ASP  37  20.897 -12.878  -9.842
  263    H    ARG  38           H        ARG  38  21.145 -13.056  -5.611
  264    HA   ARG  38           HA       ARG  38  21.547 -15.742  -5.034
  265    HB2  ARG  38           HB2      ARG  38  20.885 -13.877  -3.483
  266    HB3  ARG  38           HB3      ARG  38  19.228 -14.004  -4.084
  267    HG2  ARG  38           HG2      ARG  38  19.249 -16.447  -3.344
  268    HG3  ARG  38           HG3      ARG  38  20.803 -16.141  -2.577
  269    HD2  ARG  38           HD2      ARG  38  18.142 -14.784  -1.956
  270    HD3  ARG  38           HD3      ARG  38  18.917 -16.019  -0.973
  271    HE   ARG  38           HE       ARG  38  19.505 -13.178  -1.051
  272   HH11  ARG  38          1HH1      ARG  38  21.011 -16.266  -0.201
  273   HH12  ARG  38          2HH1      ARG  38  22.061 -15.517   0.961
  274   HH21  ARG  38          1HH2      ARG  38  20.886 -12.283   0.383
  275   HH22  ARG  38          2HH2      ARG  38  22.021 -13.276   1.267
  276    H    SER  39           H        SER  39  18.528 -14.334  -6.447
  277    HA   SER  39           HA       SER  39  17.126 -16.851  -6.430
  278    HB2  SER  39           HB2      SER  39  16.516 -14.331  -8.004
  279    HB3  SER  39           HB3      SER  39  15.424 -15.694  -7.724
  280    HG   SER  39           HG       SER  39  15.057 -13.990  -6.230
  281    H    ILE  40           H        ILE  40  18.874 -15.116  -9.062
  282    HA   ILE  40           HA       ILE  40  18.281 -17.051 -11.104
  283    HB   ILE  40           HB       ILE  40  20.512 -15.008 -10.797
  284   HG12  ILE  40          2HG1      ILE  40  18.224 -15.085 -12.815
  285   HG13  ILE  40          3HG1      ILE  40  17.942 -14.447 -11.201
  286   HG21  ILE  40          1HG2      ILE  40  20.984 -15.359 -13.228
  287   HG22  ILE  40          2HG2      ILE  40  21.439 -16.743 -12.249
  288   HG23  ILE  40          3HG2      ILE  40  19.947 -16.801 -13.206
  289   HD11  ILE  40          3HD1      ILE  40  20.089 -13.319 -13.056
  290   HD12  ILE  40          1HD1      ILE  40  18.435 -12.695 -12.896
  291   HD13  ILE  40          2HD1      ILE  40  19.526 -12.651 -11.518
  292    H    ILE  41           H        ILE  41  21.085 -16.977  -8.814
  293    HA   ILE  41           HA       ILE  41  22.214 -19.323 -10.048
  294    HB   ILE  41           HB       ILE  41  23.554 -17.717  -8.733
  295   HG12  ILE  41          2HG1      ILE  41  25.026 -19.331  -7.622
  296   HG13  ILE  41          3HG1      ILE  41  23.786 -20.581  -7.709
  297   HG21  ILE  41          1HG2      ILE  41  22.395 -19.036  -6.238
  298   HG22  ILE  41          2HG2      ILE  41  23.706 -17.846  -6.303
  299   HG23  ILE  41          3HG2      ILE  41  22.086 -17.378  -6.794
  300   HD11  ILE  41          3HD1      ILE  41  24.967 -19.194 -10.164
  301   HD12  ILE  41          1HD1      ILE  41  25.613 -20.692  -9.477
  302   HD13  ILE  41          2HD1      ILE  41  23.968 -20.666 -10.127
  303    H    LEU  42           H        LEU  42  20.028 -19.057  -7.191
  304    HA   LEU  42           HA       LEU  42  19.981 -21.926  -6.861
  305    HB2  LEU  42           HB2      LEU  42  18.431 -21.623  -5.157
  306    HB3  LEU  42           HB3      LEU  42  19.541 -20.274  -5.087
  307    HG   LEU  42           HG       LEU  42  17.722 -18.930  -6.342
  308   HD11  LEU  42          1HD1      LEU  42  15.988 -21.195  -5.222
  309   HD12  LEU  42          2HD1      LEU  42  16.111 -20.739  -6.934
  310   HD13  LEU  42          3HD1      LEU  42  15.375 -19.635  -5.785
  311   HD21  LEU  42          3HD2      LEU  42  16.684 -18.337  -4.190
  312   HD22  LEU  42          1HD2      LEU  42  18.408 -18.604  -3.984
  313   HD23  LEU  42          2HD2      LEU  42  17.261 -19.854  -3.468
  314    H    ARG  43           H        ARG  43  18.083 -19.779  -8.934
  315    HA   ARG  43           HA       ARG  43  16.160 -21.772  -9.715
  316    HB2  ARG  43           HB2      ARG  43  15.809 -19.374 -10.068
  317    HB3  ARG  43           HB3      ARG  43  17.191 -19.303 -11.155
  318    HG2  ARG  43           HG2      ARG  43  15.094 -19.286 -12.415
  319    HG3  ARG  43           HG3      ARG  43  16.035 -20.723 -12.788
  320    HD2  ARG  43           HD2      ARG  43  13.704 -21.314 -12.613
  321    HD3  ARG  43           HD3      ARG  43  14.576 -22.073 -11.280
  322    HE   ARG  43           HE       ARG  43  13.565 -19.529 -10.429
  323   HH11  ARG  43          1HH1      ARG  43  12.301 -22.730 -11.234
  324   HH12  ARG  43          2HH1      ARG  43  10.931 -22.553 -10.172
  325   HH21  ARG  43          1HH2      ARG  43  11.765 -19.347  -9.116
  326   HH22  ARG  43          2HH2      ARG  43  10.629 -20.662  -9.000
  327    H    HIS  44           H        HIS  44  19.426 -20.921 -10.992
  328    HA   HIS  44           HA       HIS  44  19.270 -22.887 -13.113
  329    HB2  HIS  44           HB2      HIS  44  20.814 -20.848 -12.963
  330    HB3  HIS  44           HB3      HIS  44  21.850 -21.844 -11.924
  331    HD1  HIS  44           HD1      HIS  44  23.292 -23.717 -13.229
  332    HD2  HIS  44           HD2      HIS  44  20.313 -21.804 -15.509
  333    HE1  HIS  44           HE1      HIS  44  23.540 -24.569 -15.622
  334    H    LEU  45           H        LEU  45  20.531 -23.071  -9.772
  335    HA   LEU  45           HA       LEU  45  21.645 -25.662  -9.877
  336    HB2  LEU  45           HB2      LEU  45  20.248 -24.138  -7.659
  337    HB3  LEU  45           HB3      LEU  45  20.926 -25.742  -7.393
  338    HG   LEU  45           HG       LEU  45  22.562 -23.341  -8.338
  339   HD11  LEU  45          1HD1      LEU  45  23.486 -23.361  -6.046
  340   HD12  LEU  45          2HD1      LEU  45  22.377 -24.678  -5.607
  341   HD13  LEU  45          3HD1      LEU  45  21.740 -23.075  -6.014
  342   HD21  LEU  45          3HD2      LEU  45  24.482 -24.857  -7.639
  343   HD22  LEU  45          1HD2      LEU  45  23.635 -25.357  -9.098
  344   HD23  LEU  45          2HD2      LEU  45  23.326 -26.188  -7.550
  345    H    LEU  46           H        LEU  46  18.213 -24.831  -9.654
  346    HA   LEU  46           HA       LEU  46  17.219 -27.486  -9.240
  347    HB2  LEU  46           HB2      LEU  46  15.968 -25.346  -8.893
  348    HB3  LEU  46           HB3      LEU  46  15.967 -25.075 -10.624
  349    HG   LEU  46           HG       LEU  46  14.585 -27.127 -10.947
  350   HD11  LEU  46          1HD1      LEU  46  13.468 -28.147  -8.954
  351   HD12  LEU  46          2HD1      LEU  46  14.536 -27.205  -7.893
  352   HD13  LEU  46          3HD1      LEU  46  15.200 -28.460  -8.965
  353   HD21  LEU  46          3HD2      LEU  46  13.447 -25.099  -8.978
  354   HD22  LEU  46          1HD2      LEU  46  12.509 -26.146 -10.071
  355   HD23  LEU  46          2HD2      LEU  46  13.565 -24.891 -10.737
  356    H    ASN  47           H        ASN  47  18.325 -25.855 -12.197
  357    HA   ASN  47           HA       ASN  47  17.286 -27.970 -13.980
  358    HB2  ASN  47           HB2      ASN  47  17.389 -25.585 -14.689
  359    HB3  ASN  47           HB3      ASN  47  19.152 -25.634 -14.559
  360   HD21  ASN  47          1HD2      ASN  47  16.336 -27.055 -16.276
  361   HD22  ASN  47          2HD2      ASN  47  17.254 -27.535 -17.694
  362    H    SER  48           H        SER  48  20.508 -26.876 -12.775
  363    HA   SER  48           HA       SER  48  21.495 -29.605 -12.672
  364    HB2  SER  48           HB2      SER  48  23.417 -29.312 -14.201
  365    HB3  SER  48           HB3      SER  48  21.874 -29.318 -15.036
  366    HG   SER  48           HG       SER  48  23.602 -27.114 -14.499
  367    HA   PRO  49           HA       PRO  49  23.807 -27.607  -9.496
  368    HB2  PRO  49           HB2      PRO  49  25.677 -29.443  -8.783
  369    HB3  PRO  49           HB3      PRO  49  23.916 -29.749  -8.639
  370    HG2  PRO  49           HG2      PRO  49  25.743 -30.555 -10.934
  371    HG3  PRO  49           HG3      PRO  49  24.623 -31.604  -9.985
  372    HD2  PRO  49           HD2      PRO  49  23.900 -30.495 -12.364
  373    HD3  PRO  49           HD3      PRO  49  22.729 -30.670 -11.021
  374    H    THR  50           H        THR  50  24.384 -26.145 -11.545
  375    HA   THR  50           HA       THR  50  27.300 -25.763 -11.685
  376    HB   THR  50           HB       THR  50  27.304 -25.769 -14.102
  377    HG1  THR  50           HG1      THR  50  25.215 -25.165 -14.526
  378   HG21  THR  50          1HG2      THR  50  27.067 -28.045 -14.697
  379   HG22  THR  50          2HG2      THR  50  26.044 -28.390 -13.286
  380   HG23  THR  50          3HG2      THR  50  27.765 -27.947 -13.074
  381    H    ASP  51           H        ASP  51  27.943 -23.878 -12.832
  382    HA   ASP  51           HA       ASP  51  26.577 -21.482 -12.170
  383    HB2  ASP  51           HB2      ASP  51  28.995 -21.695 -12.378
  384    HB3  ASP  51           HB3      ASP  51  28.862 -22.069 -14.089
  385    HA   PRO  52           HA       PRO  52  23.671 -21.218 -15.509
  386    HB2  PRO  52           HB2      PRO  52  22.943 -18.544 -15.426
  387    HB3  PRO  52           HB3      PRO  52  22.416 -19.777 -14.256
  388    HG2  PRO  52           HG2      PRO  52  24.723 -17.832 -13.999
  389    HG3  PRO  52           HG3      PRO  52  23.465 -18.226 -12.786
  390    HD2  PRO  52           HD2      PRO  52  25.906 -19.364 -12.684
  391    HD3  PRO  52           HD3      PRO  52  24.443 -20.331 -12.339
  392    H    PHE  53           H        PHE  53  26.616 -19.352 -15.831
  393    HA   PHE  53           HA       PHE  53  26.005 -18.785 -18.703
  394    HB2  PHE  53           HB2      PHE  53  27.513 -17.108 -16.665
  395    HB3  PHE  53           HB3      PHE  53  27.441 -16.769 -18.391
  396    HD1  PHE  53           HD1      PHE  53  25.104 -16.503 -19.490
  397    HD2  PHE  53           HD2      PHE  53  25.795 -16.217 -15.247
  398    HE1  PHE  53           HE1      PHE  53  22.976 -15.246 -19.223
  399    HE2  PHE  53           HE2      PHE  53  23.625 -15.005 -14.975
  400    HZ   PHE  53           HZ       PHE  53  22.246 -14.507 -16.975
  401    H    ASN  54           H        ASN  54  27.708 -20.890 -17.004
  402    HA   ASN  54           HA       ASN  54  29.831 -21.193 -19.061
  403    HB2  ASN  54           HB2      ASN  54  30.763 -19.633 -17.384
  404    HB3  ASN  54           HB3      ASN  54  30.416 -20.793 -16.095
  405   HD21  ASN  54          1HD2      ASN  54  32.406 -20.267 -19.051
  406   HD22  ASN  54          2HD2      ASN  54  33.651 -21.417 -18.581
  407    H    ARG  55           H        ARG  55  27.944 -22.570 -16.430
  408    HA   ARG  55           HA       ARG  55  27.567 -24.543 -15.637
  409    HB2  ARG  55           HB2      ARG  55  28.112 -25.535 -18.436
  410    HB3  ARG  55           HB3      ARG  55  27.180 -26.366 -17.180
  411    HG2  ARG  55           HG2      ARG  55  25.660 -24.311 -17.069
  412    HG3  ARG  55           HG3      ARG  55  26.514 -23.703 -18.498
  413    HD2  ARG  55           HD2      ARG  55  24.619 -24.675 -19.370
  414    HD3  ARG  55           HD3      ARG  55  25.870 -25.912 -19.635
  415    HE   ARG  55           HE       ARG  55  24.546 -26.354 -17.119
  416   HH11  ARG  55          1HH1      ARG  55  23.890 -26.729 -20.583
  417   HH12  ARG  55          2HH1      ARG  55  22.593 -27.856 -20.306
  418   HH21  ARG  55          1HH2      ARG  55  22.798 -27.725 -16.823
  419   HH22  ARG  55          2HH2      ARG  55  22.000 -28.426 -18.208
  420    H    GLN  56           H        GLN  56  30.313 -23.748 -15.208
  421    HA   GLN  56           HA       GLN  56  31.712 -26.276 -14.639
  422    HB2  GLN  56           HB2      GLN  56  33.040 -24.971 -13.084
  423    HB3  GLN  56           HB3      GLN  56  33.027 -24.203 -14.668
  424    HG2  GLN  56           HG2      GLN  56  31.635 -22.407 -13.923
  425    HG3  GLN  56           HG3      GLN  56  31.106 -23.268 -12.487
  426   HE21  GLN  56          1HE2      GLN  56  32.590 -23.549 -10.669
  427   HE22  GLN  56          2HE2      GLN  56  33.961 -22.464 -10.523
  428    H    MET  57           H        MET  57  31.785 -27.199 -12.451
  429    HA   MET  57           HA       MET  57  29.203 -27.595 -11.307
  430    HB2  MET  57           HB2      MET  57  31.966 -28.193 -10.188
  431    HB3  MET  57           HB3      MET  57  30.462 -28.745  -9.470
  432    HG2  MET  57           HG2      MET  57  31.467 -29.432 -12.262
  433    HG3  MET  57           HG3      MET  57  31.530 -30.477 -10.860
  434    HE1  MET  57           HE1      MET  57  28.530 -30.094  -9.539
  435    HE2  MET  57           HE2      MET  57  27.824 -31.510 -10.317
  436    HE3  MET  57           HE3      MET  57  29.494 -31.588  -9.735
  437    H    LEU  58           H        LEU  58  28.187 -26.904  -9.502
  438    HA   LEU  58           HA       LEU  58  29.351 -24.944  -7.663
  439    HB2  LEU  58           HB2      LEU  58  28.622 -23.694  -9.733
  440    HB3  LEU  58           HB3      LEU  58  26.987 -24.243  -9.477
  441    HG   LEU  58           HG       LEU  58  27.628 -21.863  -8.847
  442   HD11  LEU  58          1HD1      LEU  58  26.233 -23.464  -6.678
  443   HD12  LEU  58          2HD1      LEU  58  25.484 -22.846  -8.170
  444   HD13  LEU  58          3HD1      LEU  58  26.103 -21.735  -6.955
  445   HD21  LEU  58          3HD2      LEU  58  28.751 -23.123  -6.322
  446   HD22  LEU  58          1HD2      LEU  58  28.596 -21.407  -6.688
  447   HD23  LEU  58          2HD2      LEU  58  29.722 -22.411  -7.626
  448    H    THR  59           H        THR  59  28.396 -25.017  -5.688
  449    HA   THR  59           HA       THR  59  25.819 -26.449  -5.255
  450    HB   THR  59           HB       THR  59  28.346 -26.871  -3.598
  451    HG1  THR  59           HG1      THR  59  28.507 -27.907  -5.592
  452   HG21  THR  59          1HG2      THR  59  25.595 -28.211  -3.506
  453   HG22  THR  59          2HG2      THR  59  26.347 -27.237  -2.225
  454   HG23  THR  59          3HG2      THR  59  27.042 -28.793  -2.654
  455    H    GLU  60           H        GLU  60  24.703 -25.742  -3.340
  456    HA   GLU  60           HA       GLU  60  24.754 -22.982  -2.813
  457    HB2  GLU  60           HB2      GLU  60  23.649 -25.243  -1.095
  458    HB3  GLU  60           HB3      GLU  60  23.283 -23.529  -0.887
  459    HG2  GLU  60           HG2      GLU  60  22.308 -23.458  -3.177
  460    HG3  GLU  60           HG3      GLU  60  22.607 -25.190  -3.337
  461    H    SER  61           H        SER  61  26.598 -25.524  -1.180
  462    HA   SER  61           HA       SER  61  27.352 -24.013   1.167
  463    HB2  SER  61           HB2      SER  61  29.028 -25.854   1.383
  464    HB3  SER  61           HB3      SER  61  27.368 -26.434   1.159
  465    HG   SER  61           HG       SER  61  28.918 -27.569  -0.161
  466    H    MET  62           H        MET  62  28.394 -23.783  -2.105
  467    HA   MET  62           HA       MET  62  31.090 -22.730  -1.483
  468    HB2  MET  62           HB2      MET  62  29.647 -22.987  -4.152
  469    HB3  MET  62           HB3      MET  62  31.357 -22.668  -3.892
  470    HG2  MET  62           HG2      MET  62  31.704 -24.873  -2.946
  471    HG3  MET  62           HG3      MET  62  29.982 -25.237  -3.026
  472    HE1  MET  62           HE1      MET  62  32.368 -27.064  -4.159
  473    HE2  MET  62           HE2      MET  62  30.646 -27.520  -4.136
  474    HE3  MET  62           HE3      MET  62  31.575 -27.661  -5.639
  475    H    LEU  63           H        LEU  63  27.974 -21.436  -1.625
  476    HA   LEU  63           HA       LEU  63  28.643 -18.852  -2.876
  477    HB2  LEU  63           HB2      LEU  63  26.100 -19.993  -1.627
  478    HB3  LEU  63           HB3      LEU  63  26.207 -18.426  -2.394
  479    HG   LEU  63           HG       LEU  63  26.628 -21.108  -3.788
  480   HD11  LEU  63          1HD1      LEU  63  24.356 -19.084  -3.986
  481   HD12  LEU  63          2HD1      LEU  63  24.271 -20.648  -3.157
  482   HD13  LEU  63          3HD1      LEU  63  24.505 -20.598  -4.907
  483   HD21  LEU  63          3HD2      LEU  63  26.587 -19.756  -5.892
  484   HD22  LEU  63          1HD2      LEU  63  28.002 -19.398  -4.899
  485   HD23  LEU  63          2HD2      LEU  63  26.626 -18.272  -4.915
  486    H    GLU  64           H        GLU  64  28.559 -16.861  -1.906
  487    HA   GLU  64           HA       GLU  64  28.126 -16.633   1.015
  488    HB2  GLU  64           HB2      GLU  64  30.498 -17.095   0.845
  489    HB3  GLU  64           HB3      GLU  64  30.710 -15.805  -0.348
  490    HG2  GLU  64           HG2      GLU  64  30.105 -14.101   1.326
  491    HG3  GLU  64           HG3      GLU  64  29.712 -15.358   2.500
  492    HA   PRO  65           HA       PRO  65  25.998 -13.043  -0.819
  493    HB2  PRO  65           HB2      PRO  65  25.714 -12.395   2.113
  494    HB3  PRO  65           HB3      PRO  65  24.494 -12.260   0.806
  495    HG2  PRO  65           HG2      PRO  65  24.435 -14.378   2.486
  496    HG3  PRO  65           HG3      PRO  65  24.226 -14.656   0.733
  497    HD2  PRO  65           HD2      PRO  65  26.744 -14.999   2.394
  498    HD3  PRO  65           HD3      PRO  65  26.039 -16.083   1.155
  499    H    VAL  66           H        VAL  66  26.662 -11.005  -1.350
  500    HA   VAL  66           HA       VAL  66  29.297 -10.127  -0.351
  501    HB   VAL  66           HB       VAL  66  27.633  -8.974  -2.613
  502   HG11  VAL  66          1HG1      VAL  66  30.554  -8.574  -1.829
  503   HG12  VAL  66          2HG1      VAL  66  29.794  -7.972  -3.324
  504   HG13  VAL  66          3HG1      VAL  66  29.272  -7.343  -1.755
  505   HG21  VAL  66          3HG2      VAL  66  29.966 -10.911  -2.659
  506   HG22  VAL  66          1HG2      VAL  66  28.290 -11.301  -3.104
  507   HG23  VAL  66          2HG2      VAL  66  29.220 -10.169  -4.088
  508    HA   PRO  67           HA       PRO  67  27.001  -7.098   2.167
  509    HB2  PRO  67           HB2      PRO  67  29.000  -6.279   3.827
  510    HB3  PRO  67           HB3      PRO  67  28.232  -7.895   3.965
  511    HG2  PRO  67           HG2      PRO  67  30.850  -7.198   2.602
  512    HG3  PRO  67           HG3      PRO  67  30.528  -8.526   3.746
  513    HD2  PRO  67           HD2      PRO  67  30.508  -8.889   1.016
  514    HD3  PRO  67           HD3      PRO  67  29.426  -9.801   2.106
  515    H    GLU  68           H        GLU  68  30.202  -6.274   0.714
  516    HA   GLU  68           HA       GLU  68  29.879  -3.487   1.013
  517    HB2  GLU  68           HB2      GLU  68  31.802  -3.258  -0.422
  518    HB3  GLU  68           HB3      GLU  68  32.044  -4.551   0.745
  519    HG2  GLU  68           HG2      GLU  68  31.565  -6.244  -0.989
  520    HG3  GLU  68           HG3      GLU  68  31.281  -4.955  -2.180
  521    H    LEU  69           H        LEU  69  28.477  -5.558  -1.383
  522    HA   LEU  69           HA       LEU  69  27.620  -3.244  -3.065
  523    HB2  LEU  69           HB2      LEU  69  27.320  -6.254  -3.369
  524    HB3  LEU  69           HB3      LEU  69  26.503  -5.084  -4.413
  525    HG   LEU  69           HG       LEU  69  29.524  -5.358  -4.135
  526   HD11  LEU  69          1HD1      LEU  69  29.403  -6.333  -6.391
  527   HD12  LEU  69          2HD1      LEU  69  27.621  -6.177  -6.380
  528   HD13  LEU  69          3HD1      LEU  69  28.430  -7.281  -5.248
  529   HD21  LEU  69          3HD2      LEU  69  29.551  -3.876  -6.165
  530   HD22  LEU  69          1HD2      LEU  69  28.953  -3.043  -4.737
  531   HD23  LEU  69          2HD2      LEU  69  27.806  -3.604  -5.972
  532    H    LYS  70           H        LYS  70  26.152  -5.809  -0.971
  533    HA   LYS  70           HA       LYS  70  23.507  -4.885  -1.397
  534    HB2  LYS  70           HB2      LYS  70  24.132  -7.092  -0.473
  535    HB3  LYS  70           HB3      LYS  70  24.601  -6.329   1.056
  536    HG2  LYS  70           HG2      LYS  70  22.347  -5.608   1.490
  537    HG3  LYS  70           HG3      LYS  70  21.818  -5.998  -0.158
  538    HD2  LYS  70           HD2      LYS  70  22.161  -8.408   0.279
  539    HD3  LYS  70           HD3      LYS  70  22.692  -8.026   1.941
  540    HE2  LYS  70           HE2      LYS  70  20.502  -6.961   2.396
  541    HE3  LYS  70           HE3      LYS  70  19.979  -7.293   0.746
  542    HZ1  LYS  70           HZ1      LYS  70  19.168  -8.948   2.345
  543    HZ2  LYS  70           HZ2      LYS  70  20.698  -9.379   2.726
  544    HZ3  LYS  70           HZ3      LYS  70  20.116  -9.657   1.215
  545    H    GLU  71           H        GLU  71  25.853  -3.857   1.091
  546    HA   GLU  71           HA       GLU  71  24.069  -2.034   2.448
  547    HB2  GLU  71           HB2      GLU  71  27.095  -2.197   2.316
  548    HB3  GLU  71           HB3      GLU  71  26.229  -1.075   3.351
  549    HG2  GLU  71           HG2      GLU  71  25.875  -4.105   3.504
  550    HG3  GLU  71           HG3      GLU  71  27.009  -3.191   4.484
  551    H    GLN  72           H        GLN  72  26.153  -1.653  -0.415
  552    HA   GLN  72           HA       GLN  72  25.729   1.246  -0.586
  553    HB2  GLN  72           HB2      GLN  72  26.848  -0.821  -2.503
  554    HB3  GLN  72           HB3      GLN  72  26.607   0.858  -2.961
  555    HG2  GLN  72           HG2      GLN  72  28.306  -0.021  -0.590
  556    HG3  GLN  72           HG3      GLN  72  28.943   0.316  -2.198
  557   HE21  GLN  72          1HE2      GLN  72  29.866   1.705   0.108
  558   HE22  GLN  72          2HE2      GLN  72  29.350   3.374  -0.047
  559    H    ILE  73           H        ILE  73  24.238  -1.616  -2.141
  560    HA   ILE  73           HA       ILE  73  22.424  -0.239  -3.827
  561    HB   ILE  73           HB       ILE  73  22.375  -2.977  -2.513
  562   HG12  ILE  73          2HG1      ILE  73  22.606  -2.201  -5.447
  563   HG13  ILE  73          3HG1      ILE  73  24.013  -2.355  -4.409
  564   HG21  ILE  73          1HG2      ILE  73  20.276  -1.791  -4.366
  565   HG22  ILE  73          2HG2      ILE  73  20.473  -3.537  -4.089
  566   HG23  ILE  73          3HG2      ILE  73  20.045  -2.503  -2.752
  567   HD11  ILE  73          3HD1      ILE  73  23.428  -4.757  -3.975
  568   HD12  ILE  73          1HD1      ILE  73  22.098  -4.603  -5.156
  569   HD13  ILE  73          2HD1      ILE  73  23.767  -4.391  -5.676
  570    H    GLN  74           H        GLN  74  21.845  -1.346  -0.451
  571    HA   GLN  74           HA       GLN  74  19.169  -0.294  -0.400
  572    HB2  GLN  74           HB2      GLN  74  19.170  -0.789   1.958
  573    HB3  GLN  74           HB3      GLN  74  19.926  -2.088   1.044
  574    HG2  GLN  74           HG2      GLN  74  21.355  -1.938   2.850
  575    HG3  GLN  74           HG3      GLN  74  22.184  -0.985   1.657
  576   HE21  GLN  74          1HE2      GLN  74  23.209   0.691   2.752
  577   HE22  GLN  74          2HE2      GLN  74  22.448   1.643   4.030
  578    H    ALA  75           H        ALA  75  22.269   1.267   0.356
  579    HA   ALA  75           HA       ALA  75  21.098   3.718   1.397
  580    HB1  ALA  75           HB1      ALA  75  23.438   3.063   1.866
  581    HB2  ALA  75           HB2      ALA  75  23.819   3.123   0.135
  582    HB3  ALA  75           HB3      ALA  75  23.388   4.614   1.002
  583    H    TRP  76           H        TRP  76  22.150   2.655  -1.879
  584    HA   TRP  76           HA       TRP  76  21.570   5.122  -3.200
  585    HB2  TRP  76           HB2      TRP  76  23.018   3.372  -4.100
  586    HB3  TRP  76           HB3      TRP  76  21.659   2.259  -4.226
  587    HD1  TRP  76           HD1      TRP  76  23.163   5.366  -5.869
  588    HE1  TRP  76           HE1      TRP  76  22.105   5.744  -8.171
  589    HE3  TRP  76           HE3      TRP  76  19.543   1.739  -5.699
  590    HZ2  TRP  76           HZ2      TRP  76  19.922   4.647  -9.728
  591    HZ3  TRP  76           HZ3      TRP  76  17.975   1.458  -7.593
  592    HH2  TRP  76           HH2      TRP  76  18.138   2.904  -9.596
  593    H    MET  77           H        MET  77  19.522   2.158  -2.848
  594    HA   MET  77           HA       MET  77  17.231   3.173  -4.210
  595    HB2  MET  77           HB2      MET  77  17.448   1.168  -1.930
  596    HB3  MET  77           HB3      MET  77  15.944   1.520  -2.803
  597    HG2  MET  77           HG2      MET  77  17.129   0.916  -4.956
  598    HG3  MET  77           HG3      MET  77  18.473   0.328  -3.982
  599    HE1  MET  77           HE1      MET  77  18.155  -1.580  -2.114
  600    HE2  MET  77           HE2      MET  77  16.631  -0.965  -1.452
  601    HE3  MET  77           HE3      MET  77  16.737  -2.646  -2.014
  602    H    ARG  78           H        ARG  78  18.243   3.707  -0.830
  603    HA   ARG  78           HA       ARG  78  15.853   4.975   0.078
  604    HB2  ARG  78           HB2      ARG  78  17.729   4.225   1.525
  605    HB3  ARG  78           HB3      ARG  78  18.718   5.560   0.937
  606    HG2  ARG  78           HG2      ARG  78  17.044   7.180   1.829
  607    HG3  ARG  78           HG3      ARG  78  16.052   5.823   2.405
  608    HD2  ARG  78           HD2      ARG  78  17.924   5.102   3.902
  609    HD3  ARG  78           HD3      ARG  78  18.929   6.412   3.281
  610    HE   ARG  78           HE       ARG  78  17.790   7.953   4.573
  611   HH11  ARG  78          1HH1      ARG  78  15.968   4.928   4.725
  612   HH12  ARG  78          2HH1      ARG  78  14.934   5.504   6.002
  613   HH21  ARG  78          1HH2      ARG  78  16.435   8.632   6.220
  614   HH22  ARG  78          2HH2      ARG  78  15.209   7.565   6.848
  615    H    GLU  79           H        GLU  79  18.741   6.398  -1.550
  616    HA   GLU  79           HA       GLU  79  17.772   9.101  -1.560
  617    HB2  GLU  79           HB2      GLU  79  19.758   7.733  -3.420
  618    HB3  GLU  79           HB3      GLU  79  19.444   9.473  -3.361
  619    HG2  GLU  79           HG2      GLU  79  20.123   9.503  -0.955
  620    HG3  GLU  79           HG3      GLU  79  20.557   7.796  -1.076
  621    H    LYS  80           H        LYS  80  17.335   6.453  -3.967
  622    HA   LYS  80           HA       LYS  80  15.969   8.076  -5.918
  623    HB2  LYS  80           HB2      LYS  80  15.696   5.091  -5.343
  624    HB3  LYS  80           HB3      LYS  80  15.165   5.899  -6.803
  625    HG2  LYS  80           HG2      LYS  80  18.024   5.444  -5.885
  626    HG3  LYS  80           HG3      LYS  80  17.205   4.733  -7.250
  627    HD2  LYS  80           HD2      LYS  80  17.959   7.677  -6.984
  628    HD3  LYS  80           HD3      LYS  80  18.807   6.469  -7.934
  629    HE2  LYS  80           HE2      LYS  80  16.798   6.108  -9.334
  630    HE3  LYS  80           HE3      LYS  80  15.916   7.315  -8.385
  631    HZ1  LYS  80           HZ1      LYS  80  17.583   8.965  -9.117
  632    HZ2  LYS  80           HZ2      LYS  80  16.821   8.304 -10.403
  633    HZ3  LYS  80           HZ3      LYS  80  18.343   7.826 -10.023
  634    H    GLN  81           H        GLN  81  14.792   6.396  -3.046
  635    HA   GLN  81           HA       GLN  81  11.961   6.933  -3.571
  636    HB2  GLN  81           HB2      GLN  81  13.505   5.925  -1.149
  637    HB3  GLN  81           HB3      GLN  81  11.759   6.193  -1.138
  638    HG2  GLN  81           HG2      GLN  81  11.384   4.542  -2.854
  639    HG3  GLN  81           HG3      GLN  81  13.110   4.381  -3.178
  640   HE21  GLN  81          1HE2      GLN  81  14.493   3.454  -1.482
  641   HE22  GLN  81          2HE2      GLN  81  13.781   2.318  -0.331
  642    H    SER  82           H        SER  82  14.474   8.481  -1.424
  643    HA   SER  82           HA       SER  82  12.583  10.393  -0.371
  644    HB2  SER  82           HB2      SER  82  14.497  11.425   0.679
  645    HB3  SER  82           HB3      SER  82  14.597   9.674   0.839
  646    HG   SER  82           HG       SER  82  16.075  11.377  -0.914
  647    H    SER  83           H        SER  83  14.018  10.313  -3.456
  648    HA   SER  83           HA       SER  83  14.046  13.190  -4.000
  649    HB2  SER  83           HB2      SER  83  13.941  10.750  -5.834
  650    HB3  SER  83           HB3      SER  83  14.130  12.427  -6.369
  651    HG   SER  83           HG       SER  83  15.932  10.938  -4.723
  652    H    ASP  84           H        ASP  84  11.457  10.907  -3.656
  653    HA   ASP  84           HA       ASP  84   9.578  12.475  -5.349
  654    HB2  ASP  84           HB2      ASP  84   9.654  10.013  -5.573
  655    HB3  ASP  84           HB3      ASP  84   9.234   9.845  -3.863
  656    H    HIS  85           H        HIS  85   7.786  13.512  -4.563
  657    HA   HIS  85           HA       HIS  85   7.187  13.585  -1.656
  658    HB2  HIS  85           HB2      HIS  85   7.731  16.021  -3.403
  659    HB3  HIS  85           HB3      HIS  85   6.921  16.090  -1.841
  660    HD1  HIS  85           HD1      HIS  85   8.455  15.503   0.345
  661    HD2  HIS  85           HD2      HIS  85  10.404  15.886  -3.368
  662    HE1  HIS  85           HE1      HIS  85  10.939  15.773   0.870
  Start of MODEL    2
    1    H2   PRO   1           H2       PRO   1  -0.940   3.523   0.551
    2    H3   PRO   1           H3       PRO   1  -1.300   3.938   2.106
    3    HA   PRO   1           HA       PRO   1  -1.014   1.765   2.893
    4    HB2  PRO   1           HB2      PRO   1  -0.686   0.647   0.117
    5    HB3  PRO   1           HB3      PRO   1  -1.429  -0.091   1.566
    6    HG2  PRO   1           HG2      PRO   1  -2.698   1.481  -0.554
    7    HG3  PRO   1           HG3      PRO   1  -3.502   0.758   0.872
    8    HD2  PRO   1           HD2      PRO   1  -3.294   3.469   0.529
    9    HD3  PRO   1           HD3      PRO   1  -3.280   2.683   2.131
   10    H    GLY   2           H        GLY   2   0.955   0.351   2.989
   11    HA2  GLY   2           HA2      GLY   2   3.407   1.933   2.529
   12    HA3  GLY   2           HA3      GLY   2   3.245   0.378   3.394
   13    H    SER   3           H        SER   3   1.753  -0.628   0.861
   14    HA   SER   3           HA       SER   3   4.067  -1.809  -0.410
   15    HB2  SER   3           HB2      SER   3   1.134  -1.928  -1.192
   16    HB3  SER   3           HB3      SER   3   2.435  -2.969  -1.802
   17    HG   SER   3           HG       SER   3   1.241  -3.956  -0.071
   18    H    ALA   4           H        ALA   4   5.313  -0.741  -1.818
   19    HA   ALA   4           HA       ALA   4   4.269   0.497  -4.241
   20    HB1  ALA   4           HB1      ALA   4   5.290   2.729  -3.770
   21    HB2  ALA   4           HB2      ALA   4   4.009   2.359  -2.602
   22    HB3  ALA   4           HB3      ALA   4   5.703   2.195  -2.131
   23    H    GLU   5           H        GLU   5   5.992   1.179  -5.686
   24    HA   GLU   5           HA       GLU   5   8.735   0.200  -5.160
   25    HB2  GLU   5           HB2      GLU   5   7.079  -0.665  -7.565
   26    HB3  GLU   5           HB3      GLU   5   8.818  -0.913  -7.373
   27    HG2  GLU   5           HG2      GLU   5   8.401  -2.307  -5.357
   28    HG3  GLU   5           HG3      GLU   5   6.657  -2.141  -5.601
   29    H    ILE   6           H        ILE   6  10.280   1.063  -6.617
   30    HA   ILE   6           HA       ILE   6   9.471   3.475  -8.207
   31    HB   ILE   6           HB       ILE   6  12.119   2.735  -6.895
   32   HG12  ILE   6          2HG1      ILE   6  10.535   3.518  -5.225
   33   HG13  ILE   6          3HG1      ILE   6  11.858   4.651  -5.445
   34   HG21  ILE   6          1HG2      ILE   6  11.476   5.139  -8.633
   35   HG22  ILE   6          2HG2      ILE   6  12.913   5.009  -7.586
   36   HG23  ILE   6          3HG2      ILE   6  12.690   3.878  -8.917
   37   HD11  ILE   6          3HD1      ILE   6   9.713   5.798  -5.142
   38   HD12  ILE   6          1HD1      ILE   6  10.389   6.161  -6.741
   39   HD13  ILE   6          2HD1      ILE   6   9.044   4.998  -6.563
   40    H    ASP   7           H        ASP   7  10.146   3.570 -10.344
   41    HA   ASP   7           HA       ASP   7  11.121   1.092 -11.618
   42    HB2  ASP   7           HB2      ASP   7   9.361   2.388 -12.719
   43    HB3  ASP   7           HB3      ASP   7  10.390   3.825 -12.750
   44    H    TYR   8           H        TYR   8  13.178   0.755 -10.926
   45    HA   TYR   8           HA       TYR   8  15.158   2.834 -10.701
   46    HB2  TYR   8           HB2      TYR   8  15.431  -0.190 -10.489
   47    HB3  TYR   8           HB3      TYR   8  16.646   0.986 -10.023
   48    HD1  TYR   8           HD2      TYR   8  15.877   2.845  -8.284
   49    HD2  TYR   8           HD1      TYR   8  14.013  -1.017  -8.791
   50    HE1  TYR   8           HE2      TYR   8  15.032   2.945  -5.939
   51    HE2  TYR   8           HE1      TYR   8  13.111  -0.880  -6.482
   52    HH   TYR   8           HH       TYR   8  13.008   0.323  -4.549
   53    H    SER   9           H        SER   9  14.427   3.142 -13.240
   54    HA   SER   9           HA       SER   9  16.002   1.813 -15.247
   55    HB2  SER   9           HB2      SER   9  15.446   3.817 -16.610
   56    HB3  SER   9           HB3      SER   9  14.040   3.073 -15.830
   57    HG   SER   9           HG       SER   9  13.994   5.355 -15.626
   58    H    ASP  10           H        ASP  10  16.823   4.312 -12.937
   59    HA   ASP  10           HA       ASP  10  19.271   5.172 -14.292
   60    HB2  ASP  10           HB2      ASP  10  18.112   5.725 -11.530
   61    HB3  ASP  10           HB3      ASP  10  19.569   6.487 -12.157
   62    H    ALA  11           H        ALA  11  18.650   2.351 -12.471
   63    HA   ALA  11           HA       ALA  11  20.907   2.304 -10.760
   64    HB1  ALA  11           HB1      ALA  11  18.957   0.812 -10.479
   65    HB2  ALA  11           HB2      ALA  11  19.402  -0.078 -11.956
   66    HB3  ALA  11           HB3      ALA  11  20.467  -0.102 -10.540
   67    HA   PRO  12           HA       PRO  12  24.199   1.448 -13.701
   68    HB2  PRO  12           HB2      PRO  12  26.242   0.858 -12.017
   69    HB3  PRO  12           HB3      PRO  12  25.544   2.504 -12.113
   70    HG2  PRO  12           HG2      PRO  12  24.883   0.316 -10.100
   71    HG3  PRO  12           HG3      PRO  12  25.309   2.023  -9.766
   72    HD2  PRO  12           HD2      PRO  12  22.716   1.170  -9.917
   73    HD3  PRO  12           HD3      PRO  12  23.202   2.788 -10.485
   74    H    ASP  13           H        ASP  13  25.455  -0.336 -14.517
   75    HA   ASP  13           HA       ASP  13  24.155  -2.830 -14.570
   76    HB2  ASP  13           HB2      ASP  13  27.015  -2.083 -15.290
   77    HB3  ASP  13           HB3      ASP  13  26.228  -3.600 -15.733
   78    H    GLU  14           H        GLU  14  26.684  -1.763 -12.376
   79    HA   GLU  14           HA       GLU  14  27.405  -4.398 -11.414
   80    HB2  GLU  14           HB2      GLU  14  28.730  -3.255  -9.773
   81    HB3  GLU  14           HB3      GLU  14  28.941  -2.503 -11.349
   82    HG2  GLU  14           HG2      GLU  14  27.283  -0.711 -10.622
   83    HG3  GLU  14           HG3      GLU  14  27.286  -1.431  -9.019
   84    H    PHE  15           H        PHE  15  24.678  -2.403 -10.741
   85    HA   PHE  15           HA       PHE  15  24.021  -3.862  -8.211
   86    HB2  PHE  15           HB2      PHE  15  22.716  -1.512  -9.631
   87    HB3  PHE  15           HB3      PHE  15  22.060  -2.297  -8.206
   88    HD1  PHE  15           HD1      PHE  15  25.493  -2.337  -7.462
   89    HD2  PHE  15           HD2      PHE  15  22.140   0.359  -7.861
   90    HE1  PHE  15           HE1      PHE  15  26.610  -0.730  -5.964
   91    HE2  PHE  15           HE2      PHE  15  23.290   1.974  -6.376
   92    HZ   PHE  15           HZ       PHE  15  25.511   1.444  -5.413
   93    H    ARG  16           H        ARG  16  23.671  -4.382 -11.517
   94    HA   ARG  16           HA       ARG  16  20.921  -5.477 -11.295
   95    HB2  ARG  16           HB2      ARG  16  22.607  -4.738 -13.696
   96    HB3  ARG  16           HB3      ARG  16  21.029  -5.537 -13.803
   97    HG2  ARG  16           HG2      ARG  16  19.895  -3.644 -12.781
   98    HG3  ARG  16           HG3      ARG  16  21.432  -2.839 -12.433
   99    HD2  ARG  16           HD2      ARG  16  21.941  -2.796 -14.877
  100    HD3  ARG  16           HD3      ARG  16  20.345  -3.481 -15.215
  101    HE   ARG  16           HE       ARG  16  21.045  -0.754 -14.350
  102   HH11  ARG  16          1HH2      ARG  16  18.288  -2.980 -14.811
  103   HH12  ARG  16          2HH2      ARG  16  17.166  -1.651 -14.848
  104   HH21  ARG  16          1HH1      ARG  16  19.596   0.810 -14.440
  105   HH22  ARG  16          2HH1      ARG  16  17.884   0.474 -14.534
  106    H    ASP  17           H        ASP  17  20.386  -7.513 -12.142
  107    HA   ASP  17           HA       ASP  17  22.517  -9.545 -12.200
  108    HB2  ASP  17           HB2      ASP  17  20.438 -10.989 -13.040
  109    HB3  ASP  17           HB3      ASP  17  20.826 -10.694 -11.361
  110    HA   PRO  18           HA       PRO  18  23.136  -9.096 -16.568
  111    HB2  PRO  18           HB2      PRO  18  24.494 -11.377 -17.198
  112    HB3  PRO  18           HB3      PRO  18  25.185 -10.078 -16.168
  113    HG2  PRO  18           HG2      PRO  18  23.844 -12.652 -15.271
  114    HG3  PRO  18           HG3      PRO  18  25.404 -11.963 -14.715
  115    HD2  PRO  18           HD2      PRO  18  23.088 -11.596 -13.341
  116    HD3  PRO  18           HD3      PRO  18  24.336 -10.306 -13.440
  117    H    LEU  19           H        LEU  19  21.399 -11.978 -15.406
  118    HA   LEU  19           HA       LEU  19  20.583 -12.872 -18.049
  119    HB2  LEU  19           HB2      LEU  19  20.880 -14.118 -15.689
  120    HB3  LEU  19           HB3      LEU  19  19.192 -13.703 -15.484
  121    HG   LEU  19           HG       LEU  19  20.362 -15.291 -17.814
  122   HD11  LEU  19          1HD1      LEU  19  18.822 -16.207 -15.347
  123   HD12  LEU  19          2HD1      LEU  19  20.548 -16.499 -15.681
  124   HD13  LEU  19          3HD1      LEU  19  19.320 -17.245 -16.705
  125   HD21  LEU  19          3HD2      LEU  19  17.976 -15.948 -18.242
  126   HD22  LEU  19          1HD2      LEU  19  18.293 -14.239 -18.550
  127   HD23  LEU  19          2HD2      LEU  19  17.461 -14.726 -17.052
  128    H    MET  20           H        MET  20  18.900 -11.286 -15.335
  129    HA   MET  20           HA       MET  20  16.494 -10.873 -17.025
  130    HB2  MET  20           HB2      MET  20  17.001 -10.974 -14.027
  131    HB3  MET  20           HB3      MET  20  15.479 -10.419 -14.695
  132    HG2  MET  20           HG2      MET  20  16.760 -13.140 -15.155
  133    HG3  MET  20           HG3      MET  20  15.443 -12.805 -14.041
  134    HE1  MET  20           HE1      MET  20  12.394 -12.131 -16.368
  135    HE2  MET  20           HE2      MET  20  13.013 -12.240 -14.708
  136    HE3  MET  20           HE3      MET  20  13.486 -10.872 -15.741
  137    H    ASP  21           H        ASP  21  19.059  -8.954 -15.793
  138    HA   ASP  21           HA       ASP  21  19.624  -6.823 -16.113
  139    HB2  ASP  21           HB2      ASP  21  18.466  -7.135 -18.326
  140    HB3  ASP  21           HB3      ASP  21  17.041  -6.355 -17.638
  141    H    THR  22           H        THR  22  17.487  -7.710 -13.964
  142    HA   THR  22           HA       THR  22  16.378  -5.069 -13.161
  143    HB   THR  22           HB       THR  22  15.064  -6.261 -11.539
  144    HG1  THR  22           HG1      THR  22  16.775  -8.373 -12.204
  145   HG21  THR  22          1HG2      THR  22  14.249  -6.198 -13.913
  146   HG22  THR  22          2HG2      THR  22  13.618  -7.546 -12.957
  147   HG23  THR  22          3HG2      THR  22  14.903  -7.833 -14.139
  148    H    LEU  23           H        LEU  23  16.534  -4.393 -10.898
  149    HA   LEU  23           HA       LEU  23  19.263  -4.425  -9.948
  150    HB2  LEU  23           HB2      LEU  23  17.388  -2.578  -9.807
  151    HB3  LEU  23           HB3      LEU  23  16.879  -3.428  -8.355
  152    HG   LEU  23           HG       LEU  23  19.622  -2.221  -8.903
  153   HD11  LEU  23          1HD1      LEU  23  18.959  -0.519  -7.236
  154   HD12  LEU  23          2HD1      LEU  23  17.363  -1.293  -7.078
  155   HD13  LEU  23          3HD1      LEU  23  17.845  -0.555  -8.619
  156   HD21  LEU  23          3HD2      LEU  23  19.889  -4.078  -7.319
  157   HD22  LEU  23          1HD2      LEU  23  18.567  -3.448  -6.310
  158   HD23  LEU  23          2HD2      LEU  23  20.089  -2.541  -6.510
  159    H    MET  24           H        MET  24  20.141  -6.125  -8.927
  160    HA   MET  24           HA       MET  24  18.514  -8.348  -8.226
  161    HB2  MET  24           HB2      MET  24  20.569  -9.501  -7.662
  162    HB3  MET  24           HB3      MET  24  20.669  -8.666  -9.210
  163    HG2  MET  24           HG2      MET  24  21.942  -6.834  -8.073
  164    HG3  MET  24           HG3      MET  24  21.944  -7.776  -6.581
  165    HE1  MET  24           HE1      MET  24  24.477  -6.769  -7.266
  166    HE2  MET  24           HE2      MET  24  25.564  -7.646  -8.365
  167    HE3  MET  24           HE3      MET  24  24.291  -6.611  -9.026
  168    H    THR  25           H        THR  25  20.140  -6.062  -6.123
  169    HA   THR  25           HA       THR  25  20.338  -5.679  -3.953
  170    HB   THR  25           HB       THR  25  18.011  -5.024  -4.368
  171    HG1  THR  25           HG1      THR  25  18.817  -5.878  -1.804
  172   HG21  THR  25          1HG2      THR  25  16.737  -7.044  -4.564
  173   HG22  THR  25          2HG2      THR  25  16.232  -6.236  -3.074
  174   HG23  THR  25          3HG2      THR  25  17.314  -7.640  -2.986
  175    H    ASP  26           H        ASP  26  19.720  -8.996  -4.563
  176    HA   ASP  26           HA       ASP  26  21.261  -9.674  -2.081
  177    HB2  ASP  26           HB2      ASP  26  19.258 -11.330  -3.639
  178    HB3  ASP  26           HB3      ASP  26  20.349 -11.970  -2.397
  179    HA   PRO  27           HA       PRO  27  24.078 -10.520  -5.691
  180    HB2  PRO  27           HB2      PRO  27  26.269  -9.163  -4.811
  181    HB3  PRO  27           HB3      PRO  27  24.946  -8.371  -5.703
  182    HG2  PRO  27           HG2      PRO  27  25.352  -8.421  -2.699
  183    HG3  PRO  27           HG3      PRO  27  24.952  -7.023  -3.751
  184    HD2  PRO  27           HD2      PRO  27  23.070  -8.400  -2.346
  185    HD3  PRO  27           HD3      PRO  27  22.731  -7.688  -3.953
  186    H    VAL  28           H        VAL  28  25.260 -12.332  -5.613
  187    HA   VAL  28           HA       VAL  28  26.361 -13.364  -3.025
  188    HB   VAL  28           HB       VAL  28  24.692 -14.818  -5.127
  189   HG11  VAL  28          1HG1      VAL  28  26.466 -16.363  -4.379
  190   HG12  VAL  28          2HG1      VAL  28  26.101 -15.972  -2.678
  191   HG13  VAL  28          3HG1      VAL  28  24.916 -16.834  -3.688
  192   HG21  VAL  28          3HG2      VAL  28  23.189 -15.282  -3.213
  193   HG22  VAL  28          1HG2      VAL  28  24.220 -14.312  -2.152
  194   HG23  VAL  28          2HG2      VAL  28  23.334 -13.545  -3.493
  195    H    ARG  29           H        ARG  29  28.306 -14.216  -3.112
  196    HA   ARG  29           HA       ARG  29  29.942 -14.010  -5.536
  197    HB2  ARG  29           HB2      ARG  29  30.656 -13.124  -3.346
  198    HB3  ARG  29           HB3      ARG  29  30.532 -14.730  -2.639
  199    HG2  ARG  29           HG2      ARG  29  32.366 -15.515  -4.164
  200    HG3  ARG  29           HG3      ARG  29  32.525 -13.847  -4.774
  201    HD2  ARG  29           HD2      ARG  29  33.006 -13.067  -2.459
  202    HD3  ARG  29           HD3      ARG  29  32.759 -14.712  -1.861
  203    HE   ARG  29           HE       ARG  29  34.830 -14.415  -3.922
  204   HH11  ARG  29          1HH1      ARG  29  34.193 -14.638  -0.416
  205   HH12  ARG  29          2HH1      ARG  29  35.868 -14.973  -0.068
  206   HH21  ARG  29          1HH2      ARG  29  36.948 -14.879  -3.365
  207   HH22  ARG  29          2HH2      ARG  29  37.400 -15.117  -1.701
  208    H    LEU  30           H        LEU  30  30.636 -15.620  -6.702
  209    HA   LEU  30           HA       LEU  30  30.142 -18.485  -6.022
  210    HB2  LEU  30           HB2      LEU  30  30.919 -17.179  -8.670
  211    HB3  LEU  30           HB3      LEU  30  30.392 -18.832  -8.439
  212    HG   LEU  30           HG       LEU  30  28.700 -16.310  -8.176
  213   HD11  LEU  30          1HD1      LEU  30  29.179 -17.085 -10.480
  214   HD12  LEU  30          2HD1      LEU  30  27.466 -17.242 -10.061
  215   HD13  LEU  30          3HD1      LEU  30  28.492 -18.678 -10.067
  216   HD21  LEU  30          3HD2      LEU  30  27.911 -17.899  -6.454
  217   HD22  LEU  30          1HD2      LEU  30  27.848 -19.192  -7.661
  218   HD23  LEU  30          2HD2      LEU  30  26.755 -17.794  -7.786
  219    HA   PRO  31           HA       PRO  31  34.161 -19.155  -4.874
  220    HB2  PRO  31           HB2      PRO  31  35.004 -21.560  -5.982
  221    HB3  PRO  31           HB3      PRO  31  33.761 -21.403  -4.705
  222    HG2  PRO  31           HG2      PRO  31  33.332 -21.618  -7.702
  223    HG3  PRO  31           HG3      PRO  31  32.542 -22.563  -6.395
  224    HD2  PRO  31           HD2      PRO  31  31.349 -20.437  -7.501
  225    HD3  PRO  31           HD3      PRO  31  31.247 -20.675  -5.730
  226    H    SER  32           H        SER  32  34.028 -19.163  -8.449
  227    HA   SER  32           HA       SER  32  36.878 -18.628  -8.775
  228    HB2  SER  32           HB2      SER  32  34.528 -18.243 -10.668
  229    HB3  SER  32           HB3      SER  32  36.241 -18.128 -11.118
  230    HG   SER  32           HG       SER  32  36.500 -20.314 -10.554
  231    H    GLY  33           H        GLY  33  34.628 -16.660  -7.340
  232    HA2  GLY  33           HA2      GLY  33  34.975 -14.465  -6.616
  233    HA3  GLY  33           HA3      GLY  33  36.179 -14.197  -7.896
  234    H    THR  34           H        THR  34  33.405 -15.547  -9.237
  235    HA   THR  34           HA       THR  34  32.481 -13.052 -10.491
  236    HB   THR  34           HB       THR  34  31.502 -15.936 -10.637
  237    HG1  THR  34           HG1      THR  34  33.554 -15.407 -11.559
  238   HG21  THR  34          1HG2      THR  34  29.605 -14.497 -11.211
  239   HG22  THR  34          2HG2      THR  34  30.279 -15.236 -12.662
  240   HG23  THR  34          3HG2      THR  34  30.626 -13.525 -12.295
  241    H    VAL  35           H        VAL  35  30.538 -12.022 -10.110
  242    HA   VAL  35           HA       VAL  35  29.021 -12.794  -7.643
  243    HB   VAL  35           HB       VAL  35  29.173 -10.062  -8.961
  244   HG11  VAL  35          1HG1      VAL  35  27.929  -9.294  -6.934
  245   HG12  VAL  35          2HG1      VAL  35  26.966 -10.386  -7.921
  246   HG13  VAL  35          3HG1      VAL  35  27.732 -10.993  -6.434
  247   HG21  VAL  35          3HG2      VAL  35  30.300  -9.412  -6.806
  248   HG22  VAL  35          1HG2      VAL  35  30.345 -11.128  -6.347
  249   HG23  VAL  35          2HG2      VAL  35  31.255 -10.552  -7.764
  250    H    MET  36           H        MET  36  26.928 -13.225  -7.773
  251    HA   MET  36           HA       MET  36  25.369 -12.788 -10.263
  252    HB2  MET  36           HB2      MET  36  26.422 -15.131 -10.162
  253    HB3  MET  36           HB3      MET  36  25.468 -15.415  -8.714
  254    HG2  MET  36           HG2      MET  36  24.520 -16.382 -10.817
  255    HG3  MET  36           HG3      MET  36  23.408 -15.355  -9.950
  256    HE1  MET  36           HE1      MET  36  25.602 -14.126 -13.834
  257    HE2  MET  36           HE2      MET  36  26.378 -13.983 -12.241
  258    HE3  MET  36           HE3      MET  36  25.952 -15.580 -12.876
  259    H    ASP  37           H        ASP  37  23.052 -13.146  -9.871
  260    HA   ASP  37           HA       ASP  37  22.095 -12.024  -7.307
  261    HB2  ASP  37           HB2      ASP  37  20.996 -11.168  -9.200
  262    HB3  ASP  37           HB3      ASP  37  20.880 -12.760  -9.963
  263    H    ARG  38           H        ARG  38  21.129 -13.128  -5.695
  264    HA   ARG  38           HA       ARG  38  21.514 -15.847  -5.255
  265    HB2  ARG  38           HB2      ARG  38  20.912 -14.022  -3.578
  266    HB3  ARG  38           HB3      ARG  38  19.227 -14.247  -4.071
  267    HG2  ARG  38           HG2      ARG  38  19.564 -16.750  -3.506
  268    HG3  ARG  38           HG3      ARG  38  21.105 -16.288  -2.796
  269    HD2  ARG  38           HD2      ARG  38  19.873 -14.733  -1.290
  270    HD3  ARG  38           HD3      ARG  38  18.340 -15.292  -1.981
  271    HE   ARG  38           HE       ARG  38  19.741 -17.581  -1.131
  272   HH11  ARG  38          1HH1      ARG  38  18.252 -14.773   0.434
  273   HH12  ARG  38          2HH1      ARG  38  17.977 -15.645   1.913
  274   HH21  ARG  38          1HH2      ARG  38  19.370 -18.634   0.809
  275   HH22  ARG  38          2HH2      ARG  38  18.578 -17.796   2.115
  276    H    SER  39           H        SER  39  18.502 -14.296  -6.551
  277    HA   SER  39           HA       SER  39  16.974 -16.734  -6.517
  278    HB2  SER  39           HB2      SER  39  16.498 -14.198  -8.109
  279    HB3  SER  39           HB3      SER  39  15.347 -15.517  -7.866
  280    HG   SER  39           HG       SER  39  15.049 -13.775  -6.361
  281    H    ILE  40           H        ILE  40  18.837 -15.135  -9.158
  282    HA   ILE  40           HA       ILE  40  18.211 -17.134 -11.154
  283    HB   ILE  40           HB       ILE  40  20.422 -15.057 -10.902
  284   HG12  ILE  40          2HG1      ILE  40  18.171 -15.283 -12.946
  285   HG13  ILE  40          3HG1      ILE  40  17.878 -14.554 -11.372
  286   HG21  ILE  40          1HG2      ILE  40  20.966 -15.553 -13.307
  287   HG22  ILE  40          2HG2      ILE  40  21.424 -16.849 -12.212
  288   HG23  ILE  40          3HG2      ILE  40  19.955 -17.000 -13.207
  289   HD11  ILE  40          3HD1      ILE  40  20.021 -13.551 -13.283
  290   HD12  ILE  40          1HD1      ILE  40  18.383 -12.877 -13.117
  291   HD13  ILE  40          2HD1      ILE  40  19.503 -12.836 -11.752
  292    H    ILE  41           H        ILE  41  21.001 -16.958  -8.844
  293    HA   ILE  41           HA       ILE  41  22.114 -19.376  -9.961
  294    HB   ILE  41           HB       ILE  41  23.497 -17.769  -8.702
  295   HG12  ILE  41          2HG1      ILE  41  24.883 -19.380  -7.476
  296   HG13  ILE  41          3HG1      ILE  41  23.603 -20.580  -7.530
  297   HG21  ILE  41          1HG2      ILE  41  23.607 -17.781  -6.267
  298   HG22  ILE  41          2HG2      ILE  41  22.024 -17.261  -6.810
  299   HG23  ILE  41          3HG2      ILE  41  22.244 -18.904  -6.169
  300   HD11  ILE  41          3HD1      ILE  41  23.806 -20.684  -9.999
  301   HD12  ILE  41          1HD1      ILE  41  25.022 -19.376  -9.944
  302   HD13  ILE  41          2HD1      ILE  41  25.360 -20.969  -9.230
  303    H    LEU  42           H        LEU  42  19.935 -18.960  -7.083
  304    HA   LEU  42           HA       LEU  42  19.887 -21.794  -6.615
  305    HB2  LEU  42           HB2      LEU  42  18.293 -21.421  -4.963
  306    HB3  LEU  42           HB3      LEU  42  19.365 -20.039  -4.960
  307    HG   LEU  42           HG       LEU  42  17.495 -18.872  -6.375
  308   HD11  LEU  42          1HD1      LEU  42  15.196 -19.626  -5.804
  309   HD12  LEU  42          2HD1      LEU  42  15.870 -21.068  -5.010
  310   HD13  LEU  42          3HD1      LEU  42  16.030 -20.858  -6.755
  311   HD21  LEU  42          3HD2      LEU  42  18.146 -18.241  -4.069
  312   HD22  LEU  42          1HD2      LEU  42  17.064 -19.483  -3.416
  313   HD23  LEU  42          2HD2      LEU  42  16.405 -18.094  -4.310
  314    H    ARG  43           H        ARG  43  17.921 -19.787  -8.793
  315    HA   ARG  43           HA       ARG  43  16.072 -21.832  -9.569
  316    HB2  ARG  43           HB2      ARG  43  15.714 -19.460 -10.081
  317    HB3  ARG  43           HB3      ARG  43  17.140 -19.447 -11.130
  318    HG2  ARG  43           HG2      ARG  43  16.023 -21.179 -12.589
  319    HG3  ARG  43           HG3      ARG  43  14.583 -21.052 -11.569
  320    HD2  ARG  43           HD2      ARG  43  15.895 -18.779 -13.121
  321    HD3  ARG  43           HD3      ARG  43  14.519 -19.708 -13.708
  322    HE   ARG  43           HE       ARG  43  14.498 -17.587 -11.690
  323   HH11  ARG  43          1HH1      ARG  43  12.626 -20.346 -12.879
  324   HH12  ARG  43          2HH1      ARG  43  11.137 -19.716 -12.236
  325   HH21  ARG  43          1HH2      ARG  43  12.542 -16.841 -10.909
  326   HH22  ARG  43          2HH2      ARG  43  11.096 -17.769 -11.135
  327    H    HIS  44           H        HIS  44  19.321 -20.893 -10.918
  328    HA   HIS  44           HA       HIS  44  19.227 -22.903 -12.963
  329    HB2  HIS  44           HB2      HIS  44  20.745 -20.835 -12.787
  330    HB3  HIS  44           HB3      HIS  44  21.796 -21.824 -11.766
  331    HD1  HIS  44           HD1      HIS  44  23.290 -23.629 -13.116
  332    HD2  HIS  44           HD2      HIS  44  20.323 -21.665 -15.358
  333    HE1  HIS  44           HE1      HIS  44  23.667 -24.298 -15.543
  334    H    LEU  45           H        LEU  45  20.569 -22.987  -9.631
  335    HA   LEU  45           HA       LEU  45  21.585 -25.657  -9.671
  336    HB2  LEU  45           HB2      LEU  45  20.756 -23.652  -7.597
  337    HB3  LEU  45           HB3      LEU  45  20.948 -25.319  -7.085
  338    HG   LEU  45           HG       LEU  45  23.225 -25.415  -7.582
  339   HD11  LEU  45          1HD1      LEU  45  23.369 -24.367  -9.799
  340   HD12  LEU  45          2HD1      LEU  45  24.551 -23.688  -8.705
  341   HD13  LEU  45          3HD1      LEU  45  23.097 -22.766  -9.080
  342   HD21  LEU  45          3HD2      LEU  45  24.169 -23.519  -6.298
  343   HD22  LEU  45          1HD2      LEU  45  22.674 -24.132  -5.555
  344   HD23  LEU  45          2HD2      LEU  45  22.652 -22.627  -6.497
  345    H    LEU  46           H        LEU  46  18.266 -24.534  -9.032
  346    HA   LEU  46           HA       LEU  46  17.198 -27.085  -8.325
  347    HB2  LEU  46           HB2      LEU  46  16.114 -24.886  -7.922
  348    HB3  LEU  46           HB3      LEU  46  15.891 -24.674  -9.661
  349    HG   LEU  46           HG       LEU  46  14.364 -26.613  -9.719
  350   HD11  LEU  46          1HD1      LEU  46  14.711 -26.636  -6.685
  351   HD12  LEU  46          2HD1      LEU  46  15.175 -27.940  -7.808
  352   HD13  LEU  46          3HD1      LEU  46  13.470 -27.538  -7.596
  353   HD21  LEU  46          3HD2      LEU  46  12.487 -25.506  -8.567
  354   HD22  LEU  46          1HD2      LEU  46  13.494 -24.328  -9.426
  355   HD23  LEU  46          2HD2      LEU  46  13.635 -24.486  -7.661
  356    H    ASN  47           H        ASN  47  17.934 -25.704 -11.513
  357    HA   ASN  47           HA       ASN  47  16.697 -27.923 -12.996
  358    HB2  ASN  47           HB2      ASN  47  16.869 -25.655 -13.963
  359    HB3  ASN  47           HB3      ASN  47  18.631 -25.741 -13.897
  360   HD21  ASN  47          1HD2      ASN  47  19.770 -27.262 -15.359
  361   HD22  ASN  47          2HD2      ASN  47  18.921 -27.846 -16.776
  362    H    SER  48           H        SER  48  20.068 -26.918 -12.169
  363    HA   SER  48           HA       SER  48  21.032 -29.655 -12.016
  364    HB2  SER  48           HB2      SER  48  22.692 -29.360 -13.923
  365    HB3  SER  48           HB3      SER  48  21.009 -29.619 -14.389
  366    HG   SER  48           HG       SER  48  22.452 -27.157 -14.393
  367    HA   PRO  49           HA       PRO  49  23.834 -27.399  -9.480
  368    HB2  PRO  49           HB2      PRO  49  25.656 -29.268  -8.753
  369    HB3  PRO  49           HB3      PRO  49  23.926 -29.449  -8.369
  370    HG2  PRO  49           HG2      PRO  49  25.417 -30.653 -10.731
  371    HG3  PRO  49           HG3      PRO  49  24.361 -31.487  -9.536
  372    HD2  PRO  49           HD2      PRO  49  23.414 -30.621 -11.951
  373    HD3  PRO  49           HD3      PRO  49  22.416 -30.580 -10.466
  374    H    THR  50           H        THR  50  24.222 -26.195 -11.656
  375    HA   THR  50           HA       THR  50  27.140 -26.016 -12.120
  376    HB   THR  50           HB       THR  50  26.607 -25.629 -14.580
  377    HG1  THR  50           HG1      THR  50  24.710 -26.754 -15.287
  378   HG21  THR  50          1HG2      THR  50  26.147 -28.462 -13.561
  379   HG22  THR  50          2HG2      THR  50  27.735 -27.681 -13.758
  380   HG23  THR  50          3HG2      THR  50  26.717 -27.972 -15.173
  381    H    ASP  51           H        ASP  51  27.871 -24.092 -12.987
  382    HA   ASP  51           HA       ASP  51  26.613 -21.716 -12.047
  383    HB2  ASP  51           HB2      ASP  51  29.005 -22.082 -12.209
  384    HB3  ASP  51           HB3      ASP  51  28.925 -22.180 -13.960
  385    HA   PRO  52           HA       PRO  52  23.734 -21.001 -15.341
  386    HB2  PRO  52           HB2      PRO  52  23.152 -18.318 -14.986
  387    HB3  PRO  52           HB3      PRO  52  22.570 -19.637 -13.929
  388    HG2  PRO  52           HG2      PRO  52  24.963 -17.849 -13.504
  389    HG3  PRO  52           HG3      PRO  52  23.680 -18.292 -12.336
  390    HD2  PRO  52           HD2      PRO  52  26.044 -19.585 -12.333
  391    HD3  PRO  52           HD3      PRO  52  24.514 -20.492 -12.117
  392    H    PHE  53           H        PHE  53  26.792 -19.336 -15.467
  393    HA   PHE  53           HA       PHE  53  26.342 -18.809 -18.395
  394    HB2  PHE  53           HB2      PHE  53  27.760 -17.073 -16.338
  395    HB3  PHE  53           HB3      PHE  53  27.846 -16.823 -18.073
  396    HD1  PHE  53           HD2      PHE  53  25.901 -16.061 -19.381
  397    HD2  PHE  53           HD1      PHE  53  25.705 -16.508 -15.105
  398    HE1  PHE  53           HE2      PHE  53  23.802 -14.721 -19.332
  399    HE2  PHE  53           HE1      PHE  53  23.566 -15.221 -15.059
  400    HZ   PHE  53           HZ       PHE  53  22.639 -14.309 -17.185
  401    H    ASN  54           H        ASN  54  28.557 -20.033 -15.933
  402    HA   ASN  54           HA       ASN  54  30.723 -20.369 -17.963
  403    HB2  ASN  54           HB2      ASN  54  31.148 -19.088 -15.891
  404    HB3  ASN  54           HB3      ASN  54  30.762 -20.521 -14.926
  405   HD21  ASN  54          1HD2      ASN  54  33.008 -19.428 -17.558
  406   HD22  ASN  54          2HD2      ASN  54  34.335 -20.425 -17.008
  407    H    ARG  55           H        ARG  55  28.410 -22.289 -16.200
  408    HA   ARG  55           HA       ARG  55  27.920 -24.437 -16.069
  409    HB2  ARG  55           HB2      ARG  55  29.656 -24.684 -18.559
  410    HB3  ARG  55           HB3      ARG  55  28.604 -25.960 -17.969
  411    HG2  ARG  55           HG2      ARG  55  27.608 -23.193 -18.744
  412    HG3  ARG  55           HG3      ARG  55  27.638 -24.590 -19.820
  413    HD2  ARG  55           HD2      ARG  55  26.187 -25.851 -18.252
  414    HD3  ARG  55           HD3      ARG  55  26.106 -24.448 -17.178
  415    HE   ARG  55           HE       ARG  55  24.762 -24.829 -19.770
  416   HH11  ARG  55          1HH1      ARG  55  25.500 -22.503 -17.212
  417   HH12  ARG  55          2HH1      ARG  55  24.370 -21.337 -17.837
  418   HH21  ARG  55          1HH2      ARG  55  23.267 -23.304 -20.471
  419   HH22  ARG  55          2HH2      ARG  55  23.105 -21.797 -19.613
  420    H    GLN  56           H        GLN  56  30.727 -23.565 -14.895
  421    HA   GLN  56           HA       GLN  56  31.997 -26.100 -14.275
  422    HB2  GLN  56           HB2      GLN  56  33.054 -24.895 -12.441
  423    HB3  GLN  56           HB3      GLN  56  33.150 -23.959 -13.928
  424    HG2  GLN  56           HG2      GLN  56  31.333 -22.478 -13.146
  425    HG3  GLN  56           HG3      GLN  56  31.091 -23.481 -11.706
  426   HE21  GLN  56          1HE2      GLN  56  33.604 -21.443 -13.349
  427   HE22  GLN  56          2HE2      GLN  56  34.367 -20.965 -11.820
  428    H    MET  57           H        MET  57  31.862 -27.221 -12.188
  429    HA   MET  57           HA       MET  57  29.245 -27.834 -11.215
  430    HB2  MET  57           HB2      MET  57  31.110 -29.366 -10.947
  431    HB3  MET  57           HB3      MET  57  32.023 -28.178 -10.012
  432    HG2  MET  57           HG2      MET  57  31.102 -29.879  -8.546
  433    HG3  MET  57           HG3      MET  57  30.411 -28.316  -8.171
  434    HE1  MET  57           HE1      MET  57  29.151 -30.726  -6.869
  435    HE2  MET  57           HE2      MET  57  28.437 -29.094  -6.790
  436    HE3  MET  57           HE3      MET  57  27.414 -30.490  -7.189
  437    H    LEU  58           H        LEU  58  27.973 -26.962  -9.663
  438    HA   LEU  58           HA       LEU  58  28.947 -24.885  -7.810
  439    HB2  LEU  58           HB2      LEU  58  28.305 -24.013 -10.279
  440    HB3  LEU  58           HB3      LEU  58  26.681 -24.138  -9.646
  441    HG   LEU  58           HG       LEU  58  27.446 -21.891  -9.481
  442   HD11  LEU  58          1HD1      LEU  58  26.145 -22.730  -7.484
  443   HD12  LEU  58          2HD1      LEU  58  27.177 -21.328  -7.177
  444   HD13  LEU  58          3HD1      LEU  58  27.696 -22.919  -6.634
  445   HD21  LEU  58          3HD2      LEU  58  29.876 -22.285  -9.565
  446   HD22  LEU  58          1HD2      LEU  58  29.851 -22.809  -7.863
  447   HD23  LEU  58          2HD2      LEU  58  29.407 -21.152  -8.290
  448    H    THR  59           H        THR  59  27.802 -24.969  -5.918
  449    HA   THR  59           HA       THR  59  24.972 -25.678  -5.916
  450    HB   THR  59           HB       THR  59  26.302 -27.851  -5.739
  451    HG1  THR  59           HG1      THR  59  24.659 -28.598  -4.423
  452   HG21  THR  59          1HG2      THR  59  27.842 -26.989  -3.892
  453   HG22  THR  59          2HG2      THR  59  27.085 -28.570  -3.649
  454   HG23  THR  59          3HG2      THR  59  26.428 -27.162  -2.805
  455    H    GLU  60           H        GLU  60  24.244 -25.811  -3.540
  456    HA   GLU  60           HA       GLU  60  24.179 -23.168  -2.578
  457    HB2  GLU  60           HB2      GLU  60  23.591 -25.682  -0.968
  458    HB3  GLU  60           HB3      GLU  60  22.946 -24.071  -0.692
  459    HG2  GLU  60           HG2      GLU  60  21.812 -24.206  -2.947
  460    HG3  GLU  60           HG3      GLU  60  22.361 -25.885  -3.057
  461    H    SER  61           H        SER  61  26.549 -25.681  -1.797
  462    HA   SER  61           HA       SER  61  27.400 -24.474   0.755
  463    HB2  SER  61           HB2      SER  61  29.155 -26.173   0.695
  464    HB3  SER  61           HB3      SER  61  27.551 -26.869   0.440
  465    HG   SER  61           HG       SER  61  29.157 -27.694  -1.022
  466    H    MET  62           H        MET  62  28.026 -23.780  -2.550
  467    HA   MET  62           HA       MET  62  30.761 -22.684  -2.081
  468    HB2  MET  62           HB2      MET  62  29.151 -22.972  -4.656
  469    HB3  MET  62           HB3      MET  62  30.867 -22.570  -4.510
  470    HG2  MET  62           HG2      MET  62  31.305 -24.772  -3.457
  471    HG3  MET  62           HG3      MET  62  29.604 -25.198  -3.646
  472    HE1  MET  62           HE1      MET  62  31.346 -27.571  -6.174
  473    HE2  MET  62           HE2      MET  62  31.883 -27.050  -4.562
  474    HE3  MET  62           HE3      MET  62  30.171 -27.440  -4.848
  475    H    LEU  63           H        LEU  63  27.711 -21.489  -1.689
  476    HA   LEU  63           HA       LEU  63  28.054 -18.886  -3.020
  477    HB2  LEU  63           HB2      LEU  63  25.776 -19.984  -1.302
  478    HB3  LEU  63           HB3      LEU  63  25.724 -18.534  -2.302
  479    HG   LEU  63           HG       LEU  63  25.889 -21.421  -3.258
  480   HD11  LEU  63          1HD1      LEU  63  23.678 -20.663  -2.481
  481   HD12  LEU  63          2HD1      LEU  63  23.676 -20.938  -4.228
  482   HD13  LEU  63          3HD1      LEU  63  23.752 -19.275  -3.593
  483   HD21  LEU  63          3HD2      LEU  63  27.229 -20.100  -4.833
  484   HD22  LEU  63          1HD2      LEU  63  25.924 -18.882  -4.947
  485   HD23  LEU  63          2HD2      LEU  63  25.675 -20.534  -5.555
  486    H    GLU  64           H        GLU  64  27.970 -16.885  -1.966
  487    HA   GLU  64           HA       GLU  64  27.958 -16.643   0.963
  488    HB2  GLU  64           HB2      GLU  64  30.278 -17.218   0.598
  489    HB3  GLU  64           HB3      GLU  64  30.431 -16.036  -0.697
  490    HG2  GLU  64           HG2      GLU  64  30.116 -14.194   0.924
  491    HG3  GLU  64           HG3      GLU  64  29.870 -15.369   2.219
  492    HA   PRO  65           HA       PRO  65  25.864 -13.024  -0.855
  493    HB2  PRO  65           HB2      PRO  65  25.702 -12.273   2.065
  494    HB3  PRO  65           HB3      PRO  65  24.444 -12.147   0.789
  495    HG2  PRO  65           HG2      PRO  65  24.385 -14.203   2.561
  496    HG3  PRO  65           HG3      PRO  65  24.089 -14.527   0.819
  497    HD2  PRO  65           HD2      PRO  65  26.656 -14.909   2.388
  498    HD3  PRO  65           HD3      PRO  65  25.868 -16.010   1.217
  499    H    VAL  66           H        VAL  66  26.584 -11.030  -1.485
  500    HA   VAL  66           HA       VAL  66  29.271 -10.185  -0.598
  501    HB   VAL  66           HB       VAL  66  27.553  -9.168  -2.887
  502   HG11  VAL  66          1HG1      VAL  66  30.482  -8.622  -2.200
  503   HG12  VAL  66          2HG1      VAL  66  29.670  -8.145  -3.703
  504   HG13  VAL  66          3HG1      VAL  66  29.163  -7.433  -2.176
  505   HG21  VAL  66          3HG2      VAL  66  29.958 -11.030  -2.893
  506   HG22  VAL  66          1HG2      VAL  66  28.275 -11.515  -3.220
  507   HG23  VAL  66          2HG2      VAL  66  29.107 -10.421  -4.326
  508    HA   PRO  67           HA       PRO  67  27.132  -6.969   1.823
  509    HB2  PRO  67           HB2      PRO  67  29.154  -6.186   3.445
  510    HB3  PRO  67           HB3      PRO  67  28.348  -7.762   3.629
  511    HG2  PRO  67           HG2      PRO  67  30.961  -7.175   2.205
  512    HG3  PRO  67           HG3      PRO  67  30.617  -8.456   3.412
  513    HD2  PRO  67           HD2      PRO  67  30.549  -8.910   0.714
  514    HD3  PRO  67           HD3      PRO  67  29.458  -9.754   1.852
  515    H    GLU  68           H        GLU  68  30.292  -6.391   0.180
  516    HA   GLU  68           HA       GLU  68  30.159  -3.565   0.382
  517    HB2  GLU  68           HB2      GLU  68  31.988  -3.522  -1.208
  518    HB3  GLU  68           HB3      GLU  68  32.250  -4.780  -0.002
  519    HG2  GLU  68           HG2      GLU  68  31.533  -6.511  -1.617
  520    HG3  GLU  68           HG3      GLU  68  31.227  -5.266  -2.836
  521    H    LEU  69           H        LEU  69  28.466  -5.635  -1.791
  522    HA   LEU  69           HA       LEU  69  27.587  -3.317  -3.481
  523    HB2  LEU  69           HB2      LEU  69  27.216  -6.336  -3.724
  524    HB3  LEU  69           HB3      LEU  69  26.299  -5.187  -4.693
  525    HG   LEU  69           HG       LEU  69  29.340  -5.394  -4.693
  526   HD11  LEU  69          1HD1      LEU  69  28.256  -7.394  -5.623
  527   HD12  LEU  69          2HD1      LEU  69  29.041  -6.456  -6.901
  528   HD13  LEU  69          3HD1      LEU  69  27.277  -6.382  -6.708
  529   HD21  LEU  69          3HD2      LEU  69  29.153  -4.012  -6.773
  530   HD22  LEU  69          1HD2      LEU  69  28.646  -3.131  -5.336
  531   HD23  LEU  69          2HD2      LEU  69  27.417  -3.785  -6.435
  532    H    LYS  70           H        LYS  70  26.192  -5.836  -1.278
  533    HA   LYS  70           HA       LYS  70  23.528  -4.877  -1.387
  534    HB2  LYS  70           HB2      LYS  70  24.164  -7.006  -0.415
  535    HB3  LYS  70           HB3      LYS  70  25.057  -6.196   0.890
  536    HG2  LYS  70           HG2      LYS  70  23.000  -5.236   1.784
  537    HG3  LYS  70           HG3      LYS  70  22.052  -5.890   0.458
  538    HD2  LYS  70           HD2      LYS  70  23.649  -7.630   2.393
  539    HD3  LYS  70           HD3      LYS  70  21.982  -7.149   2.706
  540    HE2  LYS  70           HE2      LYS  70  22.869  -8.721   0.238
  541    HE3  LYS  70           HE3      LYS  70  22.236  -9.425   1.729
  542    HZ1  LYS  70           HZ1      LYS  70  20.204  -8.032   1.360
  543    HZ2  LYS  70           HZ2      LYS  70  20.414  -9.204   0.237
  544    HZ3  LYS  70           HZ3      LYS  70  20.774  -7.659  -0.139
  545    H    GLU  71           H        GLU  71  26.157  -3.757   0.774
  546    HA   GLU  71           HA       GLU  71  24.597  -1.874   2.263
  547    HB2  GLU  71           HB2      GLU  71  26.810  -2.826   2.918
  548    HB3  GLU  71           HB3      GLU  71  27.592  -1.851   1.667
  549    HG2  GLU  71           HG2      GLU  71  26.839   0.229   2.814
  550    HG3  GLU  71           HG3      GLU  71  25.957  -0.740   4.000
  551    H    GLN  72           H        GLN  72  26.377  -1.533  -0.824
  552    HA   GLN  72           HA       GLN  72  25.901   1.348  -1.056
  553    HB2  GLN  72           HB2      GLN  72  26.815  -0.757  -3.054
  554    HB3  GLN  72           HB3      GLN  72  26.669   0.952  -3.424
  555    HG2  GLN  72           HG2      GLN  72  28.499  -0.193  -1.275
  556    HG3  GLN  72           HG3      GLN  72  28.990   0.251  -2.904
  557   HE21  GLN  72          1HE2      GLN  72  28.224   1.491   0.309
  558   HE22  GLN  72          2HE2      GLN  72  28.596   3.170  -0.069
  559    H    ILE  73           H        ILE  73  24.351  -1.583  -2.397
  560    HA   ILE  73           HA       ILE  73  22.395  -0.248  -3.993
  561    HB   ILE  73           HB       ILE  73  22.507  -2.984  -2.665
  562   HG12  ILE  73          2HG1      ILE  73  22.549  -2.217  -5.609
  563   HG13  ILE  73          3HG1      ILE  73  24.017  -2.359  -4.650
  564   HG21  ILE  73          1HG2      ILE  73  20.286  -1.818  -4.381
  565   HG22  ILE  73          2HG2      ILE  73  20.514  -3.559  -4.157
  566   HG23  ILE  73          3HG2      ILE  73  20.153  -2.560  -2.764
  567   HD11  ILE  73          3HD1      ILE  73  23.768  -4.409  -5.845
  568   HD12  ILE  73          1HD1      ILE  73  23.432  -4.754  -4.146
  569   HD13  ILE  73          2HD1      ILE  73  22.095  -4.615  -5.318
  570    H    GLN  74           H        GLN  74  22.098  -1.366  -0.568
  571    HA   GLN  74           HA       GLN  74  19.397  -0.469  -0.363
  572    HB2  GLN  74           HB2      GLN  74  19.582  -0.896   2.007
  573    HB3  GLN  74           HB3      GLN  74  20.355  -2.169   1.078
  574    HG2  GLN  74           HG2      GLN  74  21.871  -1.863   2.813
  575    HG3  GLN  74           HG3      GLN  74  22.576  -0.910   1.535
  576   HE21  GLN  74          1HE2      GLN  74  23.611   0.808   2.534
  577   HE22  GLN  74          2HE2      GLN  74  22.888   1.756   3.835
  578    H    ALA  75           H        ALA  75  22.422   1.310   0.169
  579    HA   ALA  75           HA       ALA  75  21.172   3.672   1.286
  580    HB1  ALA  75           HB1      ALA  75  23.587   3.168   1.563
  581    HB2  ALA  75           HB2      ALA  75  23.817   3.281  -0.198
  582    HB3  ALA  75           HB3      ALA  75  23.361   4.716   0.739
  583    H    TRP  76           H        TRP  76  22.111   2.719  -2.056
  584    HA   TRP  76           HA       TRP  76  21.241   5.148  -3.309
  585    HB2  TRP  76           HB2      TRP  76  22.840   3.494  -4.233
  586    HB3  TRP  76           HB3      TRP  76  21.514   2.365  -4.476
  587    HD1  TRP  76           HD1      TRP  76  22.911   5.667  -5.766
  588    HE1  TRP  76           HE1      TRP  76  21.929   6.221  -8.072
  589    HE3  TRP  76           HE3      TRP  76  19.487   1.885  -6.083
  590    HZ2  TRP  76           HZ2      TRP  76  19.830   5.203  -9.792
  591    HZ3  TRP  76           HZ3      TRP  76  17.996   1.709  -8.056
  592    HH2  TRP  76           HH2      TRP  76  18.139   3.356  -9.899
  593    H    MET  77           H        MET  77  19.523   2.006  -2.848
  594    HA   MET  77           HA       MET  77  17.058   2.841  -4.088
  595    HB2  MET  77           HB2      MET  77  17.645   0.745  -1.968
  596    HB3  MET  77           HB3      MET  77  16.063   0.972  -2.712
  597    HG2  MET  77           HG2      MET  77  17.001   0.522  -4.947
  598    HG3  MET  77           HG3      MET  77  18.612   0.378  -4.253
  599    HE1  MET  77           HE1      MET  77  15.205  -2.717  -3.800
  600    HE2  MET  77           HE2      MET  77  15.054  -1.067  -3.184
  601    HE3  MET  77           HE3      MET  77  15.204  -1.348  -4.934
  602    H    ARG  78           H        ARG  78  18.229   3.252  -0.722
  603    HA   ARG  78           HA       ARG  78  15.775   4.414   0.252
  604    HB2  ARG  78           HB2      ARG  78  17.559   3.397   1.632
  605    HB3  ARG  78           HB3      ARG  78  18.610   4.773   1.318
  606    HG2  ARG  78           HG2      ARG  78  15.877   5.410   2.427
  607    HG3  ARG  78           HG3      ARG  78  16.930   4.448   3.454
  608    HD2  ARG  78           HD2      ARG  78  17.353   6.640   4.136
  609    HD3  ARG  78           HD3      ARG  78  18.745   6.182   3.148
  610    HE   ARG  78           HE       ARG  78  16.604   7.563   1.690
  611   HH11  ARG  78          1HH1      ARG  78  19.535   8.096   3.589
  612   HH12  ARG  78          2HH1      ARG  78  19.767   9.699   2.947
  613   HH21  ARG  78          1HH2      ARG  78  16.936   9.648   0.934
  614   HH22  ARG  78          2HH2      ARG  78  18.332  10.553   1.446
  615    H    GLU  79           H        GLU  79  18.706   5.859  -1.227
  616    HA   GLU  79           HA       GLU  79  17.850   8.574  -1.044
  617    HB2  GLU  79           HB2      GLU  79  20.166   7.797  -1.498
  618    HB3  GLU  79           HB3      GLU  79  19.659   7.300  -3.131
  619    HG2  GLU  79           HG2      GLU  79  19.050   9.650  -3.649
  620    HG3  GLU  79           HG3      GLU  79  19.506  10.128  -2.007
  621    H    LYS  80           H        LYS  80  17.258   6.121  -3.607
  622    HA   LYS  80           HA       LYS  80  15.772   7.902  -5.321
  623    HB2  LYS  80           HB2      LYS  80  15.961   4.871  -5.071
  624    HB3  LYS  80           HB3      LYS  80  15.030   5.655  -6.328
  625    HG2  LYS  80           HG2      LYS  80  18.032   6.022  -5.933
  626    HG3  LYS  80           HG3      LYS  80  17.301   4.889  -7.060
  627    HD2  LYS  80           HD2      LYS  80  16.955   7.917  -7.191
  628    HD3  LYS  80           HD3      LYS  80  18.108   6.962  -8.126
  629    HE2  LYS  80           HE2      LYS  80  16.310   5.719  -9.225
  630    HE3  LYS  80           HE3      LYS  80  15.089   6.556  -8.253
  631    HZ1  LYS  80           HZ1      LYS  80  16.903   7.883 -10.182
  632    HZ2  LYS  80           HZ2      LYS  80  15.743   8.634  -9.311
  633    HZ3  LYS  80           HZ3      LYS  80  15.345   7.547 -10.455
  634    H    GLN  81           H        GLN  81  14.703   5.719  -2.716
  635    HA   GLN  81           HA       GLN  81  11.853   6.216  -3.241
  636    HB2  GLN  81           HB2      GLN  81  13.381   4.819  -1.007
  637    HB3  GLN  81           HB3      GLN  81  11.623   5.001  -0.994
  638    HG2  GLN  81           HG2      GLN  81  11.359   3.717  -3.012
  639    HG3  GLN  81           HG3      GLN  81  13.102   3.681  -3.309
  640   HE21  GLN  81          1HE2      GLN  81  14.447   2.586  -1.570
  641   HE22  GLN  81          2HE2      GLN  81  13.737   1.171  -0.770
  642    H    SER  82           H        SER  82  14.268   7.630  -1.044
  643    HA   SER  82           HA       SER  82  14.279   9.588   0.108
  644    HB2  SER  82           HB2      SER  82  11.620  10.260  -1.209
  645    HB3  SER  82           HB3      SER  82  12.706  11.377  -0.381
  646    HG   SER  82           HG       SER  82  12.985  11.447  -2.663
  647    H    SER  83           H        SER  83  11.946   7.303   0.774
  648    HA   SER  83           HA       SER  83  10.569   8.749   2.954
  649    HB2  SER  83           HB2      SER  83  10.215   5.937   1.850
  650    HB3  SER  83           HB3      SER  83   9.147   6.737   3.019
  651    HG   SER  83           HG       SER  83   9.675   7.658   0.347
  652    H    ASP  84           H        ASP  84  13.456   7.292   2.935
  653    HA   ASP  84           HA       ASP  84  14.927   6.727   4.521
  654    HB2  ASP  84           HB2      ASP  84  13.545   8.106   6.125
  655    HB3  ASP  84           HB3      ASP  84  12.755   6.598   6.639
  656    H    HIS  85           H        HIS  85  15.596   4.855   5.925
  657    HA   HIS  85           HA       HIS  85  15.079   2.424   4.494
  658    HB2  HIS  85           HB2      HIS  85  16.701   1.430   6.075
  659    HB3  HIS  85           HB3      HIS  85  17.276   2.904   5.310
  660    HD1  HIS  85           HD1      HIS  85  15.009   3.202   8.359
  661    HD2  HIS  85           HD2      HIS  85  19.065   3.320   7.294
  662    HE1  HIS  85           HE1      HIS  85  16.260   4.117  10.407
  Start of MODEL    3
    1    H2   PRO   1           H2       PRO   1   6.409  -4.937  -6.245
    2    H3   PRO   1           H3       PRO   1   5.984  -6.413  -6.893
    3    HA   PRO   1           HA       PRO   1   3.700  -6.015  -6.578
    4    HB2  PRO   1           HB2      PRO   1   4.265  -3.402  -5.169
    5    HB3  PRO   1           HB3      PRO   1   2.902  -4.541  -4.974
    6    HG2  PRO   1           HG2      PRO   1   5.429  -4.487  -3.535
    7    HG3  PRO   1           HG3      PRO   1   4.127  -5.700  -3.349
    8    HD2  PRO   1           HD2      PRO   1   6.611  -6.338  -4.377
    9    HD3  PRO   1           HD3      PRO   1   5.102  -7.165  -4.844
   10    H    GLY   2           H        GLY   2   5.823  -3.140  -7.158
   11    HA2  GLY   2           HA2      GLY   2   5.917  -1.768  -9.068
   12    HA3  GLY   2           HA3      GLY   2   4.507  -2.588  -9.776
   13    H    SER   3           H        SER   3   4.637  -1.345  -6.475
   14    HA   SER   3           HA       SER   3   2.396   0.580  -7.112
   15    HB2  SER   3           HB2      SER   3   2.554  -1.403  -4.810
   16    HB3  SER   3           HB3      SER   3   1.246  -0.260  -5.106
   17    HG   SER   3           HG       SER   3   0.756  -1.394  -7.042
   18    H    ALA   4           H        ALA   4   5.120  -0.187  -4.968
   19    HA   ALA   4           HA       ALA   4   5.003   2.609  -3.860
   20    HB1  ALA   4           HB1      ALA   4   4.380   0.892  -2.169
   21    HB2  ALA   4           HB2      ALA   4   5.895   0.032  -2.481
   22    HB3  ALA   4           HB3      ALA   4   5.934   1.665  -1.784
   23    H    GLU   5           H        GLU   5   6.822   0.221  -5.547
   24    HA   GLU   5           HA       GLU   5   9.473   1.125  -4.910
   25    HB2  GLU   5           HB2      GLU   5   8.601  -0.598  -7.268
   26    HB3  GLU   5           HB3      GLU   5  10.189  -0.498  -6.505
   27    HG2  GLU   5           HG2      GLU   5   9.511  -2.398  -5.491
   28    HG3  GLU   5           HG3      GLU   5   8.771  -1.300  -4.337
   29    H    ILE   6           H        ILE   6  10.887   2.358  -6.113
   30    HA   ILE   6           HA       ILE   6   9.829   4.175  -8.179
   31    HB   ILE   6           HB       ILE   6  12.419   3.923  -6.634
   32   HG12  ILE   6          2HG1      ILE   6  11.873   6.253  -6.015
   33   HG13  ILE   6          3HG1      ILE   6  10.406   6.190  -6.991
   34   HG21  ILE   6          1HG2      ILE   6  13.205   4.520  -8.870
   35   HG22  ILE   6          2HG2      ILE   6  11.971   5.796  -8.985
   36   HG23  ILE   6          3HG2      ILE   6  13.291   5.918  -7.808
   37   HD11  ILE   6          3HD1      ILE   6   9.358   4.685  -5.449
   38   HD12  ILE   6          1HD1      ILE   6  10.890   4.381  -4.595
   39   HD13  ILE   6          2HD1      ILE   6  10.104   5.965  -4.494
   40    H    ASP   7           H        ASP   7  10.760   4.391 -10.292
   41    HA   ASP   7           HA       ASP   7  11.259   1.855 -11.637
   42    HB2  ASP   7           HB2      ASP   7   9.813   3.609 -12.578
   43    HB3  ASP   7           HB3      ASP   7  11.170   4.727 -12.644
   44    H    TYR   8           H        TYR   8  13.216   1.102 -10.800
   45    HA   TYR   8           HA       TYR   8  15.590   2.717 -10.671
   46    HB2  TYR   8           HB2      TYR   8  15.322  -0.292 -10.356
   47    HB3  TYR   8           HB3      TYR   8  16.677   0.704  -9.841
   48    HD1  TYR   8           HD2      TYR   8  15.941   2.814  -8.279
   49    HD2  TYR   8           HD1      TYR   8  13.862  -0.947  -8.636
   50    HE1  TYR   8           HE2      TYR   8  14.900   3.187  -6.057
   51    HE2  TYR   8           HE1      TYR   8  12.791  -0.564  -6.425
   52    HH   TYR   8           HH       TYR   8  13.426   2.395  -4.476
   53    H    SER   9           H        SER   9  14.551   2.395 -13.459
   54    HA   SER   9           HA       SER   9  16.464   0.952 -15.052
   55    HB2  SER   9           HB2      SER   9  14.853   3.466 -15.665
   56    HB3  SER   9           HB3      SER   9  15.743   2.497 -16.860
   57    HG   SER   9           HG       SER   9  13.440   1.984 -16.648
   58    H    ASP  10           H        ASP  10  16.890   3.788 -13.167
   59    HA   ASP  10           HA       ASP  10  19.213   4.877 -14.549
   60    HB2  ASP  10           HB2      ASP  10  17.502   6.177 -13.233
   61    HB3  ASP  10           HB3      ASP  10  18.069   5.377 -11.768
   62    H    ALA  11           H        ALA  11  18.848   2.092 -12.640
   63    HA   ALA  11           HA       ALA  11  21.001   2.250 -10.829
   64    HB1  ALA  11           HB1      ALA  11  19.788  -0.217 -12.157
   65    HB2  ALA  11           HB2      ALA  11  20.796  -0.208 -10.700
   66    HB3  ALA  11           HB3      ALA  11  19.203   0.572 -10.673
   67    HA   PRO  12           HA       PRO  12  24.617   1.622 -13.427
   68    HB2  PRO  12           HB2      PRO  12  26.481   0.871 -11.595
   69    HB3  PRO  12           HB3      PRO  12  25.815   2.527 -11.648
   70    HG2  PRO  12           HG2      PRO  12  24.905   0.236  -9.885
   71    HG3  PRO  12           HG3      PRO  12  25.340   1.904  -9.388
   72    HD2  PRO  12           HD2      PRO  12  22.753   1.164  -9.817
   73    HD3  PRO  12           HD3      PRO  12  23.333   2.792 -10.279
   74    H    ASP  13           H        ASP  13  25.883  -0.131 -14.290
   75    HA   ASP  13           HA       ASP  13  24.401  -2.522 -14.603
   76    HB2  ASP  13           HB2      ASP  13  27.290  -1.880 -15.288
   77    HB3  ASP  13           HB3      ASP  13  26.408  -3.291 -15.879
   78    H    GLU  14           H        GLU  14  26.910  -1.800 -12.287
   79    HA   GLU  14           HA       GLU  14  27.588  -4.542 -11.622
   80    HB2  GLU  14           HB2      GLU  14  28.889  -3.606  -9.835
   81    HB3  GLU  14           HB3      GLU  14  29.149  -2.673 -11.299
   82    HG2  GLU  14           HG2      GLU  14  27.478  -0.965 -10.413
   83    HG3  GLU  14           HG3      GLU  14  27.444  -1.877  -8.907
   84    H    PHE  15           H        PHE  15  24.852  -2.611 -10.780
   85    HA   PHE  15           HA       PHE  15  24.188  -4.234  -8.386
   86    HB2  PHE  15           HB2      PHE  15  22.848  -1.862  -9.738
   87    HB3  PHE  15           HB3      PHE  15  22.185  -2.711  -8.363
   88    HD1  PHE  15           HD2      PHE  15  25.576  -2.747  -7.497
   89    HD2  PHE  15           HD1      PHE  15  22.225  -0.054  -7.953
   90    HE1  PHE  15           HE2      PHE  15  26.603  -1.200  -5.886
   91    HE2  PHE  15           HE1      PHE  15  23.289   1.503  -6.338
   92    HZ   PHE  15           HZ       PHE  15  25.467   0.942  -5.301
   93    H    ARG  16           H        ARG  16  23.868  -4.627 -11.705
   94    HA   ARG  16           HA       ARG  16  21.174  -5.869 -11.570
   95    HB2  ARG  16           HB2      ARG  16  22.860  -5.036 -13.950
   96    HB3  ARG  16           HB3      ARG  16  21.235  -5.721 -14.038
   97    HG2  ARG  16           HG2      ARG  16  20.273  -3.772 -12.938
   98    HG3  ARG  16           HG3      ARG  16  21.884  -3.092 -12.623
   99    HD2  ARG  16           HD2      ARG  16  22.314  -3.039 -15.070
  100    HD3  ARG  16           HD3      ARG  16  20.679  -3.594 -15.366
  101    HE   ARG  16           HE       ARG  16  21.519  -0.979 -14.174
  102   HH11  ARG  16          1HH1      ARG  16  18.955  -2.791 -15.874
  103   HH12  ARG  16          2HH1      ARG  16  18.148  -1.326 -16.348
  104   HH21  ARG  16          1HH2      ARG  16  20.445   0.796 -14.778
  105   HH22  ARG  16          2HH2      ARG  16  18.996   0.718 -15.744
  106    H    ASP  17           H        ASP  17  20.805  -7.970 -12.222
  107    HA   ASP  17           HA       ASP  17  23.161  -9.765 -12.527
  108    HB2  ASP  17           HB2      ASP  17  21.320 -10.404 -11.004
  109    HB3  ASP  17           HB3      ASP  17  20.212 -10.466 -12.389
  110    HA   PRO  18           HA       PRO  18  22.798  -9.289 -16.876
  111    HB2  PRO  18           HB2      PRO  18  24.343 -11.428 -17.803
  112    HB3  PRO  18           HB3      PRO  18  24.960  -9.875 -17.162
  113    HG2  PRO  18           HG2      PRO  18  24.649 -12.512 -15.747
  114    HG3  PRO  18           HG3      PRO  18  26.006 -11.351 -15.653
  115    HD2  PRO  18           HD2      PRO  18  24.067 -11.499 -13.743
  116    HD3  PRO  18           HD3      PRO  18  24.813  -9.948 -14.202
  117    H    LEU  19           H        LEU  19  21.326 -12.131 -15.473
  118    HA   LEU  19           HA       LEU  19  20.156 -13.027 -18.024
  119    HB2  LEU  19           HB2      LEU  19  20.486 -14.673 -16.252
  120    HB3  LEU  19           HB3      LEU  19  19.555 -13.706 -15.120
  121    HG   LEU  19           HG       LEU  19  17.522 -14.102 -16.511
  122   HD11  LEU  19          1HD1      LEU  19  17.579 -15.895 -18.234
  123   HD12  LEU  19          2HD1      LEU  19  19.343 -15.976 -18.092
  124   HD13  LEU  19          3HD1      LEU  19  18.556 -14.503 -18.716
  125   HD21  LEU  19          3HD2      LEU  19  18.997 -16.586 -15.583
  126   HD22  LEU  19          1HD2      LEU  19  17.250 -16.473 -15.880
  127   HD23  LEU  19          2HD2      LEU  19  17.978 -15.520 -14.592
  128    H    MET  20           H        MET  20  18.907 -11.355 -15.105
  129    HA   MET  20           HA       MET  20  16.402 -10.731 -16.539
  130    HB2  MET  20           HB2      MET  20  17.245 -10.339 -13.633
  131    HB3  MET  20           HB3      MET  20  15.645  -9.933 -14.296
  132    HG2  MET  20           HG2      MET  20  16.920 -12.693 -14.303
  133    HG3  MET  20           HG3      MET  20  15.681 -12.123 -13.193
  134    HE1  MET  20           HE1      MET  20  13.826 -14.835 -15.263
  135    HE2  MET  20           HE2      MET  20  15.524 -14.835 -14.752
  136    HE3  MET  20           HE3      MET  20  14.267 -14.259 -13.642
  137    H    ASP  21           H        ASP  21  19.303  -9.026 -15.968
  138    HA   ASP  21           HA       ASP  21  20.037  -7.016 -16.585
  139    HB2  ASP  21           HB2      ASP  21  18.764  -7.641 -18.673
  140    HB3  ASP  21           HB3      ASP  21  17.432  -6.631 -18.104
  141    H    THR  22           H        THR  22  18.144  -7.270 -14.201
  142    HA   THR  22           HA       THR  22  17.730  -4.374 -13.640
  143    HB   THR  22           HB       THR  22  15.635  -5.507 -14.450
  144    HG1  THR  22           HG1      THR  22  14.439  -4.497 -12.836
  145   HG21  THR  22          1HG2      THR  22  15.688  -6.902 -11.732
  146   HG22  THR  22          2HG2      THR  22  15.971  -7.725 -13.284
  147   HG23  THR  22          3HG2      THR  22  14.407  -6.968 -12.955
  148    H    LEU  23           H        LEU  23  17.143  -4.057 -11.316
  149    HA   LEU  23           HA       LEU  23  19.526  -4.525  -9.906
  150    HB2  LEU  23           HB2      LEU  23  17.465  -2.728  -9.778
  151    HB3  LEU  23           HB3      LEU  23  17.079  -3.696  -8.371
  152    HG   LEU  23           HG       LEU  23  19.665  -2.200  -8.942
  153   HD11  LEU  23          1HD1      LEU  23  18.972  -0.801  -7.027
  154   HD12  LEU  23          2HD1      LEU  23  17.477  -1.756  -6.870
  155   HD13  LEU  23          3HD1      LEU  23  17.771  -0.778  -8.324
  156   HD21  LEU  23          3HD2      LEU  23  20.362  -2.776  -6.642
  157   HD22  LEU  23          1HD2      LEU  23  20.202  -4.232  -7.611
  158   HD23  LEU  23          2HD2      LEU  23  18.929  -3.806  -6.444
  159    H    MET  24           H        MET  24  20.230  -6.222  -8.756
  160    HA   MET  24           HA       MET  24  18.502  -8.507  -8.312
  161    HB2  MET  24           HB2      MET  24  20.513  -9.635  -7.507
  162    HB3  MET  24           HB3      MET  24  20.739  -8.846  -9.065
  163    HG2  MET  24           HG2      MET  24  21.905  -6.968  -7.858
  164    HG3  MET  24           HG3      MET  24  21.801  -7.909  -6.371
  165    HE1  MET  24           HE1      MET  24  24.275  -6.801  -8.799
  166    HE2  MET  24           HE2      MET  24  24.408  -6.873  -7.024
  167    HE3  MET  24           HE3      MET  24  25.532  -7.801  -8.054
  168    H    THR  25           H        THR  25  19.897  -6.169  -6.080
  169    HA   THR  25           HA       THR  25  19.599  -5.621  -3.921
  170    HB   THR  25           HB       THR  25  17.591  -5.917  -2.755
  171    HG1  THR  25           HG1      THR  25  17.109  -7.969  -4.599
  172   HG21  THR  25          1HG2      THR  25  16.925  -5.551  -5.701
  173   HG22  THR  25          2HG2      THR  25  17.513  -4.294  -4.592
  174   HG23  THR  25          3HG2      THR  25  15.941  -5.040  -4.311
  175    H    ASP  26           H        ASP  26  19.499  -9.053  -4.501
  176    HA   ASP  26           HA       ASP  26  21.047  -9.466  -1.957
  177    HB2  ASP  26           HB2      ASP  26  19.060 -11.301  -3.331
  178    HB3  ASP  26           HB3      ASP  26  20.248 -11.859  -2.157
  179    HA   PRO  27           HA       PRO  27  23.927 -10.530  -5.428
  180    HB2  PRO  27           HB2      PRO  27  26.143  -9.239  -4.431
  181    HB3  PRO  27           HB3      PRO  27  24.906  -8.432  -5.429
  182    HG2  PRO  27           HG2      PRO  27  25.146  -8.416  -2.425
  183    HG3  PRO  27           HG3      PRO  27  24.849  -7.025  -3.522
  184    HD2  PRO  27           HD2      PRO  27  22.835  -8.295  -2.180
  185    HD3  PRO  27           HD3      PRO  27  22.589  -7.646  -3.826
  186    H    VAL  28           H        VAL  28  25.002 -12.390  -5.321
  187    HA   VAL  28           HA       VAL  28  26.228 -13.367  -2.770
  188    HB   VAL  28           HB       VAL  28  24.604 -14.993  -4.775
  189   HG11  VAL  28          1HG1      VAL  28  25.850 -15.904  -2.154
  190   HG12  VAL  28          2HG1      VAL  28  24.831 -16.868  -3.245
  191   HG13  VAL  28          3HG1      VAL  28  26.425 -16.351  -3.783
  192   HG21  VAL  28          3HG2      VAL  28  22.999 -15.368  -2.930
  193   HG22  VAL  28          1HG2      VAL  28  23.932 -14.269  -1.893
  194   HG23  VAL  28          2HG2      VAL  28  23.112 -13.652  -3.348
  195    H    ARG  29           H        ARG  29  28.202 -14.188  -2.956
  196    HA   ARG  29           HA       ARG  29  29.536 -13.988  -5.561
  197    HB2  ARG  29           HB2      ARG  29  30.282 -13.283  -3.009
  198    HB3  ARG  29           HB3      ARG  29  31.081 -14.841  -3.146
  199    HG2  ARG  29           HG2      ARG  29  32.176 -14.036  -5.273
  200    HG3  ARG  29           HG3      ARG  29  31.310 -12.502  -5.105
  201    HD2  ARG  29           HD2      ARG  29  33.503 -12.104  -4.291
  202    HD3  ARG  29           HD3      ARG  29  32.442 -12.178  -2.866
  203    HE   ARG  29           HE       ARG  29  33.533 -14.780  -3.432
  204   HH11  ARG  29          1HH2      ARG  29  34.584 -11.680  -2.110
  205   HH12  ARG  29          2HH2      ARG  29  35.901 -12.397  -1.222
  206   HH21  ARG  29          1HH1      ARG  29  35.243 -15.649  -2.258
  207   HH22  ARG  29          2HH1      ARG  29  36.268 -14.604  -1.314
  208    H    LEU  30           H        LEU  30  30.221 -15.619  -6.730
  209    HA   LEU  30           HA       LEU  30  29.880 -18.467  -5.970
  210    HB2  LEU  30           HB2      LEU  30  30.559 -16.904  -8.490
  211    HB3  LEU  30           HB3      LEU  30  30.949 -18.589  -8.412
  212    HG   LEU  30           HG       LEU  30  28.546 -19.115  -7.889
  213   HD11  LEU  30          1HD1      LEU  30  26.830 -17.426  -8.552
  214   HD12  LEU  30          2HD1      LEU  30  28.105 -16.187  -8.606
  215   HD13  LEU  30          3HD1      LEU  30  27.680 -16.981  -7.074
  216   HD21  LEU  30          3HD2      LEU  30  29.504 -19.380 -10.129
  217   HD22  LEU  30          1HD2      LEU  30  29.125 -17.690 -10.519
  218   HD23  LEU  30          2HD2      LEU  30  27.821 -18.867 -10.230
  219    HA   PRO  31           HA       PRO  31  34.070 -19.161  -4.711
  220    HB2  PRO  31           HB2      PRO  31  34.839 -21.503  -5.927
  221    HB3  PRO  31           HB3      PRO  31  33.651 -21.428  -4.601
  222    HG2  PRO  31           HG2      PRO  31  33.114 -21.483  -7.594
  223    HG3  PRO  31           HG3      PRO  31  32.383 -22.521  -6.334
  224    HD2  PRO  31           HD2      PRO  31  31.088 -20.350  -7.232
  225    HD3  PRO  31           HD3      PRO  31  31.077 -20.722  -5.484
  226    H    SER  32           H        SER  32  33.464 -18.948  -8.181
  227    HA   SER  32           HA       SER  32  36.169 -18.546  -9.109
  228    HB2  SER  32           HB2      SER  32  34.904 -17.621 -11.081
  229    HB3  SER  32           HB3      SER  32  34.369 -19.231 -10.593
  230    HG   SER  32           HG       SER  32  32.616 -17.726 -10.990
  231    H    GLY  33           H        GLY  33  34.123 -16.593  -7.167
  232    HA2  GLY  33           HA2      GLY  33  34.530 -14.453  -6.309
  233    HA3  GLY  33           HA3      GLY  33  35.684 -14.112  -7.625
  234    H    THR  34           H        THR  34  33.134 -15.347  -9.256
  235    HA   THR  34           HA       THR  34  32.135 -12.859 -10.249
  236    HB   THR  34           HB       THR  34  31.066 -15.703 -10.449
  237    HG1  THR  34           HG1      THR  34  32.133 -15.563 -12.464
  238   HG21  THR  34          1HG2      THR  34  30.336 -13.238 -12.101
  239   HG22  THR  34          2HG2      THR  34  29.233 -14.193 -11.068
  240   HG23  THR  34          3HG2      THR  34  29.918 -14.915 -12.521
  241    H    VAL  35           H        VAL  35  30.411 -11.640  -9.692
  242    HA   VAL  35           HA       VAL  35  28.781 -12.404  -7.327
  243    HB   VAL  35           HB       VAL  35  28.936  -9.739  -8.770
  244   HG11  VAL  35          1HG1      VAL  35  27.738  -8.876  -6.754
  245   HG12  VAL  35          2HG1      VAL  35  26.758 -10.013  -7.652
  246   HG13  VAL  35          3HG1      VAL  35  27.573 -10.545  -6.157
  247   HG21  VAL  35          3HG2      VAL  35  30.135 -10.606  -6.102
  248   HG22  VAL  35          1HG2      VAL  35  31.058 -10.249  -7.578
  249   HG23  VAL  35          2HG2      VAL  35  30.166  -8.961  -6.770
  250    H    MET  36           H        MET  36  26.643 -12.827  -7.463
  251    HA   MET  36           HA       MET  36  25.101 -12.463  -9.972
  252    HB2  MET  36           HB2      MET  36  26.424 -14.714  -9.782
  253    HB3  MET  36           HB3      MET  36  25.236 -15.153  -8.560
  254    HG2  MET  36           HG2      MET  36  23.426 -14.882 -10.198
  255    HG3  MET  36           HG3      MET  36  24.566 -14.282 -11.414
  256    HE1  MET  36           HE1      MET  36  26.390 -15.683 -12.555
  257    HE2  MET  36           HE2      MET  36  27.109 -16.357 -11.077
  258    HE3  MET  36           HE3      MET  36  26.604 -17.439 -12.385
  259    H    ASP  37           H        ASP  37  22.779 -12.881  -9.652
  260    HA   ASP  37           HA       ASP  37  21.754 -11.977  -7.080
  261    HB2  ASP  37           HB2      ASP  37  20.604 -11.360  -9.104
  262    HB3  ASP  37           HB3      ASP  37  20.462 -13.042  -9.597
  263    H    ARG  38           H        ARG  38  21.059 -13.078  -5.409
  264    HA   ARG  38           HA       ARG  38  21.524 -15.711  -4.745
  265    HB2  ARG  38           HB2      ARG  38  20.834 -13.823  -3.227
  266    HB3  ARG  38           HB3      ARG  38  19.202 -13.952  -3.849
  267    HG2  ARG  38           HG2      ARG  38  19.606 -16.558  -3.011
  268    HG3  ARG  38           HG3      ARG  38  20.718 -15.714  -1.949
  269    HD2  ARG  38           HD2      ARG  38  18.663 -15.883  -0.800
  270    HD3  ARG  38           HD3      ARG  38  18.762 -14.190  -1.305
  271    HE   ARG  38           HE       ARG  38  17.282 -14.886  -3.280
  272   HH11  ARG  38          1HH2      ARG  38  16.954 -16.544  -0.156
  273   HH12  ARG  38          2HH2      ARG  38  15.340 -17.055  -0.533
  274   HH21  ARG  38          1HH1      ARG  38  15.249 -15.559  -3.660
  275   HH22  ARG  38          2HH1      ARG  38  14.370 -16.496  -2.468
  276    H    SER  39           H        SER  39  18.376 -14.454  -5.980
  277    HA   SER  39           HA       SER  39  17.059 -17.009  -5.752
  278    HB2  SER  39           HB2      SER  39  16.238 -14.549  -7.327
  279    HB3  SER  39           HB3      SER  39  15.207 -15.915  -6.879
  280    HG   SER  39           HG       SER  39  15.143 -13.989  -5.467
  281    H    ILE  40           H        ILE  40  18.590 -15.314  -8.526
  282    HA   ILE  40           HA       ILE  40  17.839 -17.330 -10.468
  283    HB   ILE  40           HB       ILE  40  20.007 -15.193 -10.519
  284   HG12  ILE  40          2HG1      ILE  40  17.295 -15.319 -11.949
  285   HG13  ILE  40          3HG1      ILE  40  17.502 -14.522 -10.391
  286   HG21  ILE  40          1HG2      ILE  40  20.658 -16.928 -12.104
  287   HG22  ILE  40          2HG2      ILE  40  19.006 -16.984 -12.777
  288   HG23  ILE  40          3HG2      ILE  40  20.036 -15.552 -12.997
  289   HD11  ILE  40          3HD1      ILE  40  18.747 -13.679 -13.014
  290   HD12  ILE  40          1HD1      ILE  40  17.580 -12.818 -11.993
  291   HD13  ILE  40          2HD1      ILE  40  19.230 -13.023 -11.435
  292    H    ILE  41           H        ILE  41  20.927 -16.994  -8.554
  293    HA   ILE  41           HA       ILE  41  21.974 -19.367  -9.783
  294    HB   ILE  41           HB       ILE  41  23.410 -17.696  -8.675
  295   HG12  ILE  41          2HG1      ILE  41  25.031 -19.223  -7.702
  296   HG13  ILE  41          3HG1      ILE  41  23.827 -20.485  -7.523
  297   HG21  ILE  41          1HG2      ILE  41  23.802 -17.720  -6.265
  298   HG22  ILE  41          2HG2      ILE  41  22.132 -17.300  -6.588
  299   HG23  ILE  41          3HG2      ILE  41  22.535 -18.929  -6.024
  300   HD11  ILE  41          3HD1      ILE  41  23.676 -20.750  -9.959
  301   HD12  ILE  41          1HD1      ILE  41  24.744 -19.338 -10.194
  302   HD13  ILE  41          2HD1      ILE  41  25.374 -20.809  -9.458
  303    H    LEU  42           H        LEU  42  20.046 -19.058  -6.741
  304    HA   LEU  42           HA       LEU  42  20.204 -21.903  -6.278
  305    HB2  LEU  42           HB2      LEU  42  18.766 -21.654  -4.491
  306    HB3  LEU  42           HB3      LEU  42  19.779 -20.230  -4.539
  307    HG   LEU  42           HG       LEU  42  17.743 -19.093  -5.727
  308   HD11  LEU  42          1HD1      LEU  42  16.269 -21.088  -6.041
  309   HD12  LEU  42          2HD1      LEU  42  15.534 -19.936  -4.945
  310   HD13  LEU  42          3HD1      LEU  42  16.325 -21.389  -4.294
  311   HD21  LEU  42          3HD2      LEU  42  17.634 -19.868  -2.784
  312   HD22  LEU  42          1HD2      LEU  42  16.835 -18.458  -3.519
  313   HD23  LEU  42          2HD2      LEU  42  18.606 -18.550  -3.466
  314    H    ARG  43           H        ARG  43  17.945 -19.967  -8.231
  315    HA   ARG  43           HA       ARG  43  16.177 -22.178  -8.747
  316    HB2  ARG  43           HB2      ARG  43  15.452 -19.874  -9.045
  317    HB3  ARG  43           HB3      ARG  43  16.654 -19.620 -10.317
  318    HG2  ARG  43           HG2      ARG  43  14.397 -19.956 -11.232
  319    HG3  ARG  43           HG3      ARG  43  15.510 -21.200 -11.784
  320    HD2  ARG  43           HD2      ARG  43  14.577 -22.731  -9.951
  321    HD3  ARG  43           HD3      ARG  43  13.396 -21.471  -9.606
  322    HE   ARG  43           HE       ARG  43  12.240 -22.007 -11.547
  323   HH11  ARG  43          1HH1      ARG  43  15.361 -23.720 -11.703
  324   HH12  ARG  43          2HH1      ARG  43  14.793 -24.756 -12.981
  325   HH21  ARG  43          1HH2      ARG  43  11.622 -23.380 -13.205
  326   HH22  ARG  43          2HH2      ARG  43  12.743 -24.561 -13.820
  327    H    HIS  44           H        HIS  44  19.154 -21.003 -10.394
  328    HA   HIS  44           HA       HIS  44  18.953 -23.012 -12.468
  329    HB2  HIS  44           HB2      HIS  44  20.322 -20.858 -12.558
  330    HB3  HIS  44           HB3      HIS  44  21.508 -21.652 -11.518
  331    HD1  HIS  44           HD1      HIS  44  23.032 -23.556 -12.755
  332    HD2  HIS  44           HD2      HIS  44  19.858 -21.965 -15.026
  333    HE1  HIS  44           HE1      HIS  44  23.248 -24.533 -15.080
  334    H    LEU  45           H        LEU  45  20.657 -22.990  -9.282
  335    HA   LEU  45           HA       LEU  45  21.804 -25.572  -9.393
  336    HB2  LEU  45           HB2      LEU  45  20.757 -23.800  -7.185
  337    HB3  LEU  45           HB3      LEU  45  21.295 -25.425  -6.799
  338    HG   LEU  45           HG       LEU  45  23.090 -23.472  -8.319
  339   HD11  LEU  45          1HD1      LEU  45  22.505 -22.410  -6.182
  340   HD12  LEU  45          2HD1      LEU  45  24.164 -23.027  -6.099
  341   HD13  LEU  45          3HD1      LEU  45  22.855 -23.918  -5.315
  342   HD21  LEU  45          3HD2      LEU  45  23.604 -26.005  -6.673
  343   HD22  LEU  45          1HD2      LEU  45  24.867 -24.975  -7.347
  344   HD23  LEU  45          2HD2      LEU  45  23.789 -25.846  -8.436
  345    H    LEU  46           H        LEU  46  18.443 -24.716  -8.598
  346    HA   LEU  46           HA       LEU  46  17.534 -27.345  -7.969
  347    HB2  LEU  46           HB2      LEU  46  16.344 -25.188  -7.529
  348    HB3  LEU  46           HB3      LEU  46  16.068 -25.006  -9.260
  349    HG   LEU  46           HG       LEU  46  14.662 -27.059  -9.259
  350   HD11  LEU  46          1HD1      LEU  46  15.087 -26.975  -6.229
  351   HD12  LEU  46          2HD1      LEU  46  15.597 -28.272  -7.333
  352   HD13  LEU  46          3HD1      LEU  46  13.874 -27.964  -7.074
  353   HD21  LEU  46          3HD2      LEU  46  13.854 -24.902  -7.260
  354   HD22  LEU  46          1HD2      LEU  46  12.753 -26.034  -8.079
  355   HD23  LEU  46          2HD2      LEU  46  13.655 -24.839  -9.032
  356    H    ASN  47           H        ASN  47  18.199 -25.853 -11.103
  357    HA   ASN  47           HA       ASN  47  16.922 -28.037 -12.625
  358    HB2  ASN  47           HB2      ASN  47  16.959 -25.569 -13.296
  359    HB3  ASN  47           HB3      ASN  47  18.666 -25.773 -13.693
  360   HD21  ASN  47          1HD2      ASN  47  19.171 -27.631 -15.327
  361   HD22  ASN  47          2HD2      ASN  47  17.969 -27.857 -16.584
  362    H    SER  48           H        SER  48  20.260 -26.771 -12.092
  363    HA   SER  48           HA       SER  48  21.472 -29.409 -12.726
  364    HB2  SER  48           HB2      SER  48  22.128 -26.818 -14.186
  365    HB3  SER  48           HB3      SER  48  22.970 -28.359 -14.382
  366    HG   SER  48           HG       SER  48  21.487 -28.126 -16.051
  367    HA   PRO  49           HA       PRO  49  24.325 -27.809  -9.640
  368    HB2  PRO  49           HB2      PRO  49  26.246 -29.719  -9.604
  369    HB3  PRO  49           HB3      PRO  49  24.546 -30.105  -9.220
  370    HG2  PRO  49           HG2      PRO  49  25.923 -30.441 -11.916
  371    HG3  PRO  49           HG3      PRO  49  25.004 -31.666 -10.985
  372    HD2  PRO  49           HD2      PRO  49  23.868 -30.147 -12.968
  373    HD3  PRO  49           HD3      PRO  49  22.951 -30.664 -11.519
  374    H    THR  50           H        THR  50  24.444 -26.195 -11.793
  375    HA   THR  50           HA       THR  50  27.302 -25.655 -12.340
  376    HB   THR  50           HB       THR  50  26.671 -25.312 -14.795
  377    HG1  THR  50           HG1      THR  50  24.906 -26.575 -15.494
  378   HG21  THR  50          1HG2      THR  50  28.057 -27.221 -14.101
  379   HG22  THR  50          2HG2      THR  50  26.987 -27.626 -15.437
  380   HG23  THR  50          3HG2      THR  50  26.596 -28.190 -13.795
  381    H    ASP  51           H        ASP  51  27.682 -23.727 -13.406
  382    HA   ASP  51           HA       ASP  51  26.335 -21.399 -12.411
  383    HB2  ASP  51           HB2      ASP  51  28.744 -21.679 -12.799
  384    HB3  ASP  51           HB3      ASP  51  28.462 -21.850 -14.530
  385    HA   PRO  52           HA       PRO  52  23.168 -21.141 -15.596
  386    HB2  PRO  52           HB2      PRO  52  22.397 -18.463 -15.265
  387    HB3  PRO  52           HB3      PRO  52  21.851 -19.850 -14.268
  388    HG2  PRO  52           HG2      PRO  52  24.059 -17.883 -13.734
  389    HG3  PRO  52           HG3      PRO  52  22.833 -18.503 -12.592
  390    HD2  PRO  52           HD2      PRO  52  25.368 -19.452 -12.659
  391    HD3  PRO  52           HD3      PRO  52  23.995 -20.560 -12.373
  392    H    PHE  53           H        PHE  53  26.003 -19.086 -15.767
  393    HA   PHE  53           HA       PHE  53  25.322 -18.269 -18.578
  394    HB2  PHE  53           HB2      PHE  53  27.263 -17.007 -16.599
  395    HB3  PHE  53           HB3      PHE  53  26.869 -16.409 -18.199
  396    HD1  PHE  53           HD2      PHE  53  24.479 -15.601 -18.671
  397    HD2  PHE  53           HD1      PHE  53  25.895 -16.506 -14.712
  398    HE1  PHE  53           HE2      PHE  53  22.594 -14.316 -17.696
  399    HE2  PHE  53           HE1      PHE  53  23.998 -15.221 -13.736
  400    HZ   PHE  53           HZ       PHE  53  22.353 -14.136 -15.227
  401    H    ASN  54           H        ASN  54  27.934 -19.507 -16.462
  402    HA   ASN  54           HA       ASN  54  29.748 -19.773 -18.793
  403    HB2  ASN  54           HB2      ASN  54  30.411 -18.536 -16.730
  404    HB3  ASN  54           HB3      ASN  54  30.250 -20.025 -15.803
  405   HD21  ASN  54          1HD2      ASN  54  32.082 -18.527 -18.527
  406   HD22  ASN  54          2HD2      ASN  54  33.495 -19.531 -18.306
  407    H    ARG  55           H        ARG  55  27.873 -21.819 -16.677
  408    HA   ARG  55           HA       ARG  55  27.419 -23.955 -16.582
  409    HB2  ARG  55           HB2      ARG  55  28.622 -23.944 -19.365
  410    HB3  ARG  55           HB3      ARG  55  28.084 -25.436 -18.633
  411    HG2  ARG  55           HG2      ARG  55  26.308 -24.596 -19.974
  412    HG3  ARG  55           HG3      ARG  55  25.842 -24.583 -18.283
  413    HD2  ARG  55           HD2      ARG  55  26.194 -22.106 -18.212
  414    HD3  ARG  55           HD3      ARG  55  26.733 -22.153 -19.896
  415    HE   ARG  55           HE       ARG  55  24.519 -22.336 -20.585
  416   HH11  ARG  55          1HH1      ARG  55  24.595 -22.816 -17.076
  417   HH12  ARG  55          2HH1      ARG  55  22.861 -22.970 -16.979
  418   HH21  ARG  55          1HH2      ARG  55  22.275 -22.448 -20.355
  419   HH22  ARG  55          2HH2      ARG  55  21.594 -22.721 -18.778
  420    H    GLN  56           H        GLN  56  30.348 -22.982 -15.887
  421    HA   GLN  56           HA       GLN  56  31.803 -25.396 -15.274
  422    HB2  GLN  56           HB2      GLN  56  32.927 -24.014 -13.599
  423    HB3  GLN  56           HB3      GLN  56  32.840 -23.178 -15.153
  424    HG2  GLN  56           HG2      GLN  56  30.831 -21.905 -14.272
  425    HG3  GLN  56           HG3      GLN  56  31.090 -22.649 -12.695
  426   HE21  GLN  56          1HE2      GLN  56  31.070 -19.809 -13.104
  427   HE22  GLN  56          2HE2      GLN  56  32.727 -19.252 -12.842
  428    H    MET  57           H        MET  57  31.855 -26.548 -13.236
  429    HA   MET  57           HA       MET  57  29.223 -27.062 -12.126
  430    HB2  MET  57           HB2      MET  57  31.995 -28.046 -11.315
  431    HB3  MET  57           HB3      MET  57  30.466 -28.595 -10.593
  432    HG2  MET  57           HG2      MET  57  29.669 -29.335 -12.807
  433    HG3  MET  57           HG3      MET  57  31.198 -28.840 -13.537
  434    HE1  MET  57           HE1      MET  57  29.915 -31.708 -13.924
  435    HE2  MET  57           HE2      MET  57  31.460 -31.220 -14.645
  436    HE3  MET  57           HE3      MET  57  31.346 -32.740 -13.739
  437    H    LEU  58           H        LEU  58  28.404 -26.689 -10.126
  438    HA   LEU  58           HA       LEU  58  29.687 -24.828  -8.232
  439    HB2  LEU  58           HB2      LEU  58  28.855 -23.469 -10.149
  440    HB3  LEU  58           HB3      LEU  58  27.240 -24.105  -9.924
  441    HG   LEU  58           HG       LEU  58  27.729 -21.760  -9.169
  442   HD11  LEU  58          1HD1      LEU  58  26.628 -23.449  -6.914
  443   HD12  LEU  58          2HD1      LEU  58  25.747 -23.047  -8.403
  444   HD13  LEU  58          3HD1      LEU  58  26.268 -21.766  -7.300
  445   HD21  LEU  58          3HD2      LEU  58  28.795 -21.335  -7.029
  446   HD22  LEU  58          1HD2      LEU  58  29.930 -22.156  -8.122
  447   HD23  LEU  58          2HD2      LEU  58  29.147 -23.051  -6.801
  448    H    THR  59           H        THR  59  28.869 -25.013  -6.201
  449    HA   THR  59           HA       THR  59  26.450 -26.713  -5.711
  450    HB   THR  59           HB       THR  59  29.098 -26.813  -4.205
  451    HG1  THR  59           HG1      THR  59  29.280 -28.828  -5.244
  452   HG21  THR  59          1HG2      THR  59  27.283 -27.486  -2.719
  453   HG22  THR  59          2HG2      THR  59  28.140 -28.928  -3.248
  454   HG23  THR  59          3HG2      THR  59  26.580 -28.523  -3.985
  455    H    GLU  60           H        GLU  60  25.292 -26.243  -3.812
  456    HA   GLU  60           HA       GLU  60  24.863 -23.582  -3.099
  457    HB2  GLU  60           HB2      GLU  60  24.364 -26.138  -1.514
  458    HB3  GLU  60           HB3      GLU  60  23.732 -24.552  -1.061
  459    HG2  GLU  60           HG2      GLU  60  22.428 -24.407  -3.108
  460    HG3  GLU  60           HG3      GLU  60  23.116 -25.924  -3.710
  461    H    SER  61           H        SER  61  26.962 -25.944  -1.365
  462    HA   SER  61           HA       SER  61  27.606 -24.313   0.856
  463    HB2  SER  61           HB2      SER  61  29.281 -26.506  -0.424
  464    HB3  SER  61           HB3      SER  61  29.384 -25.936   1.246
  465    HG   SER  61           HG       SER  61  28.144 -27.875   1.076
  466    H    MET  62           H        MET  62  28.680 -23.904  -2.375
  467    HA   MET  62           HA       MET  62  31.258 -22.619  -1.667
  468    HB2  MET  62           HB2      MET  62  29.948 -23.030  -4.395
  469    HB3  MET  62           HB3      MET  62  31.594 -22.506  -4.072
  470    HG2  MET  62           HG2      MET  62  32.184 -24.636  -3.092
  471    HG3  MET  62           HG3      MET  62  30.524 -25.209  -3.221
  472    HE1  MET  62           HE1      MET  62  32.537 -27.442  -5.740
  473    HE2  MET  62           HE2      MET  62  33.142 -26.746  -4.219
  474    HE3  MET  62           HE3      MET  62  31.494 -27.420  -4.305
  475    H    LEU  63           H        LEU  63  28.026 -21.643  -1.879
  476    HA   LEU  63           HA       LEU  63  28.498 -18.945  -3.002
  477    HB2  LEU  63           HB2      LEU  63  26.032 -20.296  -1.837
  478    HB3  LEU  63           HB3      LEU  63  26.073 -18.706  -2.566
  479    HG   LEU  63           HG       LEU  63  26.653 -21.329  -4.009
  480   HD11  LEU  63          1HD1      LEU  63  24.296 -19.402  -4.180
  481   HD12  LEU  63          2HD1      LEU  63  24.280 -21.018  -3.442
  482   HD13  LEU  63          3HD1      LEU  63  24.545 -20.846  -5.187
  483   HD21  LEU  63          3HD2      LEU  63  26.600 -18.465  -5.064
  484   HD22  LEU  63          1HD2      LEU  63  26.614 -19.907  -6.086
  485   HD23  LEU  63          2HD2      LEU  63  27.998 -19.574  -5.046
  486    H    GLU  64           H        GLU  64  28.289 -17.013  -1.917
  487    HA   GLU  64           HA       GLU  64  27.659 -16.952   0.948
  488    HB2  GLU  64           HB2      GLU  64  30.047 -17.382   0.995
  489    HB3  GLU  64           HB3      GLU  64  30.358 -16.034  -0.101
  490    HG2  GLU  64           HG2      GLU  64  29.596 -14.425   1.566
  491    HG3  GLU  64           HG3      GLU  64  29.053 -15.719   2.640
  492    HA   PRO  65           HA       PRO  65  25.697 -13.214  -0.773
  493    HB2  PRO  65           HB2      PRO  65  25.424 -12.592   2.155
  494    HB3  PRO  65           HB3      PRO  65  24.212 -12.417   0.847
  495    HG2  PRO  65           HG2      PRO  65  24.099 -14.539   2.535
  496    HG3  PRO  65           HG3      PRO  65  23.853 -14.799   0.777
  497    HD2  PRO  65           HD2      PRO  65  26.354 -15.269   2.412
  498    HD3  PRO  65           HD3      PRO  65  25.606 -16.286   1.141
  499    H    VAL  66           H        VAL  66  26.386 -11.158  -1.222
  500    HA   VAL  66           HA       VAL  66  29.008 -10.322  -0.124
  501    HB   VAL  66           HB       VAL  66  27.542  -9.170  -2.512
  502   HG11  VAL  66          1HG1      VAL  66  29.819  -8.248  -3.036
  503   HG12  VAL  66          2HG1      VAL  66  29.170  -7.585  -1.534
  504   HG13  VAL  66          3HG1      VAL  66  30.410  -8.856  -1.481
  505   HG21  VAL  66          3HG2      VAL  66  29.181 -10.413  -3.873
  506   HG22  VAL  66          1HG2      VAL  66  29.837 -11.175  -2.404
  507   HG23  VAL  66          2HG2      VAL  66  28.171 -11.518  -2.935
  508    HA   PRO  67           HA       PRO  67  26.450  -7.331   2.193
  509    HB2  PRO  67           HB2      PRO  67  28.228  -6.640   4.147
  510    HB3  PRO  67           HB3      PRO  67  27.419  -8.235   4.122
  511    HG2  PRO  67           HG2      PRO  67  30.205  -7.549   3.108
  512    HG3  PRO  67           HG3      PRO  67  29.721  -8.901   4.173
  513    HD2  PRO  67           HD2      PRO  67  30.030  -9.218   1.474
  514    HD3  PRO  67           HD3      PRO  67  28.782 -10.101   2.396
  515    H    GLU  68           H        GLU  68  29.808  -6.620   1.092
  516    HA   GLU  68           HA       GLU  68  29.574  -3.809   1.388
  517    HB2  GLU  68           HB2      GLU  68  31.643  -3.671   0.098
  518    HB3  GLU  68           HB3      GLU  68  31.716  -4.935   1.322
  519    HG2  GLU  68           HG2      GLU  68  31.311  -6.665  -0.420
  520    HG3  GLU  68           HG3      GLU  68  31.242  -5.407  -1.654
  521    H    LEU  69           H        LEU  69  28.280  -5.844  -1.085
  522    HA   LEU  69           HA       LEU  69  27.675  -3.519  -2.865
  523    HB2  LEU  69           HB2      LEU  69  27.251  -6.525  -3.197
  524    HB3  LEU  69           HB3      LEU  69  26.687  -5.303  -4.337
  525    HG   LEU  69           HG       LEU  69  29.602  -5.809  -3.622
  526   HD11  LEU  69          1HD1      LEU  69  29.756  -6.702  -5.895
  527   HD12  LEU  69          2HD1      LEU  69  28.019  -6.406  -6.155
  528   HD13  LEU  69          3HD1      LEU  69  28.549  -7.599  -4.946
  529   HD21  LEU  69          3HD2      LEU  69  28.349  -3.884  -5.635
  530   HD22  LEU  69          1HD2      LEU  69  30.073  -4.315  -5.595
  531   HD23  LEU  69          2HD2      LEU  69  29.360  -3.449  -4.237
  532    H    LYS  70           H        LYS  70  25.967  -6.007  -0.867
  533    HA   LYS  70           HA       LYS  70  23.362  -5.035  -1.453
  534    HB2  LYS  70           HB2      LYS  70  23.850  -7.222  -0.423
  535    HB3  LYS  70           HB3      LYS  70  24.359  -6.416   1.074
  536    HG2  LYS  70           HG2      LYS  70  22.145  -5.579   1.484
  537    HG3  LYS  70           HG3      LYS  70  21.594  -6.006  -0.152
  538    HD2  LYS  70           HD2      LYS  70  21.804  -8.397   0.363
  539    HD3  LYS  70           HD3      LYS  70  22.411  -8.013   1.989
  540    HE2  LYS  70           HE2      LYS  70  20.302  -6.839   2.514
  541    HE3  LYS  70           HE3      LYS  70  19.705  -7.138   0.877
  542    HZ1  LYS  70           HZ1      LYS  70  18.834  -8.741   2.485
  543    HZ2  LYS  70           HZ2      LYS  70  20.335  -9.287   2.829
  544    HZ3  LYS  70           HZ3      LYS  70  19.702  -9.490   1.330
  545    H    GLU  71           H        GLU  71  25.602  -4.029   1.129
  546    HA   GLU  71           HA       GLU  71  23.894  -2.104   2.367
  547    HB2  GLU  71           HB2      GLU  71  25.947  -3.088   3.349
  548    HB3  GLU  71           HB3      GLU  71  26.931  -2.156   2.210
  549    HG2  GLU  71           HG2      GLU  71  26.085  -0.055   3.218
  550    HG3  GLU  71           HG3      GLU  71  24.995  -0.973   4.257
  551    H    GLN  72           H        GLN  72  26.053  -1.849  -0.451
  552    HA   GLN  72           HA       GLN  72  25.697   1.046  -0.745
  553    HB2  GLN  72           HB2      GLN  72  26.832  -1.118  -2.571
  554    HB3  GLN  72           HB3      GLN  72  26.693   0.568  -3.069
  555    HG2  GLN  72           HG2      GLN  72  28.249  -0.357  -0.613
  556    HG3  GLN  72           HG3      GLN  72  28.950  -0.117  -2.206
  557   HE21  GLN  72          1HE2      GLN  72  30.118   1.312  -0.208
  558   HE22  GLN  72          2HE2      GLN  72  29.641   3.003  -0.325
  559    H    ILE  73           H        ILE  73  24.203  -1.846  -2.252
  560    HA   ILE  73           HA       ILE  73  22.486  -0.466  -4.060
  561    HB   ILE  73           HB       ILE  73  22.312  -3.153  -2.652
  562   HG12  ILE  73          2HG1      ILE  73  22.618  -2.473  -5.605
  563   HG13  ILE  73          3HG1      ILE  73  23.986  -2.633  -4.531
  564   HG21  ILE  73          1HG2      ILE  73  20.418  -3.663  -4.289
  565   HG22  ILE  73          2HG2      ILE  73  19.993  -2.620  -2.938
  566   HG23  ILE  73          3HG2      ILE  73  20.280  -1.916  -4.547
  567   HD11  ILE  73          3HD1      ILE  73  23.729  -4.693  -5.731
  568   HD12  ILE  73          1HD1      ILE  73  23.329  -4.979  -4.027
  569   HD13  ILE  73          2HD1      ILE  73  22.035  -4.854  -5.247
  570    H    GLN  74           H        GLN  74  21.771  -1.491  -0.677
  571    HA   GLN  74           HA       GLN  74  19.140  -0.338  -0.739
  572    HB2  GLN  74           HB2      GLN  74  19.031  -0.800   1.606
  573    HB3  GLN  74           HB3      GLN  74  19.789  -2.135   0.768
  574    HG2  GLN  74           HG2      GLN  74  21.129  -1.987   2.642
  575    HG3  GLN  74           HG3      GLN  74  22.046  -1.066   1.479
  576   HE21  GLN  74          1HE2      GLN  74  23.046   0.631   2.559
  577   HE22  GLN  74          2HE2      GLN  74  22.259   1.588   3.806
  578    H    ALA  75           H        ALA  75  22.283   1.118   0.108
  579    HA   ALA  75           HA       ALA  75  21.210   3.589   1.134
  580    HB1  ALA  75           HB1      ALA  75  23.904   2.932  -0.171
  581    HB2  ALA  75           HB2      ALA  75  23.514   4.415   0.714
  582    HB3  ALA  75           HB3      ALA  75  23.525   2.864   1.568
  583    H    TRP  76           H        TRP  76  22.275   2.572  -2.154
  584    HA   TRP  76           HA       TRP  76  21.674   5.049  -3.468
  585    HB2  TRP  76           HB2      TRP  76  23.102   3.290  -4.406
  586    HB3  TRP  76           HB3      TRP  76  21.729   2.209  -4.544
  587    HD1  TRP  76           HD1      TRP  76  23.192   5.398  -6.064
  588    HE1  TRP  76           HE1      TRP  76  22.172   5.830  -8.373
  589    HE3  TRP  76           HE3      TRP  76  19.625   1.728  -6.057
  590    HZ2  TRP  76           HZ2      TRP  76  20.045   4.741 -10.004
  591    HZ3  TRP  76           HZ3      TRP  76  18.082   1.479  -7.988
  592    HH2  TRP  76           HH2      TRP  76  18.276   2.978  -9.961
  593    H    MET  77           H        MET  77  19.646   2.072  -3.068
  594    HA   MET  77           HA       MET  77  17.327   3.077  -4.386
  595    HB2  MET  77           HB2      MET  77  17.616   1.063  -2.125
  596    HB3  MET  77           HB3      MET  77  16.095   1.394  -2.974
  597    HG2  MET  77           HG2      MET  77  17.067   0.675  -5.112
  598    HG3  MET  77           HG3      MET  77  18.632   0.459  -4.350
  599    HE1  MET  77           HE1      MET  77  14.998  -2.330  -3.919
  600    HE2  MET  77           HE2      MET  77  14.891  -0.621  -3.467
  601    HE3  MET  77           HE3      MET  77  15.215  -1.076  -5.154
  602    H    ARG  78           H        ARG  78  18.310   3.432  -0.944
  603    HA   ARG  78           HA       ARG  78  16.015   4.846  -0.071
  604    HB2  ARG  78           HB2      ARG  78  17.748   3.858   1.391
  605    HB3  ARG  78           HB3      ARG  78  18.881   5.127   0.916
  606    HG2  ARG  78           HG2      ARG  78  17.343   6.839   1.886
  607    HG3  ARG  78           HG3      ARG  78  16.213   5.542   2.328
  608    HD2  ARG  78           HD2      ARG  78  17.974   4.514   3.755
  609    HD3  ARG  78           HD3      ARG  78  19.080   5.839   3.310
  610    HE   ARG  78           HE       ARG  78  16.681   6.974   4.331
  611   HH11  ARG  78          1HH1      ARG  78  19.453   5.137   5.569
  612   HH12  ARG  78          2HH1      ARG  78  19.323   5.834   7.150
  613   HH21  ARG  78          1HH2      ARG  78  16.554   7.800   6.413
  614   HH22  ARG  78          2HH2      ARG  78  17.713   7.328   7.618
  615    H    GLU  79           H        GLU  79  19.003   6.115  -1.644
  616    HA   GLU  79           HA       GLU  79  18.182   8.878  -1.543
  617    HB2  GLU  79           HB2      GLU  79  20.130   7.445  -3.376
  618    HB3  GLU  79           HB3      GLU  79  19.828   9.185  -3.417
  619    HG2  GLU  79           HG2      GLU  79  20.472   9.344  -1.015
  620    HG3  GLU  79           HG3      GLU  79  20.890   7.629  -1.019
  621    H    LYS  80           H        LYS  80  17.711   6.322  -4.056
  622    HA   LYS  80           HA       LYS  80  16.312   8.021  -5.904
  623    HB2  LYS  80           HB2      LYS  80  16.241   5.011  -5.485
  624    HB3  LYS  80           HB3      LYS  80  15.501   5.819  -6.853
  625    HG2  LYS  80           HG2      LYS  80  18.476   5.720  -6.190
  626    HG3  LYS  80           HG3      LYS  80  17.646   4.839  -7.464
  627    HD2  LYS  80           HD2      LYS  80  17.989   7.853  -7.335
  628    HD3  LYS  80           HD3      LYS  80  18.926   6.738  -8.323
  629    HE2  LYS  80           HE2      LYS  80  16.876   6.040  -9.533
  630    HE3  LYS  80           HE3      LYS  80  15.918   7.183  -8.569
  631    HZ1  LYS  80           HZ1      LYS  80  17.306   8.973  -9.498
  632    HZ2  LYS  80           HZ2      LYS  80  16.554   8.135 -10.699
  633    HZ3  LYS  80           HZ3      LYS  80  18.148   7.897 -10.401
  634    H    GLN  81           H        GLN  81  15.081   6.270  -3.073
  635    HA   GLN  81           HA       GLN  81  12.278   6.653  -3.628
  636    HB2  GLN  81           HB2      GLN  81  13.843   6.345  -1.045
  637    HB3  GLN  81           HB3      GLN  81  12.093   6.561  -1.070
  638    HG2  GLN  81           HG2      GLN  81  11.763   4.544  -2.379
  639    HG3  GLN  81           HG3      GLN  81  13.494   4.317  -2.577
  640   HE21  GLN  81          1HE2      GLN  81  10.909   4.450  -0.035
  641   HE22  GLN  81          2HE2      GLN  81  11.760   3.364   1.053
  642    H    SER  82           H        SER  82  14.706   9.011  -2.458
  643    HA   SER  82           HA       SER  82  12.726  11.021  -1.759
  644    HB2  SER  82           HB2      SER  82  15.662  11.359  -2.479
  645    HB3  SER  82           HB3      SER  82  14.630  12.555  -1.704
  646    HG   SER  82           HG       SER  82  15.936  11.406  -0.184
  647    H    SER  83           H        SER  83  13.645   9.854  -4.849
  648    HA   SER  83           HA       SER  83  13.232  12.371  -6.304
  649    HB2  SER  83           HB2      SER  83  13.332   9.517  -7.356
  650    HB3  SER  83           HB3      SER  83  13.496  11.006  -8.291
  651    HG   SER  83           HG       SER  83  15.454  11.432  -7.244
  652    H    ASP  84           H        ASP  84  11.097  10.255  -4.775
  653    HA   ASP  84           HA       ASP  84   8.840  10.789  -6.675
  654    HB2  ASP  84           HB2      ASP  84   9.564   8.438  -6.580
  655    HB3  ASP  84           HB3      ASP  84   9.313   8.405  -4.846
  656    H    HIS  85           H        HIS  85   6.745  11.067  -5.745
  657    HA   HIS  85           HA       HIS  85   6.418  11.629  -2.879
  658    HB2  HIS  85           HB2      HIS  85   7.338  13.741  -3.750
  659    HB3  HIS  85           HB3      HIS  85   6.077  13.815  -4.982
  660    HD1  HIS  85           HD1      HIS  85   3.563  14.390  -4.062
  661    HD2  HIS  85           HD2      HIS  85   6.694  14.479  -1.253
  662    HE1  HIS  85           HE1      HIS  85   2.640  15.583  -2.003
  Start of MODEL    4
    1    H2   PRO   1           H2       PRO   1  -1.323   4.395 -14.105
    2    H3   PRO   1           H3       PRO   1  -2.738   4.141 -14.913
    3    HA   PRO   1           HA       PRO   1  -2.572   1.816 -14.719
    4    HB2  PRO   1           HB2      PRO   1   0.209   2.055 -13.553
    5    HB3  PRO   1           HB3      PRO   1  -0.518   0.727 -14.510
    6    HG2  PRO   1           HG2      PRO   1   1.002   3.002 -15.477
    7    HG3  PRO   1           HG3      PRO   1   0.136   1.807 -16.489
    8    HD2  PRO   1           HD2      PRO   1  -0.578   4.486 -16.329
    9    HD3  PRO   1           HD3      PRO   1  -1.695   3.160 -16.751
   10    H    GLY   2           H        GLY   2  -2.604   0.389 -12.751
   11    HA2  GLY   2           HA2      GLY   2  -3.540   1.907 -10.368
   12    HA3  GLY   2           HA3      GLY   2  -3.817   0.186 -10.741
   13    H    SER   3           H        SER   3  -0.695   0.318 -11.352
   14    HA   SER   3           HA       SER   3   0.387   0.282  -8.600
   15    HB2  SER   3           HB2      SER   3   0.636  -2.032 -10.563
   16    HB3  SER   3           HB3      SER   3   1.556  -1.868  -9.064
   17    HG   SER   3           HG       SER   3  -0.308  -3.220  -8.854
   18    H    ALA   4           H        ALA   4   2.779   0.308  -8.596
   19    HA   ALA   4           HA       ALA   4   4.220   1.033 -11.035
   20    HB1  ALA   4           HB1      ALA   4   4.722   3.347 -10.271
   21    HB2  ALA   4           HB2      ALA   4   2.990   3.129 -10.539
   22    HB3  ALA   4           HB3      ALA   4   3.657   3.131  -8.877
   23    H    GLU   5           H        GLU   5   6.481   1.808 -10.450
   24    HA   GLU   5           HA       GLU   5   7.656   1.025  -7.932
   25    HB2  GLU   5           HB2      GLU   5   9.109  -0.739  -8.773
   26    HB3  GLU   5           HB3      GLU   5   7.419  -1.203  -8.895
   27    HG2  GLU   5           HG2      GLU   5   7.474  -0.565 -11.347
   28    HG3  GLU   5           HG3      GLU   5   9.217  -0.293 -11.178
   29    H    ILE   6           H        ILE   6  10.047   1.316  -7.977
   30    HA   ILE   6           HA       ILE   6  10.682   3.846  -9.298
   31    HB   ILE   6           HB       ILE   6  12.402   2.090  -7.534
   32   HG12  ILE   6          2HG1      ILE   6  10.453   2.617  -6.218
   33   HG13  ILE   6          3HG1      ILE   6  11.833   3.536  -5.643
   34   HG21  ILE   6          1HG2      ILE   6  12.680   5.016  -8.331
   35   HG22  ILE   6          2HG2      ILE   6  13.581   4.252  -7.000
   36   HG23  ILE   6          3HG2      ILE   6  13.816   3.680  -8.645
   37   HD11  ILE   6          3HD1      ILE   6   9.552   4.625  -7.373
   38   HD12  ILE   6          1HD1      ILE   6   9.802   4.910  -5.639
   39   HD13  ILE   6          2HD1      ILE   6  10.952   5.574  -6.814
   40    H    ASP   7           H        ASP   7  12.283   4.258 -10.781
   41    HA   ASP   7           HA       ASP   7  12.794   2.173 -12.734
   42    HB2  ASP   7           HB2      ASP   7  12.093   4.461 -13.320
   43    HB3  ASP   7           HB3      ASP   7  13.595   5.105 -12.654
   44    H    TYR   8           H        TYR   8  14.053   0.966 -10.923
   45    HA   TYR   8           HA       TYR   8  16.799   1.705 -10.463
   46    HB2  TYR   8           HB2      TYR   8  15.554  -1.054 -10.243
   47    HB3  TYR   8           HB3      TYR   8  17.057  -0.505  -9.541
   48    HD1  TYR   8           HD2      TYR   8  16.589   1.965  -8.167
   49    HD2  TYR   8           HD1      TYR   8  13.970  -1.447  -8.562
   50    HE1  TYR   8           HE2      TYR   8  15.537   2.510  -5.993
   51    HE2  TYR   8           HE1      TYR   8  12.896  -0.872  -6.408
   52    HH   TYR   8           HH       TYR   8  12.874   0.555  -4.585
   53    H    SER   9           H        SER   9  15.503   0.709 -13.397
   54    HA   SER   9           HA       SER   9  17.735  -0.710 -14.551
   55    HB2  SER   9           HB2      SER   9  15.881   1.330 -15.851
   56    HB3  SER   9           HB3      SER   9  16.921   0.159 -16.679
   57    HG   SER   9           HG       SER   9  14.738  -0.562 -16.513
   58    H    ASP  10           H        ASP  10  17.436   2.567 -13.403
   59    HA   ASP  10           HA       ASP  10  19.644   3.775 -14.818
   60    HB2  ASP  10           HB2      ASP  10  17.717   4.936 -13.718
   61    HB3  ASP  10           HB3      ASP  10  18.334   4.434 -12.144
   62    H    ALA  11           H        ALA  11  19.669   1.310 -12.448
   63    HA   ALA  11           HA       ALA  11  21.920   2.039 -10.870
   64    HB1  ALA  11           HB1      ALA  11  20.793  -0.700 -11.571
   65    HB2  ALA  11           HB2      ALA  11  21.896  -0.356 -10.221
   66    HB3  ALA  11           HB3      ALA  11  20.261   0.319 -10.233
   67    HA   PRO  12           HA       PRO  12  25.405   1.078 -13.522
   68    HB2  PRO  12           HB2      PRO  12  27.319   0.303 -11.744
   69    HB3  PRO  12           HB3      PRO  12  26.741   1.985 -11.864
   70    HG2  PRO  12           HG2      PRO  12  25.811  -0.151  -9.909
   71    HG3  PRO  12           HG3      PRO  12  26.344   1.526  -9.544
   72    HD2  PRO  12           HD2      PRO  12  23.709   0.902  -9.807
   73    HD3  PRO  12           HD3      PRO  12  24.349   2.443 -10.430
   74    H    ASP  13           H        ASP  13  26.642  -0.725 -14.341
   75    HA   ASP  13           HA       ASP  13  25.173  -3.114 -14.609
   76    HB2  ASP  13           HB2      ASP  13  26.796  -2.103 -16.215
   77    HB3  ASP  13           HB3      ASP  13  28.117  -2.584 -15.161
   78    H    GLU  14           H        GLU  14  27.574  -2.309 -12.197
   79    HA   GLU  14           HA       GLU  14  28.108  -5.040 -11.342
   80    HB2  GLU  14           HB2      GLU  14  29.361  -4.065  -9.540
   81    HB3  GLU  14           HB3      GLU  14  29.744  -3.237 -11.052
   82    HG2  GLU  14           HG2      GLU  14  28.132  -1.393 -10.354
   83    HG3  GLU  14           HG3      GLU  14  27.979  -2.182  -8.792
   84    H    PHE  15           H        PHE  15  25.463  -2.893 -10.777
   85    HA   PHE  15           HA       PHE  15  24.491  -4.405  -8.384
   86    HB2  PHE  15           HB2      PHE  15  23.596  -1.846  -9.771
   87    HB3  PHE  15           HB3      PHE  15  22.655  -2.656  -8.533
   88    HD1  PHE  15           HD1      PHE  15  26.041  -2.997  -7.447
   89    HD2  PHE  15           HD2      PHE  15  22.827  -0.130  -7.839
   90    HE1  PHE  15           HE1      PHE  15  27.046  -1.601  -5.677
   91    HE2  PHE  15           HE2      PHE  15  23.846   1.250  -6.064
   92    HZ   PHE  15           HZ       PHE  15  25.958   0.515  -4.962
   93    H    ARG  16           H        ARG  16  24.095  -4.265 -11.856
   94    HA   ARG  16           HA       ARG  16  21.373  -5.447 -11.732
   95    HB2  ARG  16           HB2      ARG  16  22.994  -4.252 -14.005
   96    HB3  ARG  16           HB3      ARG  16  21.408  -5.025 -14.215
   97    HG2  ARG  16           HG2      ARG  16  20.318  -3.389 -12.778
   98    HG3  ARG  16           HG3      ARG  16  21.866  -2.699 -12.295
   99    HD2  ARG  16           HD2      ARG  16  20.852  -1.225 -13.888
  100    HD3  ARG  16           HD3      ARG  16  22.299  -1.950 -14.599
  101    HE   ARG  16           HE       ARG  16  19.866  -3.409 -15.266
  102   HH11  ARG  16          1HH1      ARG  16  21.725  -0.546 -16.178
  103   HH12  ARG  16          2HH1      ARG  16  21.124  -0.563 -17.812
  104   HH21  ARG  16          1HH2      ARG  16  19.095  -3.360 -17.324
  105   HH22  ARG  16          2HH2      ARG  16  19.652  -2.166 -18.469
  106    H    ASP  17           H        ASP  17  20.998  -7.553 -12.106
  107    HA   ASP  17           HA       ASP  17  23.200  -9.390 -12.784
  108    HB2  ASP  17           HB2      ASP  17  21.692 -10.079 -11.062
  109    HB3  ASP  17           HB3      ASP  17  20.297  -9.832 -12.092
  110    HA   PRO  18           HA       PRO  18  22.412  -8.890 -17.062
  111    HB2  PRO  18           HB2      PRO  18  23.834 -10.983 -18.172
  112    HB3  PRO  18           HB3      PRO  18  24.543  -9.492 -17.479
  113    HG2  PRO  18           HG2      PRO  18  24.247 -12.203 -16.202
  114    HG3  PRO  18           HG3      PRO  18  25.643 -11.104 -16.137
  115    HD2  PRO  18           HD2      PRO  18  23.811 -11.296 -14.105
  116    HD3  PRO  18           HD3      PRO  18  24.621  -9.750 -14.520
  117    H    LEU  19           H        LEU  19  21.082 -11.785 -15.604
  118    HA   LEU  19           HA       LEU  19  19.434 -12.325 -18.050
  119    HB2  LEU  19           HB2      LEU  19  20.311 -14.296 -16.892
  120    HB3  LEU  19           HB3      LEU  19  19.654 -13.732 -15.359
  121    HG   LEU  19           HG       LEU  19  17.343 -14.041 -16.259
  122   HD11  LEU  19          1HD1      LEU  19  17.774 -13.758 -18.688
  123   HD12  LEU  19          2HD1      LEU  19  17.009 -15.313 -18.355
  124   HD13  LEU  19          3HD1      LEU  19  18.761 -15.239 -18.691
  125   HD21  LEU  19          3HD2      LEU  19  19.143 -16.485 -16.460
  126   HD22  LEU  19          1HD2      LEU  19  17.379 -16.502 -16.246
  127   HD23  LEU  19          2HD2      LEU  19  18.416 -15.829 -14.985
  128    H    MET  20           H        MET  20  19.238 -11.163 -14.684
  129    HA   MET  20           HA       MET  20  16.408 -10.757 -14.621
  130    HB2  MET  20           HB2      MET  20  18.294 -10.818 -12.745
  131    HB3  MET  20           HB3      MET  20  18.353  -9.072 -13.027
  132    HG2  MET  20           HG2      MET  20  15.856  -9.035 -12.602
  133    HG3  MET  20           HG3      MET  20  15.962 -10.756 -12.225
  134    HE1  MET  20           HE1      MET  20  14.721  -8.458 -10.312
  135    HE2  MET  20           HE2      MET  20  14.718 -10.190  -9.926
  136    HE3  MET  20           HE3      MET  20  15.332  -9.019  -8.744
  137    H    ASP  21           H        ASP  21  19.025  -8.703 -15.717
  138    HA   ASP  21           HA       ASP  21  19.179  -6.866 -17.000
  139    HB2  ASP  21           HB2      ASP  21  17.202  -7.852 -18.229
  140    HB3  ASP  21           HB3      ASP  21  16.159  -6.784 -17.284
  141    H    THR  22           H        THR  22  17.895  -6.884 -14.013
  142    HA   THR  22           HA       THR  22  18.130  -3.965 -13.602
  143    HB   THR  22           HB       THR  22  15.756  -4.461 -14.194
  144    HG1  THR  22           HG1      THR  22  15.018  -3.143 -12.564
  145   HG21  THR  22          1HG2      THR  22  15.656  -5.844 -11.468
  146   HG22  THR  22          2HG2      THR  22  15.509  -6.669 -13.034
  147   HG23  THR  22          3HG2      THR  22  14.294  -5.486 -12.540
  148    H    LEU  23           H        LEU  23  17.477  -3.702 -11.083
  149    HA   LEU  23           HA       LEU  23  19.860  -4.493  -9.801
  150    HB2  LEU  23           HB2      LEU  23  17.827  -2.641  -9.362
  151    HB3  LEU  23           HB3      LEU  23  17.634  -3.716  -7.988
  152    HG   LEU  23           HG       LEU  23  20.170  -2.257  -8.806
  153   HD11  LEU  23          1HD1      LEU  23  18.255  -1.839  -6.482
  154   HD12  LEU  23          2HD1      LEU  23  18.456  -0.769  -7.869
  155   HD13  LEU  23          3HD1      LEU  23  19.785  -0.955  -6.714
  156   HD21  LEU  23          3HD2      LEU  23  19.641  -3.929  -6.304
  157   HD22  LEU  23          1HD2      LEU  23  21.116  -3.001  -6.650
  158   HD23  LEU  23          2HD2      LEU  23  20.721  -4.405  -7.624
  159    H    MET  24           H        MET  24  20.475  -6.354  -8.904
  160    HA   MET  24           HA       MET  24  18.700  -8.557  -8.421
  161    HB2  MET  24           HB2      MET  24  20.664  -9.634  -7.374
  162    HB3  MET  24           HB3      MET  24  20.981  -8.974  -8.987
  163    HG2  MET  24           HG2      MET  24  22.024  -6.969  -7.846
  164    HG3  MET  24           HG3      MET  24  21.871  -7.840  -6.310
  165    HE1  MET  24           HE1      MET  24  24.441  -6.819  -6.722
  166    HE2  MET  24           HE2      MET  24  25.672  -7.698  -7.658
  167    HE3  MET  24           HE3      MET  24  24.458  -6.719  -8.494
  168    H    THR  25           H        THR  25  19.835  -6.031  -6.287
  169    HA   THR  25           HA       THR  25  19.279  -5.334  -4.202
  170    HB   THR  25           HB       THR  25  17.107  -7.456  -4.085
  171    HG1  THR  25           HG1      THR  25  16.763  -6.227  -5.912
  172   HG21  THR  25          1HG2      THR  25  17.552  -6.313  -1.942
  173   HG22  THR  25          2HG2      THR  25  16.016  -5.775  -2.633
  174   HG23  THR  25          3HG2      THR  25  17.461  -4.732  -2.742
  175    H    ASP  26           H        ASP  26  19.375  -8.855  -4.457
  176    HA   ASP  26           HA       ASP  26  20.953  -9.076  -1.921
  177    HB2  ASP  26           HB2      ASP  26  18.942 -10.955  -3.182
  178    HB3  ASP  26           HB3      ASP  26  20.040 -11.408  -1.884
  179    HA   PRO  27           HA       PRO  27  23.831 -10.388  -5.313
  180    HB2  PRO  27           HB2      PRO  27  26.121  -9.342  -4.191
  181    HB3  PRO  27           HB3      PRO  27  24.993  -8.413  -5.206
  182    HG2  PRO  27           HG2      PRO  27  25.113  -8.486  -2.194
  183    HG3  PRO  27           HG3      PRO  27  24.958  -7.059  -3.258
  184    HD2  PRO  27           HD2      PRO  27  22.814  -8.153  -2.044
  185    HD3  PRO  27           HD3      PRO  27  22.693  -7.521  -3.714
  186    H    VAL  28           H        VAL  28  24.759 -12.351  -5.313
  187    HA   VAL  28           HA       VAL  28  25.987 -13.469  -2.806
  188    HB   VAL  28           HB       VAL  28  24.285 -14.941  -4.863
  189   HG11  VAL  28          1HG1      VAL  28  24.568 -16.919  -3.399
  190   HG12  VAL  28          2HG1      VAL  28  26.111 -16.404  -4.089
  191   HG13  VAL  28          3HG1      VAL  28  25.727 -16.021  -2.401
  192   HG21  VAL  28          3HG2      VAL  28  22.783 -15.391  -2.938
  193   HG22  VAL  28          1HG2      VAL  28  23.818 -14.395  -1.894
  194   HG23  VAL  28          2HG2      VAL  28  22.931 -13.653  -3.225
  195    H    ARG  29           H        ARG  29  27.979 -14.125  -3.001
  196    HA   ARG  29           HA       ARG  29  29.391 -13.842  -5.538
  197    HB2  ARG  29           HB2      ARG  29  30.087 -12.876  -3.336
  198    HB3  ARG  29           HB3      ARG  29  30.448 -14.503  -2.760
  199    HG2  ARG  29           HG2      ARG  29  32.161 -14.713  -4.549
  200    HG3  ARG  29           HG3      ARG  29  31.728 -13.098  -5.165
  201    HD2  ARG  29           HD2      ARG  29  32.350 -12.122  -2.952
  202    HD3  ARG  29           HD3      ARG  29  32.826 -13.723  -2.381
  203    HE   ARG  29           HE       ARG  29  34.332 -11.934  -4.095
  204   HH11  ARG  29          1HH1      ARG  29  33.972 -15.379  -3.385
  205   HH12  ARG  29          2HH1      ARG  29  35.630 -15.724  -3.803
  206   HH21  ARG  29          1HH2      ARG  29  36.436 -12.468  -4.661
  207   HH22  ARG  29          2HH2      ARG  29  36.970 -14.110  -4.536
  208    H    LEU  30           H        LEU  30  30.432 -15.362  -6.628
  209    HA   LEU  30           HA       LEU  30  30.243 -18.255  -5.915
  210    HB2  LEU  30           HB2      LEU  30  30.517 -16.680  -8.525
  211    HB3  LEU  30           HB3      LEU  30  30.957 -18.360  -8.450
  212    HG   LEU  30           HG       LEU  30  28.628 -18.934  -7.663
  213   HD11  LEU  30          1HD1      LEU  30  27.722 -16.872  -6.790
  214   HD12  LEU  30          2HD1      LEU  30  26.821 -17.255  -8.250
  215   HD13  LEU  30          3HD1      LEU  30  28.083 -16.004  -8.300
  216   HD21  LEU  30          3HD2      LEU  30  28.945 -17.522 -10.345
  217   HD22  LEU  30          1HD2      LEU  30  27.661 -18.688  -9.952
  218   HD23  LEU  30          2HD2      LEU  30  29.356 -19.207  -9.997
  219    HA   PRO  31           HA       PRO  31  34.471 -18.420  -4.934
  220    HB2  PRO  31           HB2      PRO  31  35.435 -20.767  -6.016
  221    HB3  PRO  31           HB3      PRO  31  34.273 -20.699  -4.642
  222    HG2  PRO  31           HG2      PRO  31  33.665 -21.060  -7.592
  223    HG3  PRO  31           HG3      PRO  31  33.053 -22.039  -6.224
  224    HD2  PRO  31           HD2      PRO  31  31.575 -20.059  -7.274
  225    HD3  PRO  31           HD3      PRO  31  31.609 -20.263  -5.503
  226    H    SER  32           H        SER  32  33.809 -18.436  -8.404
  227    HA   SER  32           HA       SER  32  36.490 -17.907  -9.358
  228    HB2  SER  32           HB2      SER  32  35.232 -17.216 -11.388
  229    HB3  SER  32           HB3      SER  32  34.734 -18.796 -10.780
  230    HG   SER  32           HG       SER  32  32.907 -17.560 -11.291
  231    H    GLY  33           H        GLY  33  34.389 -15.970  -7.481
  232    HA2  GLY  33           HA2      GLY  33  34.726 -13.762  -6.753
  233    HA3  GLY  33           HA3      GLY  33  35.794 -13.433  -8.148
  234    H    THR  34           H        THR  34  33.114 -14.961  -9.376
  235    HA   THR  34           HA       THR  34  31.877 -12.531 -10.424
  236    HB   THR  34           HB       THR  34  30.971 -15.447 -10.558
  237    HG1  THR  34           HG1      THR  34  32.891 -15.270 -11.585
  238   HG21  THR  34          1HG2      THR  34  29.791 -14.681 -12.631
  239   HG22  THR  34          2HG2      THR  34  30.167 -13.004 -12.203
  240   HG23  THR  34          3HG2      THR  34  29.105 -13.987 -11.163
  241    H    VAL  35           H        VAL  35  29.807 -11.736  -9.928
  242    HA   VAL  35           HA       VAL  35  28.495 -12.769  -7.443
  243    HB   VAL  35           HB       VAL  35  28.691  -9.874  -8.352
  244   HG11  VAL  35          1HG1      VAL  35  27.252 -11.087  -5.933
  245   HG12  VAL  35          2HG1      VAL  35  27.468  -9.347  -6.250
  246   HG13  VAL  35          3HG1      VAL  35  26.466 -10.313  -7.330
  247   HG21  VAL  35          3HG2      VAL  35  30.761 -10.635  -7.253
  248   HG22  VAL  35          1HG2      VAL  35  29.878  -9.553  -6.164
  249   HG23  VAL  35          2HG2      VAL  35  29.827 -11.307  -5.896
  250    H    MET  36           H        MET  36  26.437 -13.265  -7.602
  251    HA   MET  36           HA       MET  36  24.843 -12.633 -10.059
  252    HB2  MET  36           HB2      MET  36  25.778 -15.182  -9.132
  253    HB3  MET  36           HB3      MET  36  24.067 -15.124  -8.750
  254    HG2  MET  36           HG2      MET  36  24.245 -16.041 -10.934
  255    HG3  MET  36           HG3      MET  36  23.606 -14.422 -11.106
  256    HE1  MET  36           HE1      MET  36  27.295 -15.969 -10.720
  257    HE2  MET  36           HE2      MET  36  26.355 -16.938 -11.881
  258    HE3  MET  36           HE3      MET  36  27.740 -15.983 -12.434
  259    H    ASP  37           H        ASP  37  22.522 -12.729  -9.767
  260    HA   ASP  37           HA       ASP  37  21.425 -11.750  -7.267
  261    HB2  ASP  37           HB2      ASP  37  20.299 -11.211  -9.343
  262    HB3  ASP  37           HB3      ASP  37  20.240 -12.904  -9.821
  263    H    ARG  38           H        ARG  38  20.706 -12.839  -5.556
  264    HA   ARG  38           HA       ARG  38  21.256 -15.466  -4.910
  265    HB2  ARG  38           HB2      ARG  38  20.636 -13.637  -3.353
  266    HB3  ARG  38           HB3      ARG  38  18.962 -13.732  -3.891
  267    HG2  ARG  38           HG2      ARG  38  18.833 -16.072  -3.078
  268    HG3  ARG  38           HG3      ARG  38  20.517 -15.995  -2.529
  269    HD2  ARG  38           HD2      ARG  38  18.228 -14.243  -1.556
  270    HD3  ARG  38           HD3      ARG  38  18.841 -15.676  -0.719
  271    HE   ARG  38           HE       ARG  38  21.102 -14.144  -1.025
  272   HH11  ARG  38          1HH1      ARG  38  17.976 -13.522   0.507
  273   HH12  ARG  38          2HH1      ARG  38  18.626 -12.280   1.536
  274   HH21  ARG  38          1HH2      ARG  38  21.877 -12.566   0.361
  275   HH22  ARG  38          2HH2      ARG  38  20.796 -11.773   1.469
  276    H    SER  39           H        SER  39  18.067 -14.302  -6.168
  277    HA   SER  39           HA       SER  39  16.808 -16.878  -5.889
  278    HB2  SER  39           HB2      SER  39  15.982 -14.482  -7.591
  279    HB3  SER  39           HB3      SER  39  14.984 -15.882  -7.176
  280    HG   SER  39           HG       SER  39  14.613 -14.076  -5.785
  281    H    ILE  40           H        ILE  40  18.356 -15.240  -8.698
  282    HA   ILE  40           HA       ILE  40  17.691 -17.329 -10.594
  283    HB   ILE  40           HB       ILE  40  19.732 -15.072 -10.599
  284   HG12  ILE  40          2HG1      ILE  40  17.150 -15.535 -12.195
  285   HG13  ILE  40          3HG1      ILE  40  17.192 -14.619 -10.703
  286   HG21  ILE  40          1HG2      ILE  40  20.649 -16.838 -12.057
  287   HG22  ILE  40          2HG2      ILE  40  19.089 -16.965 -12.905
  288   HG23  ILE  40          3HG2      ILE  40  20.062 -15.480 -13.010
  289   HD11  ILE  40          3HD1      ILE  40  18.771 -12.984 -11.744
  290   HD12  ILE  40          1HD1      ILE  40  18.567 -13.847 -13.295
  291   HD13  ILE  40          2HD1      ILE  40  17.185 -13.066 -12.529
  292    H    ILE  41           H        ILE  41  20.677 -16.836  -8.594
  293    HA   ILE  41           HA       ILE  41  21.937 -19.147  -9.770
  294    HB   ILE  41           HB       ILE  41  23.207 -17.365  -8.628
  295   HG12  ILE  41          2HG1      ILE  41  24.876 -18.765  -7.488
  296   HG13  ILE  41          3HG1      ILE  41  23.750 -20.129  -7.454
  297   HG21  ILE  41          1HG2      ILE  41  22.316 -18.623  -5.993
  298   HG22  ILE  41          2HG2      ILE  41  23.509 -17.324  -6.204
  299   HG23  ILE  41          3HG2      ILE  41  21.821 -17.031  -6.602
  300   HD11  ILE  41          3HD1      ILE  41  25.470 -20.267  -9.246
  301   HD12  ILE  41          1HD1      ILE  41  23.823 -20.283  -9.886
  302   HD13  ILE  41          2HD1      ILE  41  24.815 -18.796  -9.984
  303    H    LEU  42           H        LEU  42  19.948 -18.879  -6.764
  304    HA   LEU  42           HA       LEU  42  20.217 -21.703  -6.242
  305    HB2  LEU  42           HB2      LEU  42  18.801 -21.433  -4.437
  306    HB3  LEU  42           HB3      LEU  42  19.677 -19.928  -4.576
  307    HG   LEU  42           HG       LEU  42  17.541 -19.033  -5.797
  308   HD11  LEU  42          1HD1      LEU  42  15.425 -20.060  -4.927
  309   HD12  LEU  42          2HD1      LEU  42  16.358 -21.418  -4.278
  310   HD13  LEU  42          3HD1      LEU  42  16.252 -21.162  -6.026
  311   HD21  LEU  42          3HD2      LEU  42  17.484 -19.693  -2.826
  312   HD22  LEU  42          1HD2      LEU  42  16.590 -18.392  -3.629
  313   HD23  LEU  42          2HD2      LEU  42  18.361 -18.333  -3.556
  314    H    ARG  43           H        ARG  43  17.826 -19.885  -8.180
  315    HA   ARG  43           HA       ARG  43  16.117 -22.128  -8.680
  316    HB2  ARG  43           HB2      ARG  43  15.421 -19.836  -9.004
  317    HB3  ARG  43           HB3      ARG  43  16.579 -19.597 -10.317
  318    HG2  ARG  43           HG2      ARG  43  14.493 -21.795 -10.491
  319    HG3  ARG  43           HG3      ARG  43  14.015 -20.125 -10.769
  320    HD2  ARG  43           HD2      ARG  43  15.518 -19.857 -12.626
  321    HD3  ARG  43           HD3      ARG  43  16.270 -21.418 -12.356
  322    HE   ARG  43           HE       ARG  43  13.764 -20.893 -13.711
  323   HH11  ARG  43          1HH1      ARG  43  15.491 -23.476 -11.960
  324   HH12  ARG  43          2HH1      ARG  43  14.556 -24.714 -12.745
  325   HH21  ARG  43          1HH2      ARG  43  12.619 -22.549 -14.647
  326   HH22  ARG  43          2HH2      ARG  43  12.957 -24.201 -14.236
  327    H    HIS  44           H        HIS  44  19.087 -20.995 -10.375
  328    HA   HIS  44           HA       HIS  44  18.881 -23.017 -12.444
  329    HB2  HIS  44           HB2      HIS  44  20.276 -20.857 -12.429
  330    HB3  HIS  44           HB3      HIS  44  21.459 -21.743 -11.461
  331    HD1  HIS  44           HD1      HIS  44  20.162 -21.403 -15.018
  332    HD2  HIS  44           HD2      HIS  44  22.561 -24.014 -12.750
  333    HE1  HIS  44           HE1      HIS  44  21.411 -22.849 -16.695
  334    H    LEU  45           H        LEU  45  20.665 -22.941  -9.308
  335    HA   LEU  45           HA       LEU  45  21.749 -25.558  -9.407
  336    HB2  LEU  45           HB2      LEU  45  21.220 -23.510  -7.308
  337    HB3  LEU  45           HB3      LEU  45  21.428 -25.160  -6.755
  338    HG   LEU  45           HG       LEU  45  23.603 -25.354  -7.719
  339   HD11  LEU  45          1HD1      LEU  45  23.390 -24.021  -9.793
  340   HD12  LEU  45          2HD1      LEU  45  24.791 -23.520  -8.864
  341   HD13  LEU  45          3HD1      LEU  45  23.314 -22.534  -8.834
  342   HD21  LEU  45          3HD2      LEU  45  23.315 -22.696  -6.259
  343   HD22  LEU  45          1HD2      LEU  45  24.803 -23.661  -6.394
  344   HD23  LEU  45          2HD2      LEU  45  23.401 -24.299  -5.508
  345    H    LEU  46           H        LEU  46  18.494 -24.575  -8.398
  346    HA   LEU  46           HA       LEU  46  17.555 -27.072  -7.483
  347    HB2  LEU  46           HB2      LEU  46  16.462 -24.495  -8.274
  348    HB3  LEU  46           HB3      LEU  46  15.497 -25.735  -9.020
  349    HG   LEU  46           HG       LEU  46  14.557 -25.012  -6.912
  350   HD11  LEU  46          1HD1      LEU  46  14.185 -27.158  -5.837
  351   HD12  LEU  46          2HD1      LEU  46  15.611 -27.855  -6.614
  352   HD13  LEU  46          3HD1      LEU  46  14.221 -27.364  -7.599
  353   HD21  LEU  46          3HD2      LEU  46  16.607 -24.301  -5.754
  354   HD22  LEU  46          1HD2      LEU  46  17.095 -25.991  -5.533
  355   HD23  LEU  46          2HD2      LEU  46  15.620 -25.380  -4.751
  356    H    ASN  47           H        ASN  47  18.099 -26.046 -10.821
  357    HA   ASN  47           HA       ASN  47  16.868 -28.524 -11.895
  358    HB2  ASN  47           HB2      ASN  47  16.446 -26.384 -13.040
  359    HB3  ASN  47           HB3      ASN  47  18.179 -26.167 -13.298
  360   HD21  ASN  47          1HD2      ASN  47  15.344 -28.144 -14.228
  361   HD22  ASN  47          2HD2      ASN  47  16.105 -28.832 -15.647
  362    H    SER  48           H        SER  48  20.098 -26.899 -11.926
  363    HA   SER  48           HA       SER  48  21.476 -29.524 -11.988
  364    HB2  SER  48           HB2      SER  48  21.856 -27.372 -14.115
  365    HB3  SER  48           HB3      SER  48  22.946 -28.726 -13.861
  366    HG   SER  48           HG       SER  48  20.255 -28.792 -14.754
  367    HA   PRO  49           HA       PRO  49  24.104 -26.959  -9.394
  368    HB2  PRO  49           HB2      PRO  49  26.105 -28.674  -8.766
  369    HB3  PRO  49           HB3      PRO  49  24.412 -28.934  -8.232
  370    HG2  PRO  49           HG2      PRO  49  25.820 -30.139 -10.653
  371    HG3  PRO  49           HG3      PRO  49  24.890 -31.000  -9.375
  372    HD2  PRO  49           HD2      PRO  49  23.776 -30.258 -11.785
  373    HD3  PRO  49           HD3      PRO  49  22.834 -30.255 -10.252
  374    H    THR  50           H        THR  50  24.300 -25.670 -11.464
  375    HA   THR  50           HA       THR  50  27.118 -25.461 -12.349
  376    HB   THR  50           HB       THR  50  26.165 -25.041 -14.719
  377    HG1  THR  50           HG1      THR  50  23.970 -25.093 -14.347
  378   HG21  THR  50          1HG2      THR  50  27.527 -27.025 -14.150
  379   HG22  THR  50          2HG2      THR  50  26.281 -27.377 -15.345
  380   HG23  THR  50          3HG2      THR  50  26.049 -27.902 -13.671
  381    H    ASP  51           H        ASP  51  27.700 -23.520 -13.353
  382    HA   ASP  51           HA       ASP  51  26.522 -21.143 -12.219
  383    HB2  ASP  51           HB2      ASP  51  28.909 -21.380 -12.667
  384    HB3  ASP  51           HB3      ASP  51  28.614 -21.554 -14.395
  385    HA   PRO  52           HA       PRO  52  23.249 -20.881 -15.171
  386    HB2  PRO  52           HB2      PRO  52  22.412 -18.232 -14.856
  387    HB3  PRO  52           HB3      PRO  52  22.048 -19.585 -13.737
  388    HG2  PRO  52           HG2      PRO  52  24.265 -17.530 -13.537
  389    HG3  PRO  52           HG3      PRO  52  23.125 -18.083 -12.261
  390    HD2  PRO  52           HD2      PRO  52  25.636 -19.094 -12.444
  391    HD3  PRO  52           HD3      PRO  52  24.252 -20.171 -12.074
  392    H    PHE  53           H        PHE  53  26.036 -18.795 -15.627
  393    HA   PHE  53           HA       PHE  53  25.160 -18.175 -18.433
  394    HB2  PHE  53           HB2      PHE  53  27.107 -16.714 -16.601
  395    HB3  PHE  53           HB3      PHE  53  26.703 -16.257 -18.244
  396    HD1  PHE  53           HD2      PHE  53  24.331 -15.534 -18.816
  397    HD2  PHE  53           HD1      PHE  53  25.690 -16.078 -14.759
  398    HE1  PHE  53           HE2      PHE  53  22.411 -14.198 -17.991
  399    HE2  PHE  53           HE1      PHE  53  23.734 -14.761 -13.941
  400    HZ   PHE  53           HZ       PHE  53  22.120 -13.822 -15.535
  401    H    ASN  54           H        ASN  54  27.852 -19.361 -16.416
  402    HA   ASN  54           HA       ASN  54  29.601 -19.677 -18.788
  403    HB2  ASN  54           HB2      ASN  54  30.337 -18.548 -16.654
  404    HB3  ASN  54           HB3      ASN  54  30.179 -20.103 -15.837
  405   HD21  ASN  54          1HD2      ASN  54  32.446 -20.170 -15.297
  406   HD22  ASN  54          2HD2      ASN  54  33.647 -20.449 -16.544
  407    H    ARG  55           H        ARG  55  27.682 -21.639 -16.628
  408    HA   ARG  55           HA       ARG  55  27.154 -23.760 -16.483
  409    HB2  ARG  55           HB2      ARG  55  28.143 -24.019 -19.347
  410    HB3  ARG  55           HB3      ARG  55  27.029 -25.116 -18.539
  411    HG2  ARG  55           HG2      ARG  55  26.466 -22.159 -19.082
  412    HG3  ARG  55           HG3      ARG  55  25.926 -23.493 -20.088
  413    HD2  ARG  55           HD2      ARG  55  24.434 -24.318 -18.408
  414    HD3  ARG  55           HD3      ARG  55  25.189 -23.361 -17.148
  415    HE   ARG  55           HE       ARG  55  24.035 -21.471 -17.783
  416   HH11  ARG  55          1HH1      ARG  55  23.423 -23.943 -20.258
  417   HH12  ARG  55          2HH1      ARG  55  22.162 -22.998 -20.997
  418   HH21  ARG  55          1HH2      ARG  55  22.459 -20.327 -18.791
  419   HH22  ARG  55          2HH2      ARG  55  21.597 -20.985 -20.160
  420    H    GLN  56           H        GLN  56  30.033 -23.045 -15.883
  421    HA   GLN  56           HA       GLN  56  31.388 -25.629 -15.657
  422    HB2  GLN  56           HB2      GLN  56  32.697 -24.540 -13.931
  423    HB3  GLN  56           HB3      GLN  56  32.647 -23.519 -15.360
  424    HG2  GLN  56           HG2      GLN  56  31.186 -21.933 -14.328
  425    HG3  GLN  56           HG3      GLN  56  30.702 -23.041 -13.055
  426   HE21  GLN  56          1HE2      GLN  56  32.187 -23.550 -11.294
  427   HE22  GLN  56          2HE2      GLN  56  33.517 -22.444 -10.962
  428    H    MET  57           H        MET  57  31.535 -26.768 -13.507
  429    HA   MET  57           HA       MET  57  28.992 -27.175 -12.220
  430    HB2  MET  57           HB2      MET  57  30.869 -28.838 -12.373
  431    HB3  MET  57           HB3      MET  57  31.763 -27.874 -11.175
  432    HG2  MET  57           HG2      MET  57  29.919 -28.248  -9.529
  433    HG3  MET  57           HG3      MET  57  29.013 -29.118 -10.767
  434    HE1  MET  57           HE1      MET  57  31.879 -29.161  -8.173
  435    HE2  MET  57           HE2      MET  57  32.779 -30.643  -8.552
  436    HE3  MET  57           HE3      MET  57  32.868 -29.262  -9.652
  437    H    LEU  58           H        LEU  58  28.173 -26.449 -10.301
  438    HA   LEU  58           HA       LEU  58  29.609 -24.577  -8.569
  439    HB2  LEU  58           HB2      LEU  58  28.612 -23.356 -10.666
  440    HB3  LEU  58           HB3      LEU  58  27.055 -23.633  -9.927
  441    HG   LEU  58           HG       LEU  58  27.872 -21.397  -9.554
  442   HD11  LEU  58          1HD1      LEU  58  26.503 -22.398  -7.733
  443   HD12  LEU  58          2HD1      LEU  58  27.635 -21.165  -7.168
  444   HD13  LEU  58          3HD1      LEU  58  28.006 -22.860  -6.884
  445   HD21  LEU  58          3HD2      LEU  58  30.243 -22.561  -8.029
  446   HD22  LEU  58          1HD2      LEU  58  29.845 -20.861  -8.255
  447   HD23  LEU  58          2HD2      LEU  58  30.312 -21.837  -9.655
  448    H    THR  59           H        THR  59  29.163 -25.398  -6.623
  449    HA   THR  59           HA       THR  59  26.561 -26.734  -6.062
  450    HB   THR  59           HB       THR  59  29.185 -26.855  -4.511
  451    HG1  THR  59           HG1      THR  59  29.429 -28.830  -5.625
  452   HG21  THR  59          1HG2      THR  59  28.220 -29.014  -3.666
  453   HG22  THR  59          2HG2      THR  59  26.687 -28.615  -4.478
  454   HG23  THR  59          3HG2      THR  59  27.297 -27.612  -3.136
  455    H    GLU  60           H        GLU  60  25.389 -26.265  -4.176
  456    HA   GLU  60           HA       GLU  60  25.084 -23.566  -3.500
  457    HB2  GLU  60           HB2      GLU  60  23.552 -24.295  -1.791
  458    HB3  GLU  60           HB3      GLU  60  23.324 -25.229  -3.269
  459    HG2  GLU  60           HG2      GLU  60  24.614 -27.127  -2.259
  460    HG3  GLU  60           HG3      GLU  60  24.787 -26.188  -0.760
  461    H    SER  61           H        SER  61  27.195 -25.937  -1.903
  462    HA   SER  61           HA       SER  61  27.754 -24.488   0.475
  463    HB2  SER  61           HB2      SER  61  29.580 -26.398  -1.028
  464    HB3  SER  61           HB3      SER  61  29.631 -26.008   0.693
  465    HG   SER  61           HG       SER  61  28.546 -28.016   0.268
  466    H    MET  62           H        MET  62  28.749 -23.805  -2.775
  467    HA   MET  62           HA       MET  62  31.231 -22.375  -1.999
  468    HB2  MET  62           HB2      MET  62  29.931 -22.724  -4.727
  469    HB3  MET  62           HB3      MET  62  31.550 -22.102  -4.381
  470    HG2  MET  62           HG2      MET  62  30.631 -24.942  -3.805
  471    HG3  MET  62           HG3      MET  62  31.583 -24.420  -5.192
  472    HE1  MET  62           HE1      MET  62  32.400 -26.820  -3.296
  473    HE2  MET  62           HE2      MET  62  33.366 -26.308  -4.691
  474    HE3  MET  62           HE3      MET  62  34.144 -26.524  -3.114
  475    H    LEU  63           H        LEU  63  27.984 -21.566  -2.048
  476    HA   LEU  63           HA       LEU  63  28.205 -18.849  -3.151
  477    HB2  LEU  63           HB2      LEU  63  25.962 -20.284  -1.658
  478    HB3  LEU  63           HB3      LEU  63  25.822 -18.718  -2.451
  479    HG   LEU  63           HG       LEU  63  26.344 -21.385  -3.837
  480   HD11  LEU  63          1HD1      LEU  63  24.070 -21.058  -4.745
  481   HD12  LEU  63          2HD1      LEU  63  23.892 -19.569  -3.800
  482   HD13  LEU  63          3HD1      LEU  63  24.050 -21.137  -2.977
  483   HD21  LEU  63          3HD2      LEU  63  25.968 -18.603  -5.042
  484   HD22  LEU  63          1HD2      LEU  63  25.989 -20.132  -5.942
  485   HD23  LEU  63          2HD2      LEU  63  27.445 -19.592  -5.112
  486    H    GLU  64           H        GLU  64  28.052 -16.926  -2.028
  487    HA   GLU  64           HA       GLU  64  27.729 -16.867   0.887
  488    HB2  GLU  64           HB2      GLU  64  30.141 -17.280   0.648
  489    HB3  GLU  64           HB3      GLU  64  30.297 -15.884  -0.418
  490    HG2  GLU  64           HG2      GLU  64  29.651 -14.370   1.391
  491    HG3  GLU  64           HG3      GLU  64  29.298 -15.737   2.462
  492    HA   PRO  65           HA       PRO  65  25.576 -13.185  -0.739
  493    HB2  PRO  65           HB2      PRO  65  25.266 -12.736   2.235
  494    HB3  PRO  65           HB3      PRO  65  24.047 -12.531   0.938
  495    HG2  PRO  65           HG2      PRO  65  23.998 -14.745   2.489
  496    HG3  PRO  65           HG3      PRO  65  23.773 -14.905   0.723
  497    HD2  PRO  65           HD2      PRO  65  26.303 -15.359   2.351
  498    HD3  PRO  65           HD3      PRO  65  25.605 -16.361   1.036
  499    H    VAL  66           H        VAL  66  26.280 -11.094  -1.110
  500    HA   VAL  66           HA       VAL  66  28.884 -10.338   0.092
  501    HB   VAL  66           HB       VAL  66  27.456  -9.043  -2.250
  502   HG11  VAL  66          1HG1      VAL  66  29.737  -8.126  -2.714
  503   HG12  VAL  66          2HG1      VAL  66  29.109  -7.542  -1.172
  504   HG13  VAL  66          3HG1      VAL  66  30.321  -8.846  -1.210
  505   HG21  VAL  66          3HG2      VAL  66  29.103 -10.256  -3.637
  506   HG22  VAL  66          1HG2      VAL  66  29.675 -11.094  -2.171
  507   HG23  VAL  66          2HG2      VAL  66  28.027 -11.380  -2.791
  508    HA   PRO  67           HA       PRO  67  26.459  -7.312   2.530
  509    HB2  PRO  67           HB2      PRO  67  28.321  -6.666   4.416
  510    HB3  PRO  67           HB3      PRO  67  27.448  -8.231   4.422
  511    HG2  PRO  67           HG2      PRO  67  30.233  -7.672   3.360
  512    HG3  PRO  67           HG3      PRO  67  29.680  -9.009   4.421
  513    HD2  PRO  67           HD2      PRO  67  29.952  -9.305   1.702
  514    HD3  PRO  67           HD3      PRO  67  28.695 -10.155   2.641
  515    H    GLU  68           H        GLU  68  29.828  -6.696   1.399
  516    HA   GLU  68           HA       GLU  68  29.633  -3.874   1.645
  517    HB2  GLU  68           HB2      GLU  68  31.673  -3.767   0.336
  518    HB3  GLU  68           HB3      GLU  68  31.763  -5.028   1.569
  519    HG2  GLU  68           HG2      GLU  68  31.368  -6.768  -0.139
  520    HG3  GLU  68           HG3      GLU  68  31.210  -5.523  -1.389
  521    H    LEU  69           H        LEU  69  28.381  -5.918  -0.874
  522    HA   LEU  69           HA       LEU  69  27.727  -3.565  -2.587
  523    HB2  LEU  69           HB2      LEU  69  27.278  -6.564  -2.933
  524    HB3  LEU  69           HB3      LEU  69  26.586  -5.351  -3.999
  525    HG   LEU  69           HG       LEU  69  29.580  -5.753  -3.570
  526   HD11  LEU  69          1HD1      LEU  69  27.780  -6.485  -5.922
  527   HD12  LEU  69          2HD1      LEU  69  28.463  -7.642  -4.747
  528   HD13  LEU  69          3HD1      LEU  69  29.540  -6.726  -5.828
  529   HD21  LEU  69          3HD2      LEU  69  28.050  -3.961  -5.509
  530   HD22  LEU  69          1HD2      LEU  69  29.789  -4.302  -5.588
  531   HD23  LEU  69          2HD2      LEU  69  29.138  -3.437  -4.200
  532    H    LYS  70           H        LYS  70  26.035  -6.058  -0.565
  533    HA   LYS  70           HA       LYS  70  23.416  -5.140  -1.099
  534    HB2  LYS  70           HB2      LYS  70  24.035  -7.273  -0.004
  535    HB3  LYS  70           HB3      LYS  70  24.513  -6.382   1.448
  536    HG2  LYS  70           HG2      LYS  70  22.134  -5.565   1.669
  537    HG3  LYS  70           HG3      LYS  70  21.716  -6.469   0.213
  538    HD2  LYS  70           HD2      LYS  70  21.020  -7.731   2.131
  539    HD3  LYS  70           HD3      LYS  70  22.367  -8.588   1.357
  540    HE2  LYS  70           HE2      LYS  70  23.933  -7.674   3.059
  541    HE3  LYS  70           HE3      LYS  70  22.622  -6.734   3.775
  542    HZ1  LYS  70           HZ1      LYS  70  21.520  -8.821   4.362
  543    HZ2  LYS  70           HZ2      LYS  70  23.020  -8.781   4.999
  544    HZ3  LYS  70           HZ3      LYS  70  22.726  -9.699   3.675
  545    H    GLU  71           H        GLU  71  25.657  -4.011   1.459
  546    HA   GLU  71           HA       GLU  71  23.830  -2.116   2.624
  547    HB2  GLU  71           HB2      GLU  71  26.869  -2.318   2.733
  548    HB3  GLU  71           HB3      GLU  71  25.908  -1.145   3.641
  549    HG2  GLU  71           HG2      GLU  71  24.635  -3.011   4.709
  550    HG3  GLU  71           HG3      GLU  71  25.702  -4.164   3.914
  551    H    GLN  72           H        GLN  72  26.116  -1.833  -0.084
  552    HA   GLN  72           HA       GLN  72  25.738   1.071  -0.374
  553    HB2  GLN  72           HB2      GLN  72  26.944  -1.048  -2.187
  554    HB3  GLN  72           HB3      GLN  72  26.790   0.654  -2.633
  555    HG2  GLN  72           HG2      GLN  72  28.090   1.302  -0.587
  556    HG3  GLN  72           HG3      GLN  72  28.371  -0.410  -0.262
  557   HE21  GLN  72          1HE2      GLN  72  29.793  -1.591  -1.722
  558   HE22  GLN  72          2HE2      GLN  72  30.866  -0.729  -2.836
  559    H    ILE  73           H        ILE  73  24.371  -1.840  -1.927
  560    HA   ILE  73           HA       ILE  73  22.693  -0.530  -3.807
  561    HB   ILE  73           HB       ILE  73  22.657  -3.241  -2.452
  562   HG12  ILE  73          2HG1      ILE  73  23.080  -2.428  -5.357
  563   HG13  ILE  73          3HG1      ILE  73  24.395  -2.598  -4.211
  564   HG21  ILE  73          1HG2      ILE  73  20.894  -3.915  -4.126
  565   HG22  ILE  73          2HG2      ILE  73  20.307  -2.855  -2.860
  566   HG23  ILE  73          3HG2      ILE  73  20.639  -2.201  -4.486
  567   HD11  ILE  73          3HD1      ILE  73  24.322  -4.591  -5.506
  568   HD12  ILE  73          1HD1      ILE  73  23.765  -5.005  -3.877
  569   HD13  ILE  73          2HD1      ILE  73  22.598  -4.846  -5.218
  570    H    GLN  74           H        GLN  74  21.822  -1.648  -0.484
  571    HA   GLN  74           HA       GLN  74  19.155  -0.665  -0.687
  572    HB2  GLN  74           HB2      GLN  74  18.976  -1.052   1.700
  573    HB3  GLN  74           HB3      GLN  74  19.840  -2.355   0.911
  574    HG2  GLN  74           HG2      GLN  74  21.102  -2.064   2.836
  575    HG3  GLN  74           HG3      GLN  74  22.011  -1.145   1.660
  576   HE21  GLN  74          1HE2      GLN  74  22.925   0.571   2.784
  577   HE22  GLN  74          2HE2      GLN  74  22.034   1.566   3.932
  578    H    ALA  75           H        ALA  75  22.098   1.055   0.251
  579    HA   ALA  75           HA       ALA  75  20.766   3.473   1.147
  580    HB1  ALA  75           HB1      ALA  75  23.070   2.928   1.803
  581    HB2  ALA  75           HB2      ALA  75  23.597   2.990   0.099
  582    HB3  ALA  75           HB3      ALA  75  23.029   4.459   0.912
  583    H    TRP  76           H        TRP  76  22.201   2.467  -2.013
  584    HA   TRP  76           HA       TRP  76  21.527   4.875  -3.411
  585    HB2  TRP  76           HB2      TRP  76  23.189   3.180  -4.135
  586    HB3  TRP  76           HB3      TRP  76  21.881   2.041  -4.483
  587    HD1  TRP  76           HD1      TRP  76  23.456   5.304  -5.719
  588    HE1  TRP  76           HE1      TRP  76  22.736   5.782  -8.134
  589    HE3  TRP  76           HE3      TRP  76  19.987   1.569  -6.278
  590    HZ2  TRP  76           HZ2      TRP  76  20.813   4.749 -10.023
  591    HZ3  TRP  76           HZ3      TRP  76  18.727   1.363  -8.406
  592    HH2  TRP  76           HH2      TRP  76  19.109   2.953 -10.264
  593    H    MET  77           H        MET  77  19.694   1.784  -3.060
  594    HA   MET  77           HA       MET  77  17.417   2.525  -4.613
  595    HB2  MET  77           HB2      MET  77  17.682   0.690  -2.197
  596    HB3  MET  77           HB3      MET  77  16.203   0.872  -3.138
  597    HG2  MET  77           HG2      MET  77  17.310   0.077  -5.157
  598    HG3  MET  77           HG3      MET  77  18.853   0.012  -4.331
  599    HE1  MET  77           HE1      MET  77  15.561  -1.784  -5.147
  600    HE2  MET  77           HE2      MET  77  15.373  -2.978  -3.851
  601    HE3  MET  77           HE3      MET  77  15.132  -1.248  -3.505
  602    H    ARG  78           H        ARG  78  18.097   3.130  -1.118
  603    HA   ARG  78           HA       ARG  78  15.627   4.400  -0.526
  604    HB2  ARG  78           HB2      ARG  78  17.279   3.638   1.164
  605    HB3  ARG  78           HB3      ARG  78  18.365   4.958   0.699
  606    HG2  ARG  78           HG2      ARG  78  16.617   6.616   1.368
  607    HG3  ARG  78           HG3      ARG  78  15.550   5.277   1.842
  608    HD2  ARG  78           HD2      ARG  78  17.199   4.545   3.524
  609    HD3  ARG  78           HD3      ARG  78  18.296   5.850   3.028
  610    HE   ARG  78           HE       ARG  78  15.732   6.923   3.726
  611   HH11  ARG  78          1HH1      ARG  78  18.601   5.597   5.312
  612   HH12  ARG  78          2HH1      ARG  78  18.335   6.513   6.772
  613   HH21  ARG  78          1HH2      ARG  78  15.430   8.050   5.638
  614   HH22  ARG  78          2HH2      ARG  78  16.557   7.868   6.951
  615    H    GLU  79           H        GLU  79  18.711   5.907  -1.714
  616    HA   GLU  79           HA       GLU  79  17.668   8.566  -1.859
  617    HB2  GLU  79           HB2      GLU  79  19.928   7.207  -3.382
  618    HB3  GLU  79           HB3      GLU  79  19.519   8.927  -3.540
  619    HG2  GLU  79           HG2      GLU  79  19.819   9.191  -1.060
  620    HG3  GLU  79           HG3      GLU  79  20.386   7.515  -0.982
  621    H    LYS  80           H        LYS  80  17.537   5.927  -4.279
  622    HA   LYS  80           HA       LYS  80  16.245   7.537  -6.318
  623    HB2  LYS  80           HB2      LYS  80  16.434   4.535  -5.819
  624    HB3  LYS  80           HB3      LYS  80  15.668   5.216  -7.247
  625    HG2  LYS  80           HG2      LYS  80  18.589   5.644  -6.493
  626    HG3  LYS  80           HG3      LYS  80  17.995   4.420  -7.601
  627    HD2  LYS  80           HD2      LYS  80  17.727   7.435  -7.996
  628    HD3  LYS  80           HD3      LYS  80  18.939   6.394  -8.751
  629    HE2  LYS  80           HE2      LYS  80  17.128   5.072  -9.844
  630    HE3  LYS  80           HE3      LYS  80  15.919   6.163  -9.147
  631    HZ1  LYS  80           HZ1      LYS  80  18.067   6.954 -11.042
  632    HZ2  LYS  80           HZ2      LYS  80  16.978   7.989 -10.374
  633    HZ3  LYS  80           HZ3      LYS  80  16.471   6.822 -11.396
  634    H    GLN  81           H        GLN  81  14.935   5.542  -3.687
  635    HA   GLN  81           HA       GLN  81  12.188   5.753  -4.644
  636    HB2  GLN  81           HB2      GLN  81  13.131   3.776  -3.432
  637    HB3  GLN  81           HB3      GLN  81  13.328   4.776  -1.987
  638    HG2  GLN  81           HG2      GLN  81  10.867   5.102  -1.879
  639    HG3  GLN  81           HG3      GLN  81  10.666   4.167  -3.361
  640   HE21  GLN  81          1HE2      GLN  81  12.006   3.892   0.003
  641   HE22  GLN  81          2HE2      GLN  81  11.612   2.181   0.146
  642    H    SER  82           H        SER  82  14.051   7.313  -1.993
  643    HA   SER  82           HA       SER  82  11.700   8.828  -1.099
  644    HB2  SER  82           HB2      SER  82  14.560   8.810  -0.096
  645    HB3  SER  82           HB3      SER  82  13.183   9.580   0.704
  646    HG   SER  82           HG       SER  82  12.257   7.537   1.039
  647    H    SER  83           H        SER  83  12.840   9.453  -3.798
  648    HA   SER  83           HA       SER  83  14.227  12.004  -3.636
  649    HB2  SER  83           HB2      SER  83  13.956  11.959  -6.104
  650    HB3  SER  83           HB3      SER  83  14.650  10.472  -5.457
  651    HG   SER  83           HG       SER  83  12.995  10.017  -6.991
  652    H    ASP  84           H        ASP  84  10.843  11.200  -3.514
  653    HA   ASP  84           HA       ASP  84   9.803  13.664  -4.647
  654    HB2  ASP  84           HB2      ASP  84   8.512  11.572  -4.660
  655    HB3  ASP  84           HB3      ASP  84   8.513  11.535  -2.903
  656    H    HIS  85           H        HIS  85   9.263  15.534  -3.708
  657    HA   HIS  85           HA       HIS  85   9.068  15.998  -0.828
  658    HB2  HIS  85           HB2      HIS  85  11.522  15.919  -1.129
  659    HB3  HIS  85           HB3      HIS  85  11.412  17.145  -2.394
  660    HD1  HIS  85           HD1      HIS  85  11.165  19.679  -1.562
  661    HD2  HIS  85           HD2      HIS  85  11.009  16.726   1.437
  662    HE1  HIS  85           HE1      HIS  85  11.318  20.916   0.670
  Start of MODEL    5
    1    H2   PRO   1           H2       PRO   1   1.619   5.575   1.713
    2    H3   PRO   1           H3       PRO   1   0.811   5.247   0.320
    3    HA   PRO   1           HA       PRO   1   2.761   5.128  -0.938
    4    HB2  PRO   1           HB2      PRO   1   4.498   6.102   1.318
    5    HB3  PRO   1           HB3      PRO   1   4.629   6.393  -0.441
    6    HG2  PRO   1           HG2      PRO   1   3.263   7.990   1.590
    7    HG3  PRO   1           HG3      PRO   1   3.399   8.351  -0.155
    8    HD2  PRO   1           HD2      PRO   1   0.993   7.735   1.021
    9    HD3  PRO   1           HD3      PRO   1   1.390   7.296  -0.668
   10    H    GLY   2           H        GLY   2   4.661   3.617  -0.822
   11    HA2  GLY   2           HA2      GLY   2   5.779   1.757   0.015
   12    HA3  GLY   2           HA3      GLY   2   4.639   1.631   1.382
   13    H    SER   3           H        SER   3   2.850   2.051  -1.403
   14    HA   SER   3           HA       SER   3   1.765  -0.572  -1.258
   15    HB2  SER   3           HB2      SER   3   1.261   1.532  -3.393
   16    HB3  SER   3           HB3      SER   3   0.179   0.214  -2.897
   17    HG   SER   3           HG       SER   3  -0.454   2.186  -1.933
   18    H    ALA   4           H        ALA   4   4.327   0.620  -3.205
   19    HA   ALA   4           HA       ALA   4   4.720  -1.915  -4.566
   20    HB1  ALA   4           HB1      ALA   4   4.070   0.583  -6.210
   21    HB2  ALA   4           HB2      ALA   4   4.644  -0.968  -6.861
   22    HB3  ALA   4           HB3      ALA   4   3.052  -0.861  -6.077
   23    H    GLU   5           H        GLU   5   6.783  -1.976  -5.701
   24    HA   GLU   5           HA       GLU   5   8.843  -0.260  -4.448
   25    HB2  GLU   5           HB2      GLU   5   9.047  -2.706  -6.253
   26    HB3  GLU   5           HB3      GLU   5  10.414  -1.851  -5.535
   27    HG2  GLU   5           HG2      GLU   5   9.579  -2.364  -3.266
   28    HG3  GLU   5           HG3      GLU   5   8.198  -3.236  -3.957
   29    H    ILE   6           H        ILE   6  10.517   0.740  -5.687
   30    HA   ILE   6           HA       ILE   6   9.591   2.132  -8.098
   31    HB   ILE   6           HB       ILE   6  12.131   2.248  -6.445
   32   HG12  ILE   6          2HG1      ILE   6  11.466   4.649  -6.185
   33   HG13  ILE   6          3HG1      ILE   6   9.973   4.321  -7.055
   34   HG21  ILE   6          1HG2      ILE   6  12.885   2.594  -8.738
   35   HG22  ILE   6          2HG2      ILE   6  11.578   3.771  -9.025
   36   HG23  ILE   6          3HG2      ILE   6  12.892   4.129  -7.886
   37   HD11  ILE   6          3HD1      ILE   6   9.170   2.927  -5.220
   38   HD12  ILE   6          1HD1      ILE   6  10.767   2.994  -4.430
   39   HD13  ILE   6          2HD1      ILE   6   9.768   4.453  -4.565
   40    H    ASP   7           H        ASP   7  10.281   1.843 -10.199
   41    HA   ASP   7           HA       ASP   7  11.536  -0.718 -10.901
   42    HB2  ASP   7           HB2      ASP   7   9.548   0.124 -12.088
   43    HB3  ASP   7           HB3      ASP   7  10.439   1.553 -12.610
   44    H    TYR   8           H        TYR   8  13.664  -0.684 -10.428
   45    HA   TYR   8           HA       TYR   8  15.295   1.663 -10.497
   46    HB2  TYR   8           HB2      TYR   8  16.021  -1.237  -9.980
   47    HB3  TYR   8           HB3      TYR   8  17.033   0.154  -9.622
   48    HD1  TYR   8           HD1      TYR   8  15.801   2.076  -8.148
   49    HD2  TYR   8           HD2      TYR   8  14.846  -2.131  -8.167
   50    HE1  TYR   8           HE1      TYR   8  14.777   2.302  -5.900
   51    HE2  TYR   8           HE2      TYR   8  13.795  -1.893  -5.918
   52    HH   TYR   8           HH       TYR   8  13.632   1.267  -4.208
   53    H    SER   9           H        SER   9  14.509   1.332 -13.138
   54    HA   SER   9           HA       SER   9  16.385   0.152 -14.918
   55    HB2  SER   9           HB2      SER   9  14.809   2.730 -15.268
   56    HB3  SER   9           HB3      SER   9  15.534   1.752 -16.565
   57    HG   SER   9           HG       SER   9  13.276   1.310 -16.234
   58    H    ASP  10           H        ASP  10  16.731   3.057 -12.996
   59    HA   ASP  10           HA       ASP  10  18.940   4.217 -14.495
   60    HB2  ASP  10           HB2      ASP  10  17.158   5.470 -13.215
   61    HB3  ASP  10           HB3      ASP  10  17.848   4.833 -11.719
   62    H    ALA  11           H        ALA  11  18.902   1.528 -12.477
   63    HA   ALA  11           HA       ALA  11  21.064   2.005 -10.715
   64    HB1  ALA  11           HB1      ALA  11  19.456   0.178 -10.426
   65    HB2  ALA  11           HB2      ALA  11  20.050  -0.622 -11.895
   66    HB3  ALA  11           HB3      ALA  11  21.108  -0.473 -10.465
   67    HA   PRO  12           HA       PRO  12  24.650   1.612 -13.409
   68    HB2  PRO  12           HB2      PRO  12  26.631   1.165 -11.601
   69    HB3  PRO  12           HB3      PRO  12  25.778   2.733 -11.705
   70    HG2  PRO  12           HG2      PRO  12  25.196   0.433  -9.805
   71    HG3  PRO  12           HG3      PRO  12  25.437   2.164  -9.402
   72    HD2  PRO  12           HD2      PRO  12  22.950   1.089  -9.732
   73    HD3  PRO  12           HD3      PRO  12  23.315   2.752 -10.263
   74    H    ASP  13           H        ASP  13  26.060  -0.043 -14.236
   75    HA   ASP  13           HA       ASP  13  24.843  -2.572 -14.417
   76    HB2  ASP  13           HB2      ASP  13  27.649  -1.662 -15.173
   77    HB3  ASP  13           HB3      ASP  13  26.936  -3.195 -15.662
   78    H    GLU  14           H        GLU  14  27.287  -1.541 -12.141
   79    HA   GLU  14           HA       GLU  14  28.207  -4.170 -11.367
   80    HB2  GLU  14           HB2      GLU  14  29.310  -3.047  -9.547
   81    HB3  GLU  14           HB3      GLU  14  29.556  -2.177 -11.061
   82    HG2  GLU  14           HG2      GLU  14  27.742  -0.555 -10.363
   83    HG3  GLU  14           HG3      GLU  14  27.667  -1.385  -8.814
   84    H    PHE  15           H        PHE  15  25.305  -2.423 -10.615
   85    HA   PHE  15           HA       PHE  15  24.670  -4.166  -8.278
   86    HB2  PHE  15           HB2      PHE  15  23.236  -1.771  -9.484
   87    HB3  PHE  15           HB3      PHE  15  22.681  -2.701  -8.102
   88    HD1  PHE  15           HD1      PHE  15  26.017  -2.706  -7.260
   89    HD2  PHE  15           HD2      PHE  15  22.715   0.043  -7.726
   90    HE1  PHE  15           HE1      PHE  15  27.090  -1.142  -5.691
   91    HE2  PHE  15           HE2      PHE  15  23.811   1.608  -6.145
   92    HZ   PHE  15           HZ       PHE  15  25.993   1.011  -5.114
   93    H    ARG  16           H        ARG  16  24.401  -4.431 -11.609
   94    HA   ARG  16           HA       ARG  16  21.671  -5.644 -11.542
   95    HB2  ARG  16           HB2      ARG  16  23.350  -4.647 -13.867
   96    HB3  ARG  16           HB3      ARG  16  21.720  -5.342 -13.989
   97    HG2  ARG  16           HG2      ARG  16  20.745  -3.484 -12.727
   98    HG3  ARG  16           HG3      ARG  16  22.337  -2.859 -12.338
   99    HD2  ARG  16           HD2      ARG  16  21.944  -1.473 -14.037
  100    HD3  ARG  16           HD3      ARG  16  22.626  -2.764 -14.994
  101    HE   ARG  16           HE       ARG  16  20.269  -3.522 -15.446
  102   HH11  ARG  16          1HH1      ARG  16  20.825  -0.082 -14.683
  103   HH12  ARG  16          2HH1      ARG  16  19.393   0.406 -15.535
  104   HH21  ARG  16          1HH2      ARG  16  18.435  -2.821 -16.440
  105   HH22  ARG  16          2HH2      ARG  16  18.075  -1.117 -16.560
  106    H    ASP  17           H        ASP  17  21.273  -7.679 -12.290
  107    HA   ASP  17           HA       ASP  17  23.591  -9.490 -12.775
  108    HB2  ASP  17           HB2      ASP  17  22.129 -10.194 -11.027
  109    HB3  ASP  17           HB3      ASP  17  20.709 -10.072 -12.063
  110    HA   PRO  18           HA       PRO  18  22.653  -9.010 -17.045
  111    HB2  PRO  18           HB2      PRO  18  24.156 -11.057 -18.179
  112    HB3  PRO  18           HB3      PRO  18  24.791  -9.507 -17.562
  113    HG2  PRO  18           HG2      PRO  18  24.756 -12.198 -16.209
  114    HG3  PRO  18           HG3      PRO  18  26.044 -10.967 -16.201
  115    HD2  PRO  18           HD2      PRO  18  24.284 -11.310 -14.135
  116    HD3  PRO  18           HD3      PRO  18  24.980  -9.712 -14.554
  117    H    LEU  19           H        LEU  19  21.533 -11.949 -15.516
  118    HA   LEU  19           HA       LEU  19  19.917 -12.739 -17.877
  119    HB2  LEU  19           HB2      LEU  19  20.912 -14.412 -16.317
  120    HB3  LEU  19           HB3      LEU  19  19.988 -13.761 -14.990
  121    HG   LEU  19           HG       LEU  19  19.196 -15.886 -15.759
  122   HD11  LEU  19          1HD1      LEU  19  17.063 -13.925 -16.638
  123   HD12  LEU  19          2HD1      LEU  19  17.505 -14.203 -14.938
  124   HD13  LEU  19          3HD1      LEU  19  16.878 -15.535 -15.930
  125   HD21  LEU  19          3HD2      LEU  19  19.994 -15.715 -18.088
  126   HD22  LEU  19          1HD2      LEU  19  18.639 -14.622 -18.469
  127   HD23  LEU  19          2HD2      LEU  19  18.321 -16.302 -17.990
  128    H    MET  20           H        MET  20  19.578 -11.308 -14.637
  129    HA   MET  20           HA       MET  20  16.767 -10.878 -14.691
  130    HB2  MET  20           HB2      MET  20  18.551 -10.882 -12.748
  131    HB3  MET  20           HB3      MET  20  18.702  -9.156 -13.106
  132    HG2  MET  20           HG2      MET  20  16.211  -8.967 -12.796
  133    HG3  MET  20           HG3      MET  20  16.172 -10.684 -12.368
  134    HE1  MET  20           HE1      MET  20  15.481  -8.705  -9.010
  135    HE2  MET  20           HE2      MET  20  15.059  -8.131 -10.634
  136    HE3  MET  20           HE3      MET  20  14.805  -9.840 -10.210
  137    H    ASP  21           H        ASP  21  19.414  -8.835 -15.770
  138    HA   ASP  21           HA       ASP  21  19.583  -7.074 -17.145
  139    HB2  ASP  21           HB2      ASP  21  17.613  -8.163 -18.356
  140    HB3  ASP  21           HB3      ASP  21  16.566  -7.011 -17.521
  141    H    THR  22           H        THR  22  18.402  -6.962 -14.189
  142    HA   THR  22           HA       THR  22  18.509  -4.043 -13.848
  143    HB   THR  22           HB       THR  22  16.163  -4.577 -14.511
  144    HG1  THR  22           HG1      THR  22  15.352  -3.245 -12.925
  145   HG21  THR  22          1HG2      THR  22  15.899  -6.750 -13.332
  146   HG22  THR  22          2HG2      THR  22  14.652  -5.579 -12.880
  147   HG23  THR  22          3HG2      THR  22  16.003  -5.913 -11.769
  148    H    LEU  23           H        LEU  23  17.778  -3.714 -11.386
  149    HA   LEU  23           HA       LEU  23  20.095  -4.407  -9.972
  150    HB2  LEU  23           HB2      LEU  23  18.124  -2.552  -9.702
  151    HB3  LEU  23           HB3      LEU  23  17.654  -3.640  -8.396
  152    HG   LEU  23           HG       LEU  23  20.353  -2.277  -8.750
  153   HD11  LEU  23          1HD1      LEU  23  18.552  -0.740  -8.154
  154   HD12  LEU  23          2HD1      LEU  23  19.660  -0.941  -6.784
  155   HD13  LEU  23          3HD1      LEU  23  18.083  -1.761  -6.793
  156   HD21  LEU  23          3HD2      LEU  23  20.608  -4.429  -7.507
  157   HD22  LEU  23          1HD2      LEU  23  19.325  -3.928  -6.392
  158   HD23  LEU  23          2HD2      LEU  23  20.865  -3.040  -6.478
  159    H    MET  24           H        MET  24  20.723  -6.278  -9.064
  160    HA   MET  24           HA       MET  24  18.969  -8.531  -8.662
  161    HB2  MET  24           HB2      MET  24  20.916  -9.608  -7.620
  162    HB3  MET  24           HB3      MET  24  21.266  -8.878  -9.200
  163    HG2  MET  24           HG2      MET  24  22.255  -6.911  -7.912
  164    HG3  MET  24           HG3      MET  24  22.099  -7.862  -6.446
  165    HE1  MET  24           HE1      MET  24  24.664  -6.730  -6.847
  166    HE2  MET  24           HE2      MET  24  25.912  -7.583  -7.778
  167    HE3  MET  24           HE3      MET  24  24.676  -6.619  -8.623
  168    H    THR  25           H        THR  25  20.106  -6.085  -6.446
  169    HA   THR  25           HA       THR  25  19.436  -5.384  -4.395
  170    HB   THR  25           HB       THR  25  17.278  -7.519  -4.309
  171    HG1  THR  25           HG1      THR  25  17.117  -4.903  -5.423
  172   HG21  THR  25          1HG2      THR  25  17.580  -6.257  -2.233
  173   HG22  THR  25          2HG2      THR  25  16.092  -5.739  -3.051
  174   HG23  THR  25          3HG2      THR  25  17.545  -4.727  -3.144
  175    H    ASP  26           H        ASP  26  19.591  -8.886  -4.671
  176    HA   ASP  26           HA       ASP  26  21.103  -9.083  -2.083
  177    HB2  ASP  26           HB2      ASP  26  19.153 -11.011  -3.404
  178    HB3  ASP  26           HB3      ASP  26  20.253 -11.453  -2.085
  179    HA   PRO  27           HA       PRO  27  24.071 -10.353  -5.405
  180    HB2  PRO  27           HB2      PRO  27  26.318  -9.234  -4.264
  181    HB3  PRO  27           HB3      PRO  27  25.198  -8.339  -5.324
  182    HG2  PRO  27           HG2      PRO  27  25.239  -8.365  -2.301
  183    HG3  PRO  27           HG3      PRO  27  25.105  -6.955  -3.411
  184    HD2  PRO  27           HD2      PRO  27  22.930  -8.035  -2.237
  185    HD3  PRO  27           HD3      PRO  27  22.867  -7.460  -3.931
  186    H    VAL  28           H        VAL  28  24.991 -12.312  -5.306
  187    HA   VAL  28           HA       VAL  28  26.136 -13.368  -2.749
  188    HB   VAL  28           HB       VAL  28  24.423 -14.853  -4.784
  189   HG11  VAL  28          1HG1      VAL  28  26.250 -16.340  -4.040
  190   HG12  VAL  28          2HG1      VAL  28  25.854 -15.983  -2.341
  191   HG13  VAL  28          3HG1      VAL  28  24.696 -16.841  -3.371
  192   HG21  VAL  28          3HG2      VAL  28  23.120 -13.549  -3.128
  193   HG22  VAL  28          1HG2      VAL  28  22.945 -15.294  -2.855
  194   HG23  VAL  28          2HG2      VAL  28  23.999 -14.336  -1.804
  195    H    ARG  29           H        ARG  29  28.132 -14.151  -2.899
  196    HA   ARG  29           HA       ARG  29  29.481 -13.952  -5.496
  197    HB2  ARG  29           HB2      ARG  29  30.249 -12.990  -3.178
  198    HB3  ARG  29           HB3      ARG  29  30.875 -14.604  -2.894
  199    HG2  ARG  29           HG2      ARG  29  32.290 -14.421  -4.929
  200    HG3  ARG  29           HG3      ARG  29  31.503 -12.890  -5.358
  201    HD2  ARG  29           HD2      ARG  29  32.367 -11.903  -3.202
  202    HD3  ARG  29           HD3      ARG  29  33.271 -13.416  -2.947
  203    HE   ARG  29           HE       ARG  29  33.743 -12.252  -5.564
  204   HH11  ARG  29          1HH1      ARG  29  34.827 -11.978  -2.203
  205   HH12  ARG  29          2HH1      ARG  29  36.364 -11.289  -2.664
  206   HH21  ARG  29          1HH2      ARG  29  35.694 -11.381  -6.088
  207   HH22  ARG  29          2HH2      ARG  29  36.848 -10.961  -4.847
  208    H    LEU  30           H        LEU  30  30.489 -15.528  -6.541
  209    HA   LEU  30           HA       LEU  30  29.965 -18.372  -5.909
  210    HB2  LEU  30           HB2      LEU  30  31.212 -16.975  -8.326
  211    HB3  LEU  30           HB3      LEU  30  30.767 -18.666  -8.261
  212    HG   LEU  30           HG       LEU  30  28.925 -16.250  -8.360
  213   HD11  LEU  30          1HD1      LEU  30  29.798 -17.116 -10.483
  214   HD12  LEU  30          2HD1      LEU  30  28.061 -17.463 -10.346
  215   HD13  LEU  30          3HD1      LEU  30  29.238 -18.753 -10.076
  216   HD21  LEU  30          3HD2      LEU  30  27.003 -17.802  -8.217
  217   HD22  LEU  30          1HD2      LEU  30  27.881 -17.683  -6.697
  218   HD23  LEU  30          2HD2      LEU  30  28.097 -19.114  -7.731
  219    HA   PRO  31           HA       PRO  31  34.161 -19.291  -4.627
  220    HB2  PRO  31           HB2      PRO  31  34.791 -21.625  -5.961
  221    HB3  PRO  31           HB3      PRO  31  33.710 -21.543  -4.547
  222    HG2  PRO  31           HG2      PRO  31  32.936 -21.566  -7.487
  223    HG3  PRO  31           HG3      PRO  31  32.255 -22.553  -6.160
  224    HD2  PRO  31           HD2      PRO  31  31.011 -20.328  -7.001
  225    HD3  PRO  31           HD3      PRO  31  31.096 -20.667  -5.254
  226    H    SER  32           H        SER  32  33.489 -18.968  -8.105
  227    HA   SER  32           HA       SER  32  36.233 -18.648  -8.976
  228    HB2  SER  32           HB2      SER  32  35.097 -17.761 -11.017
  229    HB3  SER  32           HB3      SER  32  34.509 -19.358 -10.503
  230    HG   SER  32           HG       SER  32  32.782 -17.931 -11.031
  231    H    GLY  33           H        GLY  33  34.284 -16.655  -7.035
  232    HA2  GLY  33           HA2      GLY  33  34.852 -14.580  -6.124
  233    HA3  GLY  33           HA3      GLY  33  35.981 -14.262  -7.467
  234    H    THR  34           H        THR  34  33.401 -15.220  -9.128
  235    HA   THR  34           HA       THR  34  32.467 -12.624  -9.909
  236    HB   THR  34           HB       THR  34  31.389 -15.427 -10.431
  237    HG1  THR  34           HG1      THR  34  32.612 -15.208 -12.318
  238   HG21  THR  34          1HG2      THR  34  30.801 -12.812 -11.890
  239   HG22  THR  34          2HG2      THR  34  29.627 -13.844 -11.025
  240   HG23  THR  34          3HG2      THR  34  30.391 -14.433 -12.503
  241    H    VAL  35           H        VAL  35  30.519 -11.596  -9.531
  242    HA   VAL  35           HA       VAL  35  28.886 -12.534  -7.192
  243    HB   VAL  35           HB       VAL  35  29.084  -9.729  -8.343
  244   HG11  VAL  35          1HG1      VAL  35  27.616 -10.793  -5.879
  245   HG12  VAL  35          2HG1      VAL  35  27.812  -9.089  -6.299
  246   HG13  VAL  35          3HG1      VAL  35  26.855 -10.121  -7.342
  247   HG21  VAL  35          3HG2      VAL  35  31.148 -10.327  -7.155
  248   HG22  VAL  35          1HG2      VAL  35  30.202  -9.179  -6.196
  249   HG23  VAL  35          2HG2      VAL  35  30.205 -10.900  -5.765
  250    H    MET  36           H        MET  36  26.747 -12.854  -7.398
  251    HA   MET  36           HA       MET  36  25.318 -12.431  -9.980
  252    HB2  MET  36           HB2      MET  36  26.538 -14.739  -9.663
  253    HB3  MET  36           HB3      MET  36  25.302 -15.078  -8.463
  254    HG2  MET  36           HG2      MET  36  23.547 -14.967 -10.086
  255    HG3  MET  36           HG3      MET  36  24.595 -14.210 -11.290
  256    HE1  MET  36           HE1      MET  36  27.216 -15.741 -11.514
  257    HE2  MET  36           HE2      MET  36  26.774 -17.001 -12.678
  258    HE3  MET  36           HE3      MET  36  26.152 -15.340 -12.868
  259    H    ASP  37           H        ASP  37  22.978 -12.779  -9.782
  260    HA   ASP  37           HA       ASP  37  21.792 -11.813  -7.305
  261    HB2  ASP  37           HB2      ASP  37  20.715 -11.285  -9.403
  262    HB3  ASP  37           HB3      ASP  37  20.644 -12.989  -9.856
  263    H    ARG  38           H        ARG  38  21.103 -12.859  -5.611
  264    HA   ARG  38           HA       ARG  38  21.558 -15.471  -4.840
  265    HB2  ARG  38           HB2      ARG  38  20.837 -13.546  -3.384
  266    HB3  ARG  38           HB3      ARG  38  19.218 -13.688  -4.045
  267    HG2  ARG  38           HG2      ARG  38  19.539 -16.257  -3.148
  268    HG3  ARG  38           HG3      ARG  38  20.708 -15.445  -2.108
  269    HD2  ARG  38           HD2      ARG  38  18.627 -15.606  -0.953
  270    HD3  ARG  38           HD3      ARG  38  18.862 -13.890  -1.373
  271    HE   ARG  38           HE       ARG  38  17.376 -14.841  -3.488
  272   HH11  ARG  38          1HH1      ARG  38  16.793 -14.959   0.006
  273   HH12  ARG  38          2HH1      ARG  38  15.071 -15.029  -0.215
  274   HH21  ARG  38          1HH2      ARG  38  15.216 -14.948  -3.692
  275   HH22  ARG  38          2HH2      ARG  38  14.170 -15.015  -2.295
  276    H    SER  39           H        SER  39  18.411 -14.282  -6.143
  277    HA   SER  39           HA       SER  39  17.105 -16.823  -5.849
  278    HB2  SER  39           HB2      SER  39  16.310 -14.425  -7.522
  279    HB3  SER  39           HB3      SER  39  15.252 -15.758  -7.036
  280    HG   SER  39           HG       SER  39  15.216 -13.768  -5.687
  281    H    ILE  40           H        ILE  40  18.653 -15.246  -8.662
  282    HA   ILE  40           HA       ILE  40  17.895 -17.316 -10.538
  283    HB   ILE  40           HB       ILE  40  19.932 -15.076 -10.611
  284   HG12  ILE  40          2HG1      ILE  40  17.377 -15.480 -12.229
  285   HG13  ILE  40          3HG1      ILE  40  17.342 -14.715 -10.649
  286   HG21  ILE  40          1HG2      ILE  40  20.187 -15.487 -13.039
  287   HG22  ILE  40          2HG2      ILE  40  20.798 -16.851 -12.112
  288   HG23  ILE  40          3HG2      ILE  40  19.207 -16.962 -12.902
  289   HD11  ILE  40          3HD1      ILE  40  17.366 -13.041 -12.392
  290   HD12  ILE  40          1HD1      ILE  40  18.852 -12.932 -11.423
  291   HD13  ILE  40          2HD1      ILE  40  18.886 -13.673 -13.037
  292    H    ILE  41           H        ILE  41  20.969 -16.924  -8.621
  293    HA   ILE  41           HA       ILE  41  22.043 -19.308  -9.811
  294    HB   ILE  41           HB       ILE  41  23.477 -17.648  -8.726
  295   HG12  ILE  41          2HG1      ILE  41  25.052 -19.182  -7.651
  296   HG13  ILE  41          3HG1      ILE  41  23.807 -20.403  -7.461
  297   HG21  ILE  41          1HG2      ILE  41  22.523 -18.775  -6.052
  298   HG22  ILE  41          2HG2      ILE  41  23.838 -17.611  -6.302
  299   HG23  ILE  41          3HG2      ILE  41  22.186 -17.147  -6.679
  300   HD11  ILE  41          3HD1      ILE  41  25.382 -20.845  -9.363
  301   HD12  ILE  41          1HD1      ILE  41  23.711 -20.748  -9.885
  302   HD13  ILE  41          2HD1      ILE  41  24.803 -19.363 -10.148
  303    H    LEU  42           H        LEU  42  20.097 -18.944  -6.787
  304    HA   LEU  42           HA       LEU  42  20.234 -21.785  -6.259
  305    HB2  LEU  42           HB2      LEU  42  18.801 -21.441  -4.464
  306    HB3  LEU  42           HB3      LEU  42  19.820 -20.026  -4.565
  307    HG   LEU  42           HG       LEU  42  17.798 -18.920  -5.790
  308   HD11  LEU  42          1HD1      LEU  42  16.332 -20.914  -6.048
  309   HD12  LEU  42          2HD1      LEU  42  15.590 -19.725  -4.997
  310   HD13  LEU  42          3HD1      LEU  42  16.364 -21.165  -4.295
  311   HD21  LEU  42          3HD2      LEU  42  16.907 -18.165  -3.622
  312   HD22  LEU  42          1HD2      LEU  42  18.673 -18.311  -3.530
  313   HD23  LEU  42          2HD2      LEU  42  17.647 -19.566  -2.819
  314    H    ARG  43           H        ARG  43  17.972 -19.865  -8.214
  315    HA   ARG  43           HA       ARG  43  16.135 -21.999  -8.799
  316    HB2  ARG  43           HB2      ARG  43  15.670 -19.622  -9.239
  317    HB3  ARG  43           HB3      ARG  43  16.949 -19.591 -10.475
  318    HG2  ARG  43           HG2      ARG  43  15.629 -21.382 -11.730
  319    HG3  ARG  43           HG3      ARG  43  14.329 -21.144 -10.558
  320    HD2  ARG  43           HD2      ARG  43  15.548 -19.031 -12.386
  321    HD3  ARG  43           HD3      ARG  43  14.003 -19.849 -12.661
  322    HE   ARG  43           HE       ARG  43  13.632 -18.777 -10.178
  323   HH11  ARG  43          1HH1      ARG  43  14.604 -17.290 -13.240
  324   HH12  ARG  43          2HH1      ARG  43  13.933 -15.748 -12.804
  325   HH21  ARG  43          1HH2      ARG  43  12.824 -16.760  -9.674
  326   HH22  ARG  43          2HH2      ARG  43  12.942 -15.459 -10.815
  327    H    HIS  44           H        HIS  44  19.186 -20.926 -10.473
  328    HA   HIS  44           HA       HIS  44  18.955 -23.006 -12.438
  329    HB2  HIS  44           HB2      HIS  44  20.374 -20.849 -12.512
  330    HB3  HIS  44           HB3      HIS  44  21.576 -21.740 -11.571
  331    HD1  HIS  44           HD1      HIS  44  23.050 -23.513 -12.995
  332    HD2  HIS  44           HD2      HIS  44  19.684 -21.920 -14.969
  333    HE1  HIS  44           HE1      HIS  44  23.157 -24.348 -15.395
  334    H    LEU  45           H        LEU  45  20.699 -22.946  -9.276
  335    HA   LEU  45           HA       LEU  45  21.822 -25.548  -9.422
  336    HB2  LEU  45           HB2      LEU  45  20.924 -23.796  -7.118
  337    HB3  LEU  45           HB3      LEU  45  21.658 -25.367  -6.839
  338    HG   LEU  45           HG       LEU  45  23.042 -23.144  -8.411
  339   HD11  LEU  45          1HD1      LEU  45  23.391 -24.017  -5.511
  340   HD12  LEU  45          2HD1      LEU  45  22.688 -22.478  -6.055
  341   HD13  LEU  45          3HD1      LEU  45  24.393 -22.832  -6.368
  342   HD21  LEU  45          3HD2      LEU  45  25.072 -24.535  -7.964
  343   HD22  LEU  45          1HD2      LEU  45  23.921 -25.356  -9.012
  344   HD23  LEU  45          2HD2      LEU  45  24.039 -25.804  -7.289
  345    H    LEU  46           H        LEU  46  18.529 -24.606  -8.468
  346    HA   LEU  46           HA       LEU  46  17.674 -27.202  -7.636
  347    HB2  LEU  46           HB2      LEU  46  16.552 -25.033  -7.161
  348    HB3  LEU  46           HB3      LEU  46  16.121 -24.880  -8.858
  349    HG   LEU  46           HG       LEU  46  14.688 -26.886  -8.695
  350   HD11  LEU  46          1HD1      LEU  46  15.774 -28.123  -6.870
  351   HD12  LEU  46          2HD1      LEU  46  14.096 -27.773  -6.440
  352   HD13  LEU  46          3HD1      LEU  46  15.403 -26.815  -5.728
  353   HD21  LEU  46          3HD2      LEU  46  14.102 -24.751  -6.604
  354   HD22  LEU  46          1HD2      LEU  46  12.914 -25.822  -7.385
  355   HD23  LEU  46          2HD2      LEU  46  13.774 -24.619  -8.360
  356    H    ASN  47           H        ASN  47  18.201 -25.908 -10.852
  357    HA   ASN  47           HA       ASN  47  16.780 -28.159 -12.178
  358    HB2  ASN  47           HB2      ASN  47  18.072 -25.603 -13.181
  359    HB3  ASN  47           HB3      ASN  47  17.625 -26.910 -14.263
  360   HD21  ASN  47          1HD2      ASN  47  16.267 -24.539 -11.900
  361   HD22  ASN  47          2HD2      ASN  47  14.650 -24.638 -12.566
  362    H    SER  48           H        SER  48  20.121 -26.796 -11.978
  363    HA   SER  48           HA       SER  48  21.303 -29.479 -12.486
  364    HB2  SER  48           HB2      SER  48  21.809 -27.026 -14.231
  365    HB3  SER  48           HB3      SER  48  22.782 -28.495 -14.252
  366    HG   SER  48           HG       SER  48  21.177 -28.513 -15.911
  367    HA   PRO  49           HA       PRO  49  24.216 -27.669  -9.613
  368    HB2  PRO  49           HB2      PRO  49  26.139 -29.569  -9.462
  369    HB3  PRO  49           HB3      PRO  49  24.447 -29.907  -8.986
  370    HG2  PRO  49           HG2      PRO  49  25.750 -30.513 -11.665
  371    HG3  PRO  49           HG3      PRO  49  24.834 -31.635 -10.617
  372    HD2  PRO  49           HD2      PRO  49  23.665 -30.279 -12.698
  373    HD3  PRO  49           HD3      PRO  49  22.784 -30.656 -11.185
  374    H    THR  50           H        THR  50  24.323 -26.127 -11.712
  375    HA   THR  50           HA       THR  50  27.147 -25.703 -12.459
  376    HB   THR  50           HB       THR  50  26.407 -25.398 -14.872
  377    HG1  THR  50           HG1      THR  50  24.540 -26.604 -15.447
  378   HG21  THR  50          1HG2      THR  50  26.194 -28.257 -13.857
  379   HG22  THR  50          2HG2      THR  50  27.709 -27.384 -14.198
  380   HG23  THR  50          3HG2      THR  50  26.563 -27.725 -15.503
  381    H    ASP  51           H        ASP  51  27.537 -23.748 -13.546
  382    HA   ASP  51           HA       ASP  51  26.245 -21.443 -12.452
  383    HB2  ASP  51           HB2      ASP  51  28.639 -21.607 -12.949
  384    HB3  ASP  51           HB3      ASP  51  28.301 -21.797 -14.671
  385    HA   PRO  52           HA       PRO  52  22.985 -21.091 -15.459
  386    HB2  PRO  52           HB2      PRO  52  22.338 -18.356 -15.195
  387    HB3  PRO  52           HB3      PRO  52  21.743 -19.699 -14.175
  388    HG2  PRO  52           HG2      PRO  52  24.023 -17.805 -13.700
  389    HG3  PRO  52           HG3      PRO  52  22.827 -18.415 -12.522
  390    HD2  PRO  52           HD2      PRO  52  25.357 -19.404 -12.672
  391    HD3  PRO  52           HD3      PRO  52  23.968 -20.479 -12.336
  392    H    PHE  53           H        PHE  53  25.811 -19.036 -15.883
  393    HA   PHE  53           HA       PHE  53  24.931 -18.250 -18.626
  394    HB2  PHE  53           HB2      PHE  53  27.159 -17.176 -16.847
  395    HB3  PHE  53           HB3      PHE  53  26.718 -16.568 -18.437
  396    HD1  PHE  53           HD1      PHE  53  24.600 -15.314 -18.789
  397    HD2  PHE  53           HD2      PHE  53  25.775 -16.705 -14.880
  398    HE1  PHE  53           HE1      PHE  53  22.947 -13.798 -17.741
  399    HE2  PHE  53           HE2      PHE  53  24.065 -15.191 -13.839
  400    HZ   PHE  53           HZ       PHE  53  22.677 -13.758 -15.261
  401    H    ASN  54           H        ASN  54  27.647 -19.734 -16.858
  402    HA   ASN  54           HA       ASN  54  29.083 -20.237 -19.411
  403    HB2  ASN  54           HB2      ASN  54  30.142 -18.976 -17.543
  404    HB3  ASN  54           HB3      ASN  54  29.966 -20.380 -16.490
  405   HD21  ASN  54          1HD2      ASN  54  31.512 -19.297 -19.577
  406   HD22  ASN  54          2HD2      ASN  54  32.849 -20.429 -19.440
  407    H    ARG  55           H        ARG  55  27.402 -21.999 -16.887
  408    HA   ARG  55           HA       ARG  55  26.836 -24.097 -16.579
  409    HB2  ARG  55           HB2      ARG  55  27.681 -24.629 -19.448
  410    HB3  ARG  55           HB3      ARG  55  26.598 -25.621 -18.485
  411    HG2  ARG  55           HG2      ARG  55  26.005 -22.723 -19.244
  412    HG3  ARG  55           HG3      ARG  55  25.445 -24.131 -20.132
  413    HD2  ARG  55           HD2      ARG  55  24.014 -24.854 -18.388
  414    HD3  ARG  55           HD3      ARG  55  24.826 -23.862 -17.184
  415    HE   ARG  55           HE       ARG  55  23.699 -21.971 -17.832
  416   HH11  ARG  55          1HH2      ARG  55  22.789 -24.539 -20.102
  417   HH12  ARG  55          2HH2      ARG  55  21.481 -23.598 -20.750
  418   HH21  ARG  55          1HH1      ARG  55  22.072 -20.836 -18.722
  419   HH22  ARG  55          2HH1      ARG  55  21.062 -21.522 -19.976
  420    H    GLN  56           H        GLN  56  29.802 -23.357 -16.236
  421    HA   GLN  56           HA       GLN  56  31.056 -25.988 -15.892
  422    HB2  GLN  56           HB2      GLN  56  32.735 -24.828 -14.619
  423    HB3  GLN  56           HB3      GLN  56  32.435 -23.958 -16.115
  424    HG2  GLN  56           HG2      GLN  56  31.078 -22.271 -14.860
  425    HG3  GLN  56           HG3      GLN  56  31.310 -23.184 -13.373
  426   HE21  GLN  56          1HE2      GLN  56  33.213 -21.525 -15.977
  427   HE22  GLN  56          2HE2      GLN  56  34.501 -21.031 -14.876
  428    H    MET  57           H        MET  57  31.446 -26.940 -13.751
  429    HA   MET  57           HA       MET  57  29.045 -27.306 -12.310
  430    HB2  MET  57           HB2      MET  57  31.899 -28.064 -11.576
  431    HB3  MET  57           HB3      MET  57  30.455 -28.602 -10.721
  432    HG2  MET  57           HG2      MET  57  30.956 -30.370 -12.127
  433    HG3  MET  57           HG3      MET  57  29.594 -29.566 -12.892
  434    HE1  MET  57           HE1      MET  57  31.294 -31.795 -14.289
  435    HE2  MET  57           HE2      MET  57  29.947 -30.932 -15.067
  436    HE3  MET  57           HE3      MET  57  31.505 -31.095 -15.907
  437    H    LEU  58           H        LEU  58  28.292 -26.719 -10.349
  438    HA   LEU  58           HA       LEU  58  29.620 -24.711  -8.655
  439    HB2  LEU  58           HB2      LEU  58  28.428 -23.686 -10.803
  440    HB3  LEU  58           HB3      LEU  58  26.944 -24.063  -9.976
  441    HG   LEU  58           HG       LEU  58  27.604 -21.730  -9.851
  442   HD11  LEU  58          1HD1      LEU  58  27.841 -22.815  -7.020
  443   HD12  LEU  58          2HD1      LEU  58  26.308 -22.698  -7.932
  444   HD13  LEU  58          3HD1      LEU  58  27.241 -21.249  -7.568
  445   HD21  LEU  58          3HD2      LEU  58  29.514 -20.902  -8.641
  446   HD22  LEU  58          1HD2      LEU  58  30.081 -22.048  -9.877
  447   HD23  LEU  58          2HD2      LEU  58  30.000 -22.547  -8.170
  448    H    THR  59           H        THR  59  28.769 -24.747  -6.552
  449    HA   THR  59           HA       THR  59  26.346 -26.398  -6.027
  450    HB   THR  59           HB       THR  59  27.605 -27.219  -3.921
  451    HG1  THR  59           HG1      THR  59  29.865 -27.380  -4.268
  452   HG21  THR  59          1HG2      THR  59  28.533 -29.143  -5.120
  453   HG22  THR  59          2HG2      THR  59  28.438 -28.263  -6.661
  454   HG23  THR  59          3HG2      THR  59  26.956 -28.690  -5.775
  455    H    GLU  60           H        GLU  60  25.262 -26.035  -4.187
  456    HA   GLU  60           HA       GLU  60  24.880 -23.386  -3.311
  457    HB2  GLU  60           HB2      GLU  60  23.395 -24.413  -1.631
  458    HB3  GLU  60           HB3      GLU  60  23.145 -25.054  -3.258
  459    HG2  GLU  60           HG2      GLU  60  24.443 -27.105  -2.667
  460    HG3  GLU  60           HG3      GLU  60  24.705 -26.458  -1.042
  461    H    SER  61           H        SER  61  27.025 -25.883  -1.951
  462    HA   SER  61           HA       SER  61  27.426 -24.734   0.615
  463    HB2  SER  61           HB2      SER  61  29.353 -26.465  -0.983
  464    HB3  SER  61           HB3      SER  61  29.275 -26.278   0.774
  465    HG   SER  61           HG       SER  61  28.242 -28.213   0.109
  466    H    MET  62           H        MET  62  28.660 -23.724  -2.450
  467    HA   MET  62           HA       MET  62  31.044 -22.353  -1.305
  468    HB2  MET  62           HB2      MET  62  30.147 -22.786  -4.185
  469    HB3  MET  62           HB3      MET  62  31.681 -22.087  -3.654
  470    HG2  MET  62           HG2      MET  62  30.790 -24.939  -3.102
  471    HG3  MET  62           HG3      MET  62  31.918 -24.441  -4.345
  472    HE1  MET  62           HE1      MET  62  33.606 -26.247  -3.529
  473    HE2  MET  62           HE2      MET  62  34.187 -26.402  -1.863
  474    HE3  MET  62           HE3      MET  62  32.480 -26.737  -2.234
  475    H    LEU  63           H        LEU  63  27.850 -21.529  -1.741
  476    HA   LEU  63           HA       LEU  63  28.199 -18.815  -2.804
  477    HB2  LEU  63           HB2      LEU  63  25.817 -20.189  -1.503
  478    HB3  LEU  63           HB3      LEU  63  25.783 -18.646  -2.347
  479    HG   LEU  63           HG       LEU  63  26.302 -21.374  -3.594
  480   HD11  LEU  63          1HD1      LEU  63  24.011 -19.381  -3.893
  481   HD12  LEU  63          2HD1      LEU  63  23.946 -20.925  -3.000
  482   HD13  LEU  63          3HD1      LEU  63  24.161 -20.916  -4.756
  483   HD21  LEU  63          3HD2      LEU  63  27.664 -19.755  -4.823
  484   HD22  LEU  63          1HD2      LEU  63  26.280 -18.641  -4.932
  485   HD23  LEU  63          2HD2      LEU  63  26.243 -20.192  -5.778
  486    H    GLU  64           H        GLU  64  27.955 -16.900  -1.711
  487    HA   GLU  64           HA       GLU  64  27.387 -16.781   1.139
  488    HB2  GLU  64           HB2      GLU  64  29.793 -17.272   1.169
  489    HB3  GLU  64           HB3      GLU  64  30.104 -15.920   0.075
  490    HG2  GLU  64           HG2      GLU  64  29.371 -14.314   1.787
  491    HG3  GLU  64           HG3      GLU  64  28.896 -15.638   2.862
  492    HA   PRO  65           HA       PRO  65  25.708 -13.036  -0.716
  493    HB2  PRO  65           HB2      PRO  65  24.671 -11.765   1.467
  494    HB3  PRO  65           HB3      PRO  65  23.932 -13.220   0.720
  495    HG2  PRO  65           HG2      PRO  65  25.796 -13.087   3.122
  496    HG3  PRO  65           HG3      PRO  65  24.248 -13.960   2.984
  497    HD2  PRO  65           HD2      PRO  65  26.620 -15.224   2.591
  498    HD3  PRO  65           HD3      PRO  65  25.204 -15.623   1.583
  499    H    VAL  66           H        VAL  66  26.436 -10.991  -1.180
  500    HA   VAL  66           HA       VAL  66  29.037 -10.242  -0.006
  501    HB   VAL  66           HB       VAL  66  27.587  -8.969  -2.350
  502   HG11  VAL  66          1HG1      VAL  66  29.251  -7.449  -1.365
  503   HG12  VAL  66          2HG1      VAL  66  30.459  -8.746  -1.337
  504   HG13  VAL  66          3HG1      VAL  66  29.880  -8.088  -2.875
  505   HG21  VAL  66          3HG2      VAL  66  29.191 -10.229  -3.737
  506   HG22  VAL  66          1HG2      VAL  66  29.809 -11.048  -2.287
  507   HG23  VAL  66          2HG2      VAL  66  28.138 -11.327  -2.843
  508    HA   PRO  67           HA       PRO  67  26.731  -7.119   2.401
  509    HB2  PRO  67           HB2      PRO  67  28.646  -6.404   4.193
  510    HB3  PRO  67           HB3      PRO  67  27.810  -7.982   4.278
  511    HG2  PRO  67           HG2      PRO  67  30.523  -7.388   3.073
  512    HG3  PRO  67           HG3      PRO  67  30.077  -8.727   4.185
  513    HD2  PRO  67           HD2      PRO  67  30.214  -9.053   1.463
  514    HD3  PRO  67           HD3      PRO  67  29.038  -9.928   2.480
  515    H    GLU  68           H        GLU  68  30.046  -6.476   1.116
  516    HA   GLU  68           HA       GLU  68  29.840  -3.651   1.376
  517    HB2  GLU  68           HB2      GLU  68  31.852  -3.545   0.043
  518    HB3  GLU  68           HB3      GLU  68  31.968  -4.819   1.242
  519    HG2  GLU  68           HG2      GLU  68  31.490  -6.525  -0.512
  520    HG3  GLU  68           HG3      GLU  68  31.337  -5.240  -1.719
  521    H    LEU  69           H        LEU  69  28.489  -5.712  -1.071
  522    HA   LEU  69           HA       LEU  69  27.800  -3.397  -2.812
  523    HB2  LEU  69           HB2      LEU  69  27.419  -6.403  -3.105
  524    HB3  LEU  69           HB3      LEU  69  26.699  -5.214  -4.198
  525    HG   LEU  69           HG       LEU  69  29.692  -5.540  -3.737
  526   HD11  LEU  69          1HD1      LEU  69  29.688  -6.549  -5.995
  527   HD12  LEU  69          2HD1      LEU  69  27.914  -6.421  -6.060
  528   HD13  LEU  69          3HD1      LEU  69  28.693  -7.486  -4.871
  529   HD21  LEU  69          3HD2      LEU  69  28.121  -3.836  -5.743
  530   HD22  LEU  69          1HD2      LEU  69  29.874  -4.128  -5.804
  531   HD23  LEU  69          2HD2      LEU  69  29.179  -3.234  -4.449
  532    H    LYS  70           H        LYS  70  26.148  -5.910  -0.773
  533    HA   LYS  70           HA       LYS  70  23.553  -4.921  -1.325
  534    HB2  LYS  70           HB2      LYS  70  24.126  -7.132  -0.327
  535    HB3  LYS  70           HB3      LYS  70  24.495  -6.325   1.207
  536    HG2  LYS  70           HG2      LYS  70  22.158  -5.607   1.426
  537    HG3  LYS  70           HG3      LYS  70  21.806  -6.065  -0.231
  538    HD2  LYS  70           HD2      LYS  70  20.860  -7.703   1.310
  539    HD3  LYS  70           HD3      LYS  70  22.105  -8.445   0.301
  540    HE2  LYS  70           HE2      LYS  70  23.737  -8.284   2.159
  541    HE3  LYS  70           HE3      LYS  70  22.552  -7.434   3.150
  542    HZ1  LYS  70           HZ1      LYS  70  22.626  -9.792   3.700
  543    HZ2  LYS  70           HZ2      LYS  70  22.254 -10.228   2.163
  544    HZ3  LYS  70           HZ3      LYS  70  21.161  -9.437   3.086
  545    H    GLU  71           H        GLU  71  25.817  -3.880   1.210
  546    HA   GLU  71           HA       GLU  71  24.066  -2.004   2.498
  547    HB2  GLU  71           HB2      GLU  71  26.136  -2.998   3.457
  548    HB3  GLU  71           HB3      GLU  71  27.100  -2.021   2.363
  549    HG2  GLU  71           HG2      GLU  71  26.226   0.043   3.400
  550    HG3  GLU  71           HG3      GLU  71  25.142  -0.914   4.419
  551    H    GLN  72           H        GLN  72  26.228  -1.699  -0.315
  552    HA   GLN  72           HA       GLN  72  25.820   1.196  -0.591
  553    HB2  GLN  72           HB2      GLN  72  26.966  -0.936  -2.443
  554    HB3  GLN  72           HB3      GLN  72  26.808   0.760  -2.905
  555    HG2  GLN  72           HG2      GLN  72  28.392  -0.177  -0.462
  556    HG3  GLN  72           HG3      GLN  72  29.091   0.098  -2.050
  557   HE21  GLN  72          1HE2      GLN  72  28.926   2.386  -2.961
  558   HE22  GLN  72          2HE2      GLN  72  28.870   3.701  -1.795
  559    H    ILE  73           H        ILE  73  24.398  -1.708  -2.091
  560    HA   ILE  73           HA       ILE  73  22.592  -0.416  -3.871
  561    HB   ILE  73           HB       ILE  73  22.676  -3.125  -2.505
  562   HG12  ILE  73          2HG1      ILE  73  22.874  -2.347  -5.442
  563   HG13  ILE  73          3HG1      ILE  73  24.274  -2.471  -4.392
  564   HG21  ILE  73          1HG2      ILE  73  20.493  -2.105  -4.369
  565   HG22  ILE  73          2HG2      ILE  73  20.809  -3.823  -4.047
  566   HG23  ILE  73          3HG2      ILE  73  20.323  -2.784  -2.736
  567   HD11  ILE  73          3HD1      ILE  73  24.129  -4.484  -5.659
  568   HD12  ILE  73          1HD1      ILE  73  23.743  -4.877  -3.964
  569   HD13  ILE  73          2HD1      ILE  73  22.452  -4.763  -5.187
  570    H    GLN  74           H        GLN  74  21.957  -1.506  -0.479
  571    HA   GLN  74           HA       GLN  74  19.257  -0.569  -0.562
  572    HB2  GLN  74           HB2      GLN  74  19.092  -1.134   1.712
  573    HB3  GLN  74           HB3      GLN  74  20.132  -2.317   0.949
  574    HG2  GLN  74           HG2      GLN  74  21.352  -2.008   2.839
  575    HG3  GLN  74           HG3      GLN  74  22.088  -0.751   1.859
  576   HE21  GLN  74          1HE2      GLN  74  19.331  -1.225   4.192
  577   HE22  GLN  74          2HE2      GLN  74  19.569   0.325   4.967
  578    H    ALA  75           H        ALA  75  22.230   1.161   0.312
  579    HA   ALA  75           HA       ALA  75  20.893   3.570   1.217
  580    HB1  ALA  75           HB1      ALA  75  23.149   4.562   0.917
  581    HB2  ALA  75           HB2      ALA  75  23.223   3.031   1.801
  582    HB3  ALA  75           HB3      ALA  75  23.693   3.088   0.086
  583    H    TRP  76           H        TRP  76  22.122   2.463  -1.995
  584    HA   TRP  76           HA       TRP  76  21.486   4.888  -3.375
  585    HB2  TRP  76           HB2      TRP  76  23.076   3.197  -4.189
  586    HB3  TRP  76           HB3      TRP  76  21.767   2.050  -4.416
  587    HD1  TRP  76           HD1      TRP  76  23.317   5.174  -5.918
  588    HE1  TRP  76           HE1      TRP  76  22.364   5.625  -8.263
  589    HE3  TRP  76           HE3      TRP  76  19.646   1.615  -5.982
  590    HZ2  TRP  76           HZ2      TRP  76  20.222   4.608  -9.922
  591    HZ3  TRP  76           HZ3      TRP  76  18.163   1.388  -7.945
  592    HH2  TRP  76           HH2      TRP  76  18.419   2.876  -9.908
  593    H    MET  77           H        MET  77  19.581   1.847  -3.011
  594    HA   MET  77           HA       MET  77  17.311   2.680  -4.529
  595    HB2  MET  77           HB2      MET  77  17.523   0.833  -2.126
  596    HB3  MET  77           HB3      MET  77  16.054   1.029  -3.087
  597    HG2  MET  77           HG2      MET  77  17.359   0.328  -5.128
  598    HG3  MET  77           HG3      MET  77  18.692  -0.100  -4.071
  599    HE1  MET  77           HE1      MET  77  16.803  -1.241  -1.513
  600    HE2  MET  77           HE2      MET  77  16.897  -2.958  -1.877
  601    HE3  MET  77           HE3      MET  77  18.352  -1.961  -2.031
  602    H    ARG  78           H        ARG  78  18.101   3.384  -1.116
  603    HA   ARG  78           HA       ARG  78  15.619   4.581  -0.433
  604    HB2  ARG  78           HB2      ARG  78  17.415   3.901   1.173
  605    HB3  ARG  78           HB3      ARG  78  18.379   5.290   0.642
  606    HG2  ARG  78           HG2      ARG  78  16.570   6.827   1.421
  607    HG3  ARG  78           HG3      ARG  78  15.600   5.425   1.902
  608    HD2  ARG  78           HD2      ARG  78  17.357   4.769   3.518
  609    HD3  ARG  78           HD3      ARG  78  18.348   6.145   3.008
  610    HE   ARG  78           HE       ARG  78  15.793   7.114   3.770
  611   HH11  ARG  78          1HH1      ARG  78  18.639   5.730   5.356
  612   HH12  ARG  78          2HH1      ARG  78  18.306   6.530   6.856
  613   HH21  ARG  78          1HH2      ARG  78  15.414   8.105   5.731
  614   HH22  ARG  78          2HH2      ARG  78  16.506   7.876   7.062
  615    H    GLU  79           H        GLU  79  18.495   6.011  -2.028
  616    HA   GLU  79           HA       GLU  79  17.460   8.698  -2.095
  617    HB2  GLU  79           HB2      GLU  79  19.481   7.335  -3.913
  618    HB3  GLU  79           HB3      GLU  79  19.150   9.060  -3.907
  619    HG2  GLU  79           HG2      GLU  79  20.243   7.486  -1.532
  620    HG3  GLU  79           HG3      GLU  79  21.195   8.449  -2.651
  621    H    LYS  80           H        LYS  80  16.875   5.897  -4.218
  622    HA   LYS  80           HA       LYS  80  15.441   7.468  -6.239
  623    HB2  LYS  80           HB2      LYS  80  15.398   4.470  -5.734
  624    HB3  LYS  80           HB3      LYS  80  14.867   5.291  -7.178
  625    HG2  LYS  80           HG2      LYS  80  17.713   5.005  -6.155
  626    HG3  LYS  80           HG3      LYS  80  16.997   4.218  -7.550
  627    HD2  LYS  80           HD2      LYS  80  17.512   7.217  -7.299
  628    HD3  LYS  80           HD3      LYS  80  18.527   6.069  -8.164
  629    HE2  LYS  80           HE2      LYS  80  16.668   5.509  -9.693
  630    HE3  LYS  80           HE3      LYS  80  15.603   6.626  -8.834
  631    HZ1  LYS  80           HZ1      LYS  80  17.186   8.432  -9.463
  632    HZ2  LYS  80           HZ2      LYS  80  16.482   7.723 -10.748
  633    HZ3  LYS  80           HZ3      LYS  80  18.028   7.349 -10.380
  634    H    GLN  81           H        GLN  81  14.495   5.602  -3.362
  635    HA   GLN  81           HA       GLN  81  11.621   5.877  -3.825
  636    HB2  GLN  81           HB2      GLN  81  12.719   3.991  -2.613
  637    HB3  GLN  81           HB3      GLN  81  13.165   5.113  -1.317
  638    HG2  GLN  81           HG2      GLN  81  10.790   5.520  -0.796
  639    HG3  GLN  81           HG3      GLN  81  10.304   4.569  -2.201
  640   HE21  GLN  81          1HE2      GLN  81   9.030   3.113  -0.843
  641   HE22  GLN  81          2HE2      GLN  81   9.870   1.939   0.171
  642    H    SER  82           H        SER  82  14.074   7.763  -2.011
  643    HA   SER  82           HA       SER  82  12.304   9.549  -0.674
  644    HB2  SER  82           HB2      SER  82  14.759   9.348  -0.306
  645    HB3  SER  82           HB3      SER  82  15.036  10.140  -1.865
  646    HG   SER  82           HG       SER  82  15.084  11.601  -0.026
  647    H    SER  83           H        SER  83  11.362  11.469  -1.216
  648    HA   SER  83           HA       SER  83  10.294  13.067  -2.402
  649    HB2  SER  83           HB2      SER  83  12.278  12.598  -4.651
  650    HB3  SER  83           HB3      SER  83  11.148  13.944  -4.502
  651    HG   SER  83           HG       SER  83  13.243  13.299  -2.659
  652    H    ASP  84           H        ASP  84  10.689   9.975  -4.027
  653    HA   ASP  84           HA       ASP  84   8.306  10.226  -5.704
  654    HB2  ASP  84           HB2      ASP  84  10.064   8.692  -6.327
  655    HB3  ASP  84           HB3      ASP  84   9.973   7.855  -4.777
  656    H    HIS  85           H        HIS  85   9.062   8.643  -2.558
  657    HA   HIS  85           HA       HIS  85   6.192   8.276  -1.888
  658    HB2  HIS  85           HB2      HIS  85   8.801   7.590  -0.493
  659    HB3  HIS  85           HB3      HIS  85   7.232   7.457   0.293
  660    HD1  HIS  85           HD1      HIS  85   7.633   6.277  -3.384
  661    HD2  HIS  85           HD2      HIS  85   7.290   4.841   0.568
  662    HE1  HIS  85           HE1      HIS  85   7.251   3.766  -3.555
  Start of MODEL    6
    1    H2   PRO   1           H2       PRO   1   4.150  -0.497 -12.105
    2    H3   PRO   1           H3       PRO   1   4.096  -0.481 -13.756
    3    HA   PRO   1           HA       PRO   1   2.679   1.364 -13.847
    4    HB2  PRO   1           HB2      PRO   1   2.310   1.407 -10.858
    5    HB3  PRO   1           HB3      PRO   1   1.166   1.841 -12.167
    6    HG2  PRO   1           HG2      PRO   1   1.527  -0.746 -10.850
    7    HG3  PRO   1           HG3      PRO   1   0.370  -0.361 -12.160
    8    HD2  PRO   1           HD2      PRO   1   2.485  -2.076 -12.524
    9    HD3  PRO   1           HD3      PRO   1   1.819  -1.040 -13.816
   10    H    GLY   2           H        GLY   2   3.136   3.628 -13.446
   11    HA2  GLY   2           HA2      GLY   2   5.944   4.142 -12.621
   12    HA3  GLY   2           HA3      GLY   2   4.859   5.238 -13.505
   13    H    SER   3           H        SER   3   2.786   4.498 -11.261
   14    HA   SER   3           HA       SER   3   3.533   6.681  -9.417
   15    HB2  SER   3           HB2      SER   3   1.125   6.407  -8.723
   16    HB3  SER   3           HB3      SER   3   1.372   6.847 -10.420
   17    HG   SER   3           HG       SER   3  -0.174   5.146 -10.159
   18    H    ALA   4           H        ALA   4   2.388   3.289  -9.193
   19    HA   ALA   4           HA       ALA   4   2.777   3.120  -6.332
   20    HB1  ALA   4           HB1      ALA   4   1.978   0.818  -6.656
   21    HB2  ALA   4           HB2      ALA   4   0.987   1.934  -7.596
   22    HB3  ALA   4           HB3      ALA   4   2.227   0.948  -8.406
   23    H    GLU   5           H        GLU   5   5.060   2.821  -8.833
   24    HA   GLU   5           HA       GLU   5   6.989   1.366  -7.080
   25    HB2  GLU   5           HB2      GLU   5   6.640   0.796 -10.051
   26    HB3  GLU   5           HB3      GLU   5   7.806   0.059  -8.963
   27    HG2  GLU   5           HG2      GLU   5   6.072  -1.152  -7.783
   28    HG3  GLU   5           HG3      GLU   5   4.793  -0.294  -8.646
   29    H    ILE   6           H        ILE   6   9.127   1.991  -7.400
   30    HA   ILE   6           HA       ILE   6   9.675   4.471  -8.950
   31    HB   ILE   6           HB       ILE   6  11.326   2.874  -6.953
   32   HG12  ILE   6          2HG1      ILE   6  11.291   4.994  -5.633
   33   HG13  ILE   6          3HG1      ILE   6  10.115   5.672  -6.763
   34   HG21  ILE   6          1HG2      ILE   6  12.889   3.784  -8.549
   35   HG22  ILE   6          2HG2      ILE   6  12.053   5.361  -8.546
   36   HG23  ILE   6          3HG2      ILE   6  12.941   4.810  -7.113
   37   HD11  ILE   6          3HD1      ILE   6   8.412   4.140  -5.976
   38   HD12  ILE   6          1HD1      ILE   6   9.625   3.168  -5.084
   39   HD13  ILE   6          2HD1      ILE   6   9.213   4.810  -4.557
   40    H    ASP   7           H        ASP   7  11.037   4.531 -10.746
   41    HA   ASP   7           HA       ASP   7  11.627   1.993 -12.108
   42    HB2  ASP   7           HB2      ASP   7  10.779   3.852 -13.402
   43    HB3  ASP   7           HB3      ASP   7  12.105   4.887 -12.867
   44    H    TYR   8           H        TYR   8  13.269   0.848 -11.283
   45    HA   TYR   8           HA       TYR   8  15.817   2.154 -10.510
   46    HB2  TYR   8           HB2      TYR   8  15.058  -0.770 -10.305
   47    HB3  TYR   8           HB3      TYR   8  16.428   0.037  -9.583
   48    HD1  TYR   8           HD1      TYR   8  15.970   1.953  -7.820
   49    HD2  TYR   8           HD2      TYR   8  13.044  -0.975  -9.060
   50    HE1  TYR   8           HE1      TYR   8  14.713   2.314  -5.715
   51    HE2  TYR   8           HE2      TYR   8  11.750  -0.563  -6.985
   52    HH   TYR   8           HH       TYR   8  11.683   0.531  -4.962
   53    H    SER   9           H        SER   9  14.680   1.338 -13.478
   54    HA   SER   9           HA       SER   9  16.838  -0.251 -14.571
   55    HB2  SER   9           HB2      SER   9  14.541   0.182 -15.577
   56    HB3  SER   9           HB3      SER   9  15.139   1.782 -16.050
   57    HG   SER   9           HG       SER   9  15.355   0.150 -17.707
   58    H    ASP  10           H        ASP  10  16.702   3.037 -13.572
   59    HA   ASP  10           HA       ASP  10  18.949   4.097 -15.033
   60    HB2  ASP  10           HB2      ASP  10  17.093   5.406 -13.983
   61    HB3  ASP  10           HB3      ASP  10  17.686   4.928 -12.391
   62    H    ALA  11           H        ALA  11  18.872   1.711 -12.588
   63    HA   ALA  11           HA       ALA  11  21.076   2.377 -10.974
   64    HB1  ALA  11           HB1      ALA  11  19.989  -0.364 -11.772
   65    HB2  ALA  11           HB2      ALA  11  21.106  -0.058 -10.418
   66    HB3  ALA  11           HB3      ALA  11  19.472   0.622 -10.387
   67    HA   PRO  12           HA       PRO  12  24.627   1.616 -13.596
   68    HB2  PRO  12           HB2      PRO  12  26.591   1.157 -11.789
   69    HB3  PRO  12           HB3      PRO  12  25.813   2.757 -11.952
   70    HG2  PRO  12           HG2      PRO  12  25.139   0.582  -9.946
   71    HG3  PRO  12           HG3      PRO  12  25.452   2.314  -9.624
   72    HD2  PRO  12           HD2      PRO  12  22.917   1.362  -9.898
   73    HD3  PRO  12           HD3      PRO  12  23.375   2.964 -10.528
   74    H    ASP  13           H        ASP  13  26.030  -0.071 -14.306
   75    HA   ASP  13           HA       ASP  13  24.865  -2.617 -14.491
   76    HB2  ASP  13           HB2      ASP  13  26.429  -1.567 -16.095
   77    HB3  ASP  13           HB3      ASP  13  27.754  -1.765 -14.950
   78    H    GLU  14           H        GLU  14  27.183  -1.464 -12.095
   79    HA   GLU  14           HA       GLU  14  27.960  -4.064 -11.100
   80    HB2  GLU  14           HB2      GLU  14  29.100  -2.875  -9.348
   81    HB3  GLU  14           HB3      GLU  14  29.417  -2.113 -10.904
   82    HG2  GLU  14           HG2      GLU  14  27.644  -0.379 -10.332
   83    HG3  GLU  14           HG3      GLU  14  27.541  -1.103  -8.729
   84    H    PHE  15           H        PHE  15  25.098  -2.191 -10.582
   85    HA   PHE  15           HA       PHE  15  24.358  -3.754  -8.143
   86    HB2  PHE  15           HB2      PHE  15  23.066  -1.359  -9.496
   87    HB3  PHE  15           HB3      PHE  15  22.404  -2.200  -8.113
   88    HD1  PHE  15           HD2      PHE  15  25.752  -2.266  -7.179
   89    HD2  PHE  15           HD1      PHE  15  22.501   0.517  -7.805
   90    HE1  PHE  15           HE2      PHE  15  26.824  -0.655  -5.658
   91    HE2  PHE  15           HE1      PHE  15  23.582   2.118  -6.266
   92    HZ   PHE  15           HZ       PHE  15  25.743   1.544  -5.191
   93    H    ARG  16           H        ARG  16  24.169  -4.087 -11.482
   94    HA   ARG  16           HA       ARG  16  21.399  -5.200 -11.438
   95    HB2  ARG  16           HB2      ARG  16  23.116  -4.004 -13.622
   96    HB3  ARG  16           HB3      ARG  16  21.671  -4.953 -13.995
   97    HG2  ARG  16           HG2      ARG  16  20.225  -3.437 -12.857
   98    HG3  ARG  16           HG3      ARG  16  21.559  -2.625 -12.033
   99    HD2  ARG  16           HD2      ARG  16  20.701  -1.206 -13.762
  100    HD3  ARG  16           HD3      ARG  16  22.373  -1.683 -14.116
  101    HE   ARG  16           HE       ARG  16  20.705  -3.488 -15.498
  102   HH11  ARG  16          1HH1      ARG  16  21.301   0.005 -15.512
  103   HH12  ARG  16          2HH1      ARG  16  20.894   0.156 -17.196
  104   HH21  ARG  16          1HH2      ARG  16  20.215  -3.240 -17.656
  105   HH22  ARG  16          2HH2      ARG  16  20.294  -1.660 -18.406
  106    H    ASP  17           H        ASP  17  20.871  -7.133 -12.345
  107    HA   ASP  17           HA       ASP  17  22.934  -9.226 -12.395
  108    HB2  ASP  17           HB2      ASP  17  21.143 -10.757 -12.418
  109    HB3  ASP  17           HB3      ASP  17  20.522  -9.427 -11.447
  110    HA   PRO  18           HA       PRO  18  23.483  -9.190 -16.793
  111    HB2  PRO  18           HB2      PRO  18  24.601 -11.606 -17.288
  112    HB3  PRO  18           HB3      PRO  18  25.318 -10.471 -16.109
  113    HG2  PRO  18           HG2      PRO  18  23.425 -12.781 -15.566
  114    HG3  PRO  18           HG3      PRO  18  25.018 -12.474 -14.790
  115    HD2  PRO  18           HD2      PRO  18  22.636 -11.686 -13.679
  116    HD3  PRO  18           HD3      PRO  18  24.130 -10.717 -13.498
  117    H    LEU  19           H        LEU  19  20.753 -11.018 -15.851
  118    HA   LEU  19           HA       LEU  19  20.238 -12.025 -18.633
  119    HB2  LEU  19           HB2      LEU  19  21.105 -13.830 -17.430
  120    HB3  LEU  19           HB3      LEU  19  20.137 -13.479 -15.996
  121    HG   LEU  19           HG       LEU  19  18.087 -14.163 -17.199
  122   HD11  LEU  19          1HD1      LEU  19  20.008 -14.987 -19.430
  123   HD12  LEU  19          2HD1      LEU  19  18.781 -13.714 -19.544
  124   HD13  LEU  19          3HD1      LEU  19  18.281 -15.398 -19.349
  125   HD21  LEU  19          3HD2      LEU  19  19.314 -15.764 -15.804
  126   HD22  LEU  19          1HD2      LEU  19  20.317 -16.244 -17.186
  127   HD23  LEU  19          2HD2      LEU  19  18.577 -16.578 -17.198
  128    H    MET  20           H        MET  20  18.686 -11.454 -15.465
  129    HA   MET  20           HA       MET  20  15.989 -11.007 -16.559
  130    HB2  MET  20           HB2      MET  20  17.306 -10.843 -13.813
  131    HB3  MET  20           HB3      MET  20  15.691 -10.216 -14.095
  132    HG2  MET  20           HG2      MET  20  14.948 -12.438 -14.901
  133    HG3  MET  20           HG3      MET  20  16.580 -13.065 -14.722
  134    HE1  MET  20           HE1      MET  20  14.464 -10.754 -12.227
  135    HE2  MET  20           HE2      MET  20  13.318 -11.900 -12.948
  136    HE3  MET  20           HE3      MET  20  13.731 -12.020 -11.231
  137    H    ASP  21           H        ASP  21  18.832  -9.151 -15.739
  138    HA   ASP  21           HA       ASP  21  19.527  -7.080 -16.168
  139    HB2  ASP  21           HB2      ASP  21  18.953  -7.724 -18.472
  140    HB3  ASP  21           HB3      ASP  21  17.347  -6.996 -18.287
  141    H    THR  22           H        THR  22  18.357  -7.056 -13.916
  142    HA   THR  22           HA       THR  22  17.343  -4.309 -13.652
  143    HB   THR  22           HB       THR  22  15.321  -5.753 -13.960
  144    HG1  THR  22           HG1      THR  22  14.263  -4.734 -12.265
  145   HG21  THR  22          1HG2      THR  22  14.533  -7.166 -12.155
  146   HG22  THR  22          2HG2      THR  22  16.025  -6.920 -11.231
  147   HG23  THR  22          3HG2      THR  22  16.058  -7.797 -12.779
  148    H    LEU  23           H        LEU  23  16.921  -4.115 -11.055
  149    HA   LEU  23           HA       LEU  23  19.563  -4.265  -9.892
  150    HB2  LEU  23           HB2      LEU  23  17.321  -2.737  -9.445
  151    HB3  LEU  23           HB3      LEU  23  17.168  -3.874  -8.102
  152    HG   LEU  23           HG       LEU  23  19.560  -2.085  -8.716
  153   HD11  LEU  23          1HD1      LEU  23  18.846  -0.846  -6.692
  154   HD12  LEU  23          2HD1      LEU  23  17.447  -1.933  -6.525
  155   HD13  LEU  23          3HD1      LEU  23  17.567  -0.859  -7.913
  156   HD21  LEU  23          3HD2      LEU  23  19.082  -3.807  -6.240
  157   HD22  LEU  23          1HD2      LEU  23  20.465  -2.734  -6.551
  158   HD23  LEU  23          2HD2      LEU  23  20.248  -4.188  -7.509
  159    H    MET  24           H        MET  24  20.497  -6.034  -8.942
  160    HA   MET  24           HA       MET  24  18.979  -8.487  -8.641
  161    HB2  MET  24           HB2      MET  24  21.071  -9.476  -7.827
  162    HB3  MET  24           HB3      MET  24  21.234  -8.628  -9.369
  163    HG2  MET  24           HG2      MET  24  22.249  -6.708  -8.147
  164    HG3  MET  24           HG3      MET  24  22.183  -7.640  -6.652
  165    HE1  MET  24           HE1      MET  24  24.718  -6.527  -7.056
  166    HE2  MET  24           HE2      MET  24  25.941  -7.303  -8.089
  167    HE3  MET  24           HE3      MET  24  24.669  -6.318  -8.817
  168    H    THR  25           H        THR  25  20.040  -6.087  -6.320
  169    HA   THR  25           HA       THR  25  19.465  -5.592  -4.178
  170    HB   THR  25           HB       THR  25  17.345  -7.768  -4.306
  171    HG1  THR  25           HG1      THR  25  17.178  -5.039  -5.121
  172   HG21  THR  25          1HG2      THR  25  16.086  -6.139  -2.890
  173   HG22  THR  25          2HG2      THR  25  17.531  -5.101  -2.818
  174   HG23  THR  25          3HG2      THR  25  17.553  -6.730  -2.099
  175    H    ASP  26           H        ASP  26  19.854  -9.014  -4.780
  176    HA   ASP  26           HA       ASP  26  21.346  -9.382  -2.199
  177    HB2  ASP  26           HB2      ASP  26  19.474 -11.243  -3.685
  178    HB3  ASP  26           HB3      ASP  26  20.566 -11.758  -2.384
  179    HA   PRO  27           HA       PRO  27  24.290 -10.279  -5.668
  180    HB2  PRO  27           HB2      PRO  27  26.478  -9.016  -4.613
  181    HB3  PRO  27           HB3      PRO  27  25.236  -8.198  -5.586
  182    HG2  PRO  27           HG2      PRO  27  25.428  -8.281  -2.562
  183    HG3  PRO  27           HG3      PRO  27  25.131  -6.867  -3.616
  184    HD2  PRO  27           HD2      PRO  27  23.109  -8.184  -2.378
  185    HD3  PRO  27           HD3      PRO  27  22.908  -7.512  -4.022
  186    H    VAL  28           H        VAL  28  25.392 -12.139  -5.648
  187    HA   VAL  28           HA       VAL  28  26.428 -13.286  -3.076
  188    HB   VAL  28           HB       VAL  28  25.245 -14.794  -5.455
  189   HG11  VAL  28          1HG1      VAL  28  26.885 -16.158  -4.210
  190   HG12  VAL  28          2HG1      VAL  28  26.046 -15.791  -2.682
  191   HG13  VAL  28          3HG1      VAL  28  25.244 -16.736  -3.950
  192   HG21  VAL  28          3HG2      VAL  28  23.453 -13.588  -4.289
  193   HG22  VAL  28          1HG2      VAL  28  23.357 -15.313  -3.966
  194   HG23  VAL  28          2HG2      VAL  28  24.011 -14.216  -2.723
  195    H    ARG  29           H        ARG  29  28.403 -14.063  -3.058
  196    HA   ARG  29           HA       ARG  29  30.252 -13.780  -5.323
  197    HB2  ARG  29           HB2      ARG  29  30.860 -12.968  -3.092
  198    HB3  ARG  29           HB3      ARG  29  30.566 -14.565  -2.399
  199    HG2  ARG  29           HG2      ARG  29  32.472 -15.466  -3.766
  200    HG3  ARG  29           HG3      ARG  29  32.788 -13.802  -4.334
  201    HD2  ARG  29           HD2      ARG  29  33.098 -13.090  -1.970
  202    HD3  ARG  29           HD3      ARG  29  32.712 -14.741  -1.438
  203    HE   ARG  29           HE       ARG  29  34.952 -14.549  -3.320
  204   HH11  ARG  29          1HH2      ARG  29  34.058 -14.707   0.143
  205   HH12  ARG  29          2HH2      ARG  29  35.673 -15.155   0.606
  206   HH21  ARG  29          1HH1      ARG  29  36.999 -15.144  -2.613
  207   HH22  ARG  29          2HH1      ARG  29  37.304 -15.414  -0.930
  208    H    LEU  30           H        LEU  30  30.711 -15.414  -6.606
  209    HA   LEU  30           HA       LEU  30  30.297 -18.274  -5.858
  210    HB2  LEU  30           HB2      LEU  30  30.792 -16.730  -8.444
  211    HB3  LEU  30           HB3      LEU  30  31.189 -18.430  -8.364
  212    HG   LEU  30           HG       LEU  30  28.816 -18.926  -7.629
  213   HD11  LEU  30          1HD1      LEU  30  28.357 -16.011  -8.404
  214   HD12  LEU  30          2HD1      LEU  30  28.038 -16.754  -6.820
  215   HD13  LEU  30          3HD1      LEU  30  27.074 -17.233  -8.207
  216   HD21  LEU  30          3HD2      LEU  30  27.922 -18.717  -9.928
  217   HD22  LEU  30          1HD2      LEU  30  29.597 -19.280  -9.907
  218   HD23  LEU  30          2HD2      LEU  30  29.242 -17.586 -10.319
  219    HA   PRO  31           HA       PRO  31  34.424 -19.004  -4.719
  220    HB2  PRO  31           HB2      PRO  31  35.191 -21.357  -5.941
  221    HB3  PRO  31           HB3      PRO  31  34.011 -21.253  -4.594
  222    HG2  PRO  31           HG2      PRO  31  33.447 -21.372  -7.570
  223    HG3  PRO  31           HG3      PRO  31  32.706 -22.368  -6.271
  224    HD2  PRO  31           HD2      PRO  31  31.437 -20.210  -7.221
  225    HD3  PRO  31           HD3      PRO  31  31.448 -20.507  -5.463
  226    H    SER  32           H        SER  32  33.953 -18.739  -8.224
  227    HA   SER  32           HA       SER  32  36.740 -18.361  -8.947
  228    HB2  SER  32           HB2      SER  32  35.662 -17.533 -11.065
  229    HB3  SER  32           HB3      SER  32  35.098 -19.134 -10.553
  230    HG   SER  32           HG       SER  32  33.317 -17.868 -11.117
  231    H    GLY  33           H        GLY  33  34.622 -16.390  -7.156
  232    HA2  GLY  33           HA2      GLY  33  34.949 -14.213  -6.368
  233    HA3  GLY  33           HA3      GLY  33  36.156 -13.899  -7.643
  234    H    THR  34           H        THR  34  33.493 -15.299  -9.109
  235    HA   THR  34           HA       THR  34  32.571 -12.855 -10.366
  236    HB   THR  34           HB       THR  34  31.446 -15.694 -10.403
  237    HG1  THR  34           HG1      THR  34  33.420 -15.632 -11.338
  238   HG21  THR  34          1HG2      THR  34  30.799 -13.288 -12.159
  239   HG22  THR  34          2HG2      THR  34  29.663 -14.198 -11.129
  240   HG23  THR  34          3HG2      THR  34  30.372 -14.962 -12.545
  241    H    VAL  35           H        VAL  35  30.746 -11.671  -9.978
  242    HA   VAL  35           HA       VAL  35  29.123 -12.285  -7.551
  243    HB   VAL  35           HB       VAL  35  29.350  -9.674  -9.083
  244   HG11  VAL  35          1HG1      VAL  35  27.785 -10.370  -6.550
  245   HG12  VAL  35          2HG1      VAL  35  28.017  -8.727  -7.194
  246   HG13  VAL  35          3HG1      VAL  35  27.088  -9.899  -8.118
  247   HG21  VAL  35          3HG2      VAL  35  30.354 -10.454  -6.310
  248   HG22  VAL  35          1HG2      VAL  35  31.369 -10.143  -7.733
  249   HG23  VAL  35          2HG2      VAL  35  30.418  -8.830  -7.008
  250    H    MET  36           H        MET  36  27.032 -12.802  -7.734
  251    HA   MET  36           HA       MET  36  25.528 -12.481 -10.282
  252    HB2  MET  36           HB2      MET  36  26.758 -14.752  -9.980
  253    HB3  MET  36           HB3      MET  36  25.553 -15.085  -8.731
  254    HG2  MET  36           HG2      MET  36  23.740 -14.851 -10.393
  255    HG3  MET  36           HG3      MET  36  24.917 -14.404 -11.636
  256    HE1  MET  36           HE1      MET  36  27.329 -16.589 -11.141
  257    HE2  MET  36           HE2      MET  36  26.776 -17.693 -12.413
  258    HE3  MET  36           HE3      MET  36  26.673 -15.936 -12.654
  259    H    ASP  37           H        ASP  37  23.205 -12.792 -10.006
  260    HA   ASP  37           HA       ASP  37  22.090 -11.713  -7.540
  261    HB2  ASP  37           HB2      ASP  37  21.294 -11.162  -9.818
  262    HB3  ASP  37           HB3      ASP  37  20.829 -12.836 -10.079
  263    H    ARG  38           H        ARG  38  21.405 -12.860  -5.827
  264    HA   ARG  38           HA       ARG  38  21.562 -15.597  -5.347
  265    HB2  ARG  38           HB2      ARG  38  21.228 -13.904  -3.607
  266    HB3  ARG  38           HB3      ARG  38  19.629 -13.543  -4.240
  267    HG2  ARG  38           HG2      ARG  38  19.483 -14.911  -2.219
  268    HG3  ARG  38           HG3      ARG  38  18.783 -15.718  -3.609
  269    HD2  ARG  38           HD2      ARG  38  19.957 -17.367  -2.377
  270    HD3  ARG  38           HD3      ARG  38  20.919 -17.071  -3.825
  271    HE   ARG  38           HE       ARG  38  21.806 -15.380  -1.679
  272   HH11  ARG  38          1HH1      ARG  38  21.927 -18.796  -2.606
  273   HH12  ARG  38          2HH1      ARG  38  23.349 -19.090  -1.657
  274   HH21  ARG  38          1HH2      ARG  38  23.659 -15.836  -0.503
  275   HH22  ARG  38          2HH2      ARG  38  24.325 -17.440  -0.504
  276    H    SER  39           H        SER  39  18.759 -13.805  -6.716
  277    HA   SER  39           HA       SER  39  16.939 -16.051  -6.646
  278    HB2  SER  39           HB2      SER  39  16.899 -13.485  -8.267
  279    HB3  SER  39           HB3      SER  39  15.549 -14.639  -8.134
  280    HG   SER  39           HG       SER  39  15.418 -12.863  -6.619
  281    H    ILE  40           H        ILE  40  19.330 -14.996  -9.056
  282    HA   ILE  40           HA       ILE  40  18.254 -16.811 -11.137
  283    HB   ILE  40           HB       ILE  40  20.777 -15.108 -11.098
  284   HG12  ILE  40          2HG1      ILE  40  18.019 -14.684 -12.344
  285   HG13  ILE  40          3HG1      ILE  40  18.697 -13.774 -10.992
  286   HG21  ILE  40          1HG2      ILE  40  20.852 -15.520 -13.538
  287   HG22  ILE  40          2HG2      ILE  40  20.972 -17.039 -12.676
  288   HG23  ILE  40          3HG2      ILE  40  19.424 -16.563 -13.426
  289   HD11  ILE  40          3HD1      ILE  40  19.532 -13.660 -13.887
  290   HD12  ILE  40          1HD1      ILE  40  18.899 -12.373 -12.856
  291   HD13  ILE  40          2HD1      ILE  40  20.537 -12.993 -12.572
  292    H    ILE  41           H        ILE  41  21.120 -16.738  -8.941
  293    HA   ILE  41           HA       ILE  41  22.061 -19.267  -9.919
  294    HB   ILE  41           HB       ILE  41  23.474 -17.609  -8.715
  295   HG12  ILE  41          2HG1      ILE  41  24.880 -19.200  -7.520
  296   HG13  ILE  41          3HG1      ILE  41  23.589 -20.396  -7.476
  297   HG21  ILE  41          1HG2      ILE  41  23.563 -17.535  -6.292
  298   HG22  ILE  41          2HG2      ILE  41  21.946 -17.096  -6.849
  299   HG23  ILE  41          3HG2      ILE  41  22.235 -18.698  -6.146
  300   HD11  ILE  41          3HD1      ILE  41  25.353 -20.790  -9.238
  301   HD12  ILE  41          1HD1      ILE  41  23.712 -20.714  -9.891
  302   HD13  ILE  41          2HD1      ILE  41  24.806 -19.325 -10.064
  303    H    LEU  42           H        LEU  42  19.823 -18.571  -7.180
  304    HA   LEU  42           HA       LEU  42  19.596 -21.376  -6.549
  305    HB2  LEU  42           HB2      LEU  42  17.993 -20.839  -4.975
  306    HB3  LEU  42           HB3      LEU  42  19.106 -19.492  -5.006
  307    HG   LEU  42           HG       LEU  42  17.327 -18.313  -6.515
  308   HD11  LEU  42          1HD1      LEU  42  14.984 -18.969  -5.992
  309   HD12  LEU  42          2HD1      LEU  42  15.573 -20.407  -5.131
  310   HD13  LEU  42          3HD1      LEU  42  15.769 -20.258  -6.888
  311   HD21  LEU  42          3HD2      LEU  42  16.749 -18.886  -3.576
  312   HD22  LEU  42          1HD2      LEU  42  16.188 -17.476  -4.507
  313   HD23  LEU  42          2HD2      LEU  42  17.914 -17.700  -4.183
  314    H    ARG  43           H        ARG  43  17.762 -19.306  -8.812
  315    HA   ARG  43           HA       ARG  43  15.793 -21.219  -9.568
  316    HB2  ARG  43           HB2      ARG  43  15.733 -18.859 -10.171
  317    HB3  ARG  43           HB3      ARG  43  17.148 -19.056 -11.211
  318    HG2  ARG  43           HG2      ARG  43  15.696 -20.760 -12.534
  319    HG3  ARG  43           HG3      ARG  43  14.335 -20.162 -11.585
  320    HD2  ARG  43           HD2      ARG  43  16.175 -18.540 -13.400
  321    HD3  ARG  43           HD3      ARG  43  14.540 -19.044 -13.802
  322    HE   ARG  43           HE       ARG  43  15.359 -16.836 -12.056
  323   HH11  ARG  43          1HH1      ARG  43  12.598 -18.865 -12.943
  324   HH12  ARG  43          2HH1      ARG  43  11.452 -17.671 -12.402
  325   HH21  ARG  43          1HH2      ARG  43  13.832 -15.346 -11.419
  326   HH22  ARG  43          2HH2      ARG  43  12.136 -15.710 -11.567
  327    H    HIS  44           H        HIS  44  19.156 -20.708 -10.816
  328    HA   HIS  44           HA       HIS  44  18.935 -22.899 -12.677
  329    HB2  HIS  44           HB2      HIS  44  20.560 -20.868 -12.682
  330    HB3  HIS  44           HB3      HIS  44  21.567 -21.851 -11.622
  331    HD1  HIS  44           HD1      HIS  44  23.040 -23.677 -12.912
  332    HD2  HIS  44           HD2      HIS  44  19.852 -22.038 -15.129
  333    HE1  HIS  44           HE1      HIS  44  23.275 -24.567 -15.293
  334    H    LEU  45           H        LEU  45  20.325 -22.737  -9.356
  335    HA   LEU  45           HA       LEU  45  21.305 -25.394  -9.199
  336    HB2  LEU  45           HB2      LEU  45  20.224 -23.428  -7.152
  337    HB3  LEU  45           HB3      LEU  45  20.725 -25.029  -6.662
  338    HG   LEU  45           HG       LEU  45  22.599 -23.125  -8.138
  339   HD11  LEU  45          1HD1      LEU  45  23.610 -22.715  -5.909
  340   HD12  LEU  45          2HD1      LEU  45  22.302 -23.627  -5.148
  341   HD13  LEU  45          3HD1      LEU  45  21.944 -22.109  -5.998
  342   HD21  LEU  45          3HD2      LEU  45  23.042 -25.700  -6.554
  343   HD22  LEU  45          1HD2      LEU  45  24.331 -24.646  -7.144
  344   HD23  LEU  45          2HD2      LEU  45  23.281 -25.476  -8.301
  345    H    LEU  46           H        LEU  46  17.966 -24.245  -8.686
  346    HA   LEU  46           HA       LEU  46  16.884 -26.793  -7.871
  347    HB2  LEU  46           HB2      LEU  46  15.687 -24.290  -9.109
  348    HB3  LEU  46           HB3      LEU  46  14.706 -25.665  -8.614
  349    HG   LEU  46           HG       LEU  46  16.511 -24.204  -6.665
  350   HD11  LEU  46          1HD1      LEU  46  13.548 -23.764  -7.234
  351   HD12  LEU  46          2HD1      LEU  46  14.861 -22.614  -7.590
  352   HD13  LEU  46          3HD1      LEU  46  14.480 -23.016  -5.908
  353   HD21  LEU  46          3HD2      LEU  46  15.040 -25.243  -4.963
  354   HD22  LEU  46          1HD2      LEU  46  15.866 -26.457  -5.939
  355   HD23  LEU  46          2HD2      LEU  46  14.159 -26.091  -6.252
  356    H    ASN  47           H        ASN  47  17.854 -25.651 -11.016
  357    HA   ASN  47           HA       ASN  47  16.343 -27.804 -12.408
  358    HB2  ASN  47           HB2      ASN  47  16.381 -25.513 -13.377
  359    HB3  ASN  47           HB3      ASN  47  18.142 -25.597 -13.503
  360   HD21  ASN  47          1HD2      ASN  47  15.147 -27.338 -14.567
  361   HD22  ASN  47          2HD2      ASN  47  15.827 -27.832 -16.103
  362    H    SER  48           H        SER  48  19.765 -26.749 -11.911
  363    HA   SER  48           HA       SER  48  20.731 -29.543 -12.064
  364    HB2  SER  48           HB2      SER  48  21.531 -27.385 -14.057
  365    HB3  SER  48           HB3      SER  48  22.496 -28.833 -13.755
  366    HG   SER  48           HG       SER  48  21.074 -29.056 -15.563
  367    HA   PRO  49           HA       PRO  49  23.688 -27.716  -9.239
  368    HB2  PRO  49           HB2      PRO  49  25.480 -29.715  -8.889
  369    HB3  PRO  49           HB3      PRO  49  23.771 -29.909  -8.434
  370    HG2  PRO  49           HG2      PRO  49  25.095 -30.774 -11.035
  371    HG3  PRO  49           HG3      PRO  49  24.096 -31.768  -9.919
  372    HD2  PRO  49           HD2      PRO  49  23.043 -30.523 -12.122
  373    HD3  PRO  49           HD3      PRO  49  22.116 -30.725 -10.609
  374    H    THR  50           H        THR  50  23.933 -26.356 -11.460
  375    HA   THR  50           HA       THR  50  26.820 -26.173 -12.119
  376    HB   THR  50           HB       THR  50  26.038 -25.690 -14.542
  377    HG1  THR  50           HG1      THR  50  24.179 -26.936 -15.086
  378   HG21  THR  50          1HG2      THR  50  27.373 -27.659 -13.953
  379   HG22  THR  50          2HG2      THR  50  26.193 -28.030 -15.202
  380   HG23  THR  50          3HG2      THR  50  25.903 -28.556 -13.528
  381    H    ASP  51           H        ASP  51  27.474 -24.276 -13.069
  382    HA   ASP  51           HA       ASP  51  26.263 -21.819 -12.123
  383    HB2  ASP  51           HB2      ASP  51  28.672 -22.223 -12.303
  384    HB3  ASP  51           HB3      ASP  51  28.547 -22.392 -14.044
  385    HA   PRO  52           HA       PRO  52  23.428 -21.457 -15.556
  386    HB2  PRO  52           HB2      PRO  52  22.747 -18.757 -15.395
  387    HB3  PRO  52           HB3      PRO  52  22.091 -20.047 -14.366
  388    HG2  PRO  52           HG2      PRO  52  24.355 -18.141 -13.753
  389    HG3  PRO  52           HG3      PRO  52  23.011 -18.679 -12.691
  390    HD2  PRO  52           HD2      PRO  52  25.491 -19.761 -12.515
  391    HD3  PRO  52           HD3      PRO  52  24.018 -20.757 -12.305
  392    H    PHE  53           H        PHE  53  26.363 -19.542 -15.579
  393    HA   PHE  53           HA       PHE  53  25.956 -18.868 -18.477
  394    HB2  PHE  53           HB2      PHE  53  27.492 -17.351 -16.336
  395    HB3  PHE  53           HB3      PHE  53  27.284 -16.866 -18.023
  396    HD1  PHE  53           HD2      PHE  53  24.696 -16.781 -18.816
  397    HD2  PHE  53           HD1      PHE  53  26.078 -16.347 -14.756
  398    HE1  PHE  53           HE2      PHE  53  22.579 -15.624 -18.211
  399    HE2  PHE  53           HE1      PHE  53  23.956 -15.174 -14.161
  400    HZ   PHE  53           HZ       PHE  53  22.216 -14.828 -15.888
  401    H    ASN  54           H        ASN  54  28.297 -20.025 -16.053
  402    HA   ASN  54           HA       ASN  54  30.373 -20.386 -18.156
  403    HB2  ASN  54           HB2      ASN  54  30.843 -19.333 -15.902
  404    HB3  ASN  54           HB3      ASN  54  30.529 -20.892 -15.160
  405   HD21  ASN  54          1HD2      ASN  54  32.709 -21.136 -14.354
  406   HD22  ASN  54          2HD2      ASN  54  34.051 -21.375 -15.454
  407    H    ARG  55           H        ARG  55  28.080 -22.288 -16.277
  408    HA   ARG  55           HA       ARG  55  27.401 -24.377 -16.302
  409    HB2  ARG  55           HB2      ARG  55  28.648 -24.363 -19.070
  410    HB3  ARG  55           HB3      ARG  55  27.752 -25.728 -18.424
  411    HG2  ARG  55           HG2      ARG  55  26.251 -24.490 -19.750
  412    HG3  ARG  55           HG3      ARG  55  25.752 -24.311 -18.068
  413    HD2  ARG  55           HD2      ARG  55  26.689 -22.054 -18.002
  414    HD3  ARG  55           HD3      ARG  55  27.327 -22.217 -19.640
  415    HE   ARG  55           HE       ARG  55  24.635 -21.572 -18.783
  416   HH11  ARG  55          1HH1      ARG  55  26.401 -22.897 -21.564
  417   HH12  ARG  55          2HH1      ARG  55  25.165 -22.399 -22.677
  418   HH21  ARG  55          1HH2      ARG  55  23.108 -20.997 -20.242
  419   HH22  ARG  55          2HH2      ARG  55  23.307 -21.355 -21.936
  420    H    GLN  56           H        GLN  56  30.210 -23.793 -15.294
  421    HA   GLN  56           HA       GLN  56  31.426 -26.445 -14.972
  422    HB2  GLN  56           HB2      GLN  56  32.585 -25.432 -13.096
  423    HB3  GLN  56           HB3      GLN  56  32.726 -24.385 -14.505
  424    HG2  GLN  56           HG2      GLN  56  31.183 -22.776 -13.597
  425    HG3  GLN  56           HG3      GLN  56  30.598 -23.883 -12.364
  426   HE21  GLN  56          1HE2      GLN  56  31.967 -24.437 -10.534
  427   HE22  GLN  56          2HE2      GLN  56  33.271 -23.337 -10.089
  428    H    MET  57           H        MET  57  31.287 -27.619 -12.862
  429    HA   MET  57           HA       MET  57  28.623 -27.842 -11.763
  430    HB2  MET  57           HB2      MET  57  30.353 -29.667 -11.806
  431    HB3  MET  57           HB3      MET  57  31.234 -28.794 -10.542
  432    HG2  MET  57           HG2      MET  57  29.236 -28.949  -9.055
  433    HG3  MET  57           HG3      MET  57  28.357 -29.779 -10.344
  434    HE1  MET  57           HE1      MET  57  28.486 -30.826  -7.410
  435    HE2  MET  57           HE2      MET  57  27.648 -31.672  -8.735
  436    HE3  MET  57           HE3      MET  57  28.774 -32.555  -7.689
  437    H    LEU  58           H        LEU  58  27.759 -27.027  -9.918
  438    HA   LEU  58           HA       LEU  58  29.244 -25.259  -8.105
  439    HB2  LEU  58           HB2      LEU  58  28.615 -23.881 -10.104
  440    HB3  LEU  58           HB3      LEU  58  26.932 -24.237  -9.820
  441    HG   LEU  58           HG       LEU  58  27.718 -21.969  -9.159
  442   HD11  LEU  58          1HD1      LEU  58  25.646 -22.983  -8.211
  443   HD12  LEU  58          2HD1      LEU  58  26.395 -21.752  -7.198
  444   HD13  LEU  58          3HD1      LEU  58  26.572 -23.446  -6.772
  445   HD21  LEU  58          3HD2      LEU  58  29.923 -22.619  -8.187
  446   HD22  LEU  58          1HD2      LEU  58  29.076 -23.324  -6.788
  447   HD23  LEU  58          2HD2      LEU  58  28.960 -21.588  -7.118
  448    H    THR  59           H        THR  59  28.442 -25.437  -6.093
  449    HA   THR  59           HA       THR  59  25.652 -26.422  -5.633
  450    HB   THR  59           HB       THR  59  28.105 -27.271  -4.047
  451    HG1  THR  59           HG1      THR  59  27.757 -29.267  -5.053
  452   HG21  THR  59          1HG2      THR  59  26.535 -29.015  -3.143
  453   HG22  THR  59          2HG2      THR  59  25.184 -28.172  -3.940
  454   HG23  THR  59          3HG2      THR  59  26.118 -27.378  -2.644
  455    H    GLU  60           H        GLU  60  24.680 -25.618  -3.729
  456    HA   GLU  60           HA       GLU  60  25.100 -22.909  -3.208
  457    HB2  GLU  60           HB2      GLU  60  23.466 -23.135  -1.440
  458    HB3  GLU  60           HB3      GLU  60  22.977 -24.090  -2.828
  459    HG2  GLU  60           HG2      GLU  60  23.879 -26.159  -1.660
  460    HG3  GLU  60           HG3      GLU  60  24.252 -25.159  -0.261
  461    H    SER  61           H        SER  61  26.764 -25.583  -1.654
  462    HA   SER  61           HA       SER  61  27.618 -24.326   0.738
  463    HB2  SER  61           HB2      SER  61  29.084 -26.405  -0.939
  464    HB3  SER  61           HB3      SER  61  29.294 -26.104   0.789
  465    HG   SER  61           HG       SER  61  27.937 -27.907   0.422
  466    H    MET  62           H        MET  62  28.733 -23.807  -2.550
  467    HA   MET  62           HA       MET  62  31.274 -22.545  -1.698
  468    HB2  MET  62           HB2      MET  62  30.061 -22.991  -4.466
  469    HB3  MET  62           HB3      MET  62  31.643 -22.293  -4.116
  470    HG2  MET  62           HG2      MET  62  32.178 -24.465  -4.648
  471    HG3  MET  62           HG3      MET  62  32.231 -24.438  -2.884
  472    HE1  MET  62           HE1      MET  62  32.297 -27.036  -2.771
  473    HE2  MET  62           HE2      MET  62  31.185 -28.109  -3.650
  474    HE3  MET  62           HE3      MET  62  32.318 -27.085  -4.549
  475    H    LEU  63           H        LEU  63  28.095 -21.484  -1.862
  476    HA   LEU  63           HA       LEU  63  28.657 -18.800  -2.992
  477    HB2  LEU  63           HB2      LEU  63  26.093 -20.073  -1.938
  478    HB3  LEU  63           HB3      LEU  63  26.216 -18.488  -2.693
  479    HG   LEU  63           HG       LEU  63  26.781 -21.157  -4.061
  480   HD11  LEU  63          1HD1      LEU  63  24.544 -19.130  -4.475
  481   HD12  LEU  63          2HD1      LEU  63  24.375 -20.674  -3.609
  482   HD13  LEU  63          3HD1      LEU  63  24.758 -20.665  -5.333
  483   HD21  LEU  63          3HD2      LEU  63  28.249 -19.489  -5.064
  484   HD22  LEU  63          1HD2      LEU  63  26.911 -18.325  -5.181
  485   HD23  LEU  63          2HD2      LEU  63  26.913 -19.800  -6.164
  486    H    GLU  64           H        GLU  64  28.256 -16.883  -1.937
  487    HA   GLU  64           HA       GLU  64  27.855 -16.750   0.974
  488    HB2  GLU  64           HB2      GLU  64  30.260 -17.215   0.775
  489    HB3  GLU  64           HB3      GLU  64  30.446 -15.930  -0.420
  490    HG2  GLU  64           HG2      GLU  64  29.868 -14.236   1.301
  491    HG3  GLU  64           HG3      GLU  64  29.635 -15.519   2.495
  492    HA   PRO  65           HA       PRO  65  25.955 -13.060  -0.845
  493    HB2  PRO  65           HB2      PRO  65  25.027 -11.769   1.369
  494    HB3  PRO  65           HB3      PRO  65  24.296 -13.281   0.759
  495    HG2  PRO  65           HG2      PRO  65  26.340 -12.980   2.975
  496    HG3  PRO  65           HG3      PRO  65  24.816 -13.922   2.999
  497    HD2  PRO  65           HD2      PRO  65  27.237 -15.084   2.454
  498    HD3  PRO  65           HD3      PRO  65  25.751 -15.624   1.634
  499    H    VAL  66           H        VAL  66  26.625 -10.979  -1.359
  500    HA   VAL  66           HA       VAL  66  29.265 -10.155  -0.297
  501    HB   VAL  66           HB       VAL  66  27.720  -9.010  -2.650
  502   HG11  VAL  66          1HG1      VAL  66  30.604  -8.618  -1.743
  503   HG12  VAL  66          2HG1      VAL  66  29.918  -8.016  -3.253
  504   HG13  VAL  66          3HG1      VAL  66  29.336  -7.377  -1.710
  505   HG21  VAL  66          3HG2      VAL  66  28.369 -11.349  -3.075
  506   HG22  VAL  66          1HG2      VAL  66  29.331 -10.227  -4.043
  507   HG23  VAL  66          2HG2      VAL  66  30.038 -10.965  -2.591
  508    HA   PRO  67           HA       PRO  67  26.855  -7.087   2.093
  509    HB2  PRO  67           HB2      PRO  67  28.706  -6.367   3.950
  510    HB3  PRO  67           HB3      PRO  67  27.867  -7.942   3.998
  511    HG2  PRO  67           HG2      PRO  67  30.628  -7.354   2.889
  512    HG3  PRO  67           HG3      PRO  67  30.131  -8.672   3.997
  513    HD2  PRO  67           HD2      PRO  67  30.361  -9.009   1.277
  514    HD3  PRO  67           HD3      PRO  67  29.148  -9.889   2.267
  515    H    GLU  68           H        GLU  68  30.150  -6.461   0.776
  516    HA   GLU  68           HA       GLU  68  29.995  -3.635   1.077
  517    HB2  GLU  68           HB2      GLU  68  31.965  -3.520  -0.314
  518    HB3  GLU  68           HB3      GLU  68  32.107  -4.805   0.888
  519    HG2  GLU  68           HG2      GLU  68  31.626  -6.501  -0.828
  520    HG3  GLU  68           HG3      GLU  68  31.389  -5.245  -2.050
  521    H    LEU  69           H        LEU  69  28.552  -5.672  -1.331
  522    HA   LEU  69           HA       LEU  69  27.839  -3.313  -3.034
  523    HB2  LEU  69           HB2      LEU  69  27.483  -6.313  -3.395
  524    HB3  LEU  69           HB3      LEU  69  26.715  -5.119  -4.438
  525    HG   LEU  69           HG       LEU  69  29.722  -5.420  -4.064
  526   HD11  LEU  69          1HD1      LEU  69  27.893  -6.201  -6.387
  527   HD12  LEU  69          2HD1      LEU  69  28.678  -7.328  -5.252
  528   HD13  LEU  69          3HD1      LEU  69  29.662  -6.358  -6.354
  529   HD21  LEU  69          3HD2      LEU  69  28.083  -3.665  -5.957
  530   HD22  LEU  69          1HD2      LEU  69  29.841  -3.932  -6.092
  531   HD23  LEU  69          2HD2      LEU  69  29.189  -3.093  -4.691
  532    H    LYS  70           H        LYS  70  26.266  -5.864  -1.010
  533    HA   LYS  70           HA       LYS  70  23.637  -4.895  -1.440
  534    HB2  LYS  70           HB2      LYS  70  24.277  -7.116  -0.478
  535    HB3  LYS  70           HB3      LYS  70  24.664  -6.313   1.063
  536    HG2  LYS  70           HG2      LYS  70  22.327  -5.487   1.218
  537    HG3  LYS  70           HG3      LYS  70  21.963  -6.185  -0.371
  538    HD2  LYS  70           HD2      LYS  70  22.352  -8.472   0.546
  539    HD3  LYS  70           HD3      LYS  70  22.806  -7.758   2.097
  540    HE2  LYS  70           HE2      LYS  70  20.531  -8.422   2.359
  541    HE3  LYS  70           HE3      LYS  70  20.529  -6.657   2.202
  542    HZ1  LYS  70           HZ1      LYS  70  18.815  -7.515   0.839
  543    HZ2  LYS  70           HZ2      LYS  70  19.757  -8.650   0.141
  544    HZ3  LYS  70           HZ3      LYS  70  19.979  -7.073  -0.230
  545    H    GLU  71           H        GLU  71  26.023  -3.847   0.993
  546    HA   GLU  71           HA       GLU  71  24.309  -2.052   2.413
  547    HB2  GLU  71           HB2      GLU  71  26.444  -2.968   3.251
  548    HB3  GLU  71           HB3      GLU  71  27.330  -1.982   2.070
  549    HG2  GLU  71           HG2      GLU  71  26.477   0.073   3.147
  550    HG3  GLU  71           HG3      GLU  71  25.495  -0.898   4.255
  551    H    GLN  72           H        GLN  72  26.297  -1.614  -0.524
  552    HA   GLN  72           HA       GLN  72  25.763   1.260  -0.752
  553    HB2  GLN  72           HB2      GLN  72  26.863  -0.806  -2.707
  554    HB3  GLN  72           HB3      GLN  72  26.622   0.901  -3.093
  555    HG2  GLN  72           HG2      GLN  72  28.120   1.556  -1.208
  556    HG3  GLN  72           HG3      GLN  72  28.444  -0.151  -0.894
  557   HE21  GLN  72          1HE2      GLN  72  29.787  -1.339  -2.406
  558   HE22  GLN  72          2HE2      GLN  72  30.698  -0.487  -3.665
  559    H    ILE  73           H        ILE  73  24.386  -1.694  -2.232
  560    HA   ILE  73           HA       ILE  73  22.451  -0.434  -3.889
  561    HB   ILE  73           HB       ILE  73  22.639  -3.168  -2.584
  562   HG12  ILE  73          2HG1      ILE  73  22.774  -2.307  -5.503
  563   HG13  ILE  73          3HG1      ILE  73  24.193  -2.422  -4.474
  564   HG21  ILE  73          1HG2      ILE  73  20.266  -2.880  -2.763
  565   HG22  ILE  73          2HG2      ILE  73  20.405  -2.125  -4.361
  566   HG23  ILE  73          3HG2      ILE  73  20.756  -3.851  -4.147
  567   HD11  ILE  73          3HD1      ILE  73  24.102  -4.419  -5.767
  568   HD12  ILE  73          1HD1      ILE  73  23.693  -4.856  -4.097
  569   HD13  ILE  73          2HD1      ILE  73  22.415  -4.743  -5.329
  570    H    GLN  74           H        GLN  74  21.996  -1.600  -0.492
  571    HA   GLN  74           HA       GLN  74  19.266  -0.789  -0.424
  572    HB2  GLN  74           HB2      GLN  74  19.339  -1.221   1.948
  573    HB3  GLN  74           HB3      GLN  74  20.222  -2.457   1.054
  574    HG2  GLN  74           HG2      GLN  74  21.612  -2.113   2.869
  575    HG3  GLN  74           HG3      GLN  74  22.357  -1.127   1.635
  576   HE21  GLN  74          1HE2      GLN  74  23.269   0.604   2.698
  577   HE22  GLN  74          2HE2      GLN  74  22.438   1.549   3.930
  578    H    ALA  75           H        ALA  75  22.211   1.090   0.280
  579    HA   ALA  75           HA       ALA  75  20.828   3.399   1.337
  580    HB1  ALA  75           HB1      ALA  75  23.237   2.974   1.711
  581    HB2  ALA  75           HB2      ALA  75  23.548   3.107  -0.032
  582    HB3  ALA  75           HB3      ALA  75  23.002   4.521   0.888
  583    H    TRP  76           H        TRP  76  21.916   2.469  -1.974
  584    HA   TRP  76           HA       TRP  76  21.009   4.858  -3.268
  585    HB2  TRP  76           HB2      TRP  76  22.664   3.197  -4.164
  586    HB3  TRP  76           HB3      TRP  76  21.337   2.070  -4.447
  587    HD1  TRP  76           HD1      TRP  76  22.689   5.472  -5.598
  588    HE1  TRP  76           HE1      TRP  76  21.796   6.036  -7.935
  589    HE3  TRP  76           HE3      TRP  76  19.474   1.529  -6.199
  590    HZ2  TRP  76           HZ2      TRP  76  19.903   4.936  -9.826
  591    HZ3  TRP  76           HZ3      TRP  76  18.142   1.318  -8.284
  592    HH2  TRP  76           HH2      TRP  76  18.327   3.020 -10.079
  593    H    MET  77           H        MET  77  19.379   1.673  -2.785
  594    HA   MET  77           HA       MET  77  16.903   2.362  -4.070
  595    HB2  MET  77           HB2      MET  77  17.538   0.405  -1.831
  596    HB3  MET  77           HB3      MET  77  15.951   0.548  -2.592
  597    HG2  MET  77           HG2      MET  77  16.958   0.011  -4.802
  598    HG3  MET  77           HG3      MET  77  18.536  -0.120  -4.046
  599    HE1  MET  77           HE1      MET  77  15.157  -1.732  -4.818
  600    HE2  MET  77           HE2      MET  77  15.053  -3.125  -3.726
  601    HE3  MET  77           HE3      MET  77  14.887  -1.469  -3.080
  602    H    ARG  78           H        ARG  78  17.915   2.732  -0.610
  603    HA   ARG  78           HA       ARG  78  15.516   3.883   0.332
  604    HB2  ARG  78           HB2      ARG  78  17.296   3.087   1.753
  605    HB3  ARG  78           HB3      ARG  78  18.384   4.370   1.237
  606    HG2  ARG  78           HG2      ARG  78  15.706   5.022   2.516
  607    HG3  ARG  78           HG3      ARG  78  17.084   4.521   3.503
  608    HD2  ARG  78           HD2      ARG  78  18.446   6.370   2.609
  609    HD3  ARG  78           HD3      ARG  78  17.068   6.941   1.660
  610    HE   ARG  78           HE       ARG  78  16.202   6.720   4.334
  611   HH11  ARG  78          1HH1      ARG  78  18.496   8.728   2.530
  612   HH12  ARG  78          2HH1      ARG  78  18.317  10.066   3.627
  613   HH21  ARG  78          1HH2      ARG  78  16.027   8.477   5.706
  614   HH22  ARG  78          2HH2      ARG  78  16.946   9.921   5.395
  615    H    GLU  79           H        GLU  79  18.345   5.574  -1.133
  616    HA   GLU  79           HA       GLU  79  17.213   8.193  -0.983
  617    HB2  GLU  79           HB2      GLU  79  19.605   7.682  -1.317
  618    HB3  GLU  79           HB3      GLU  79  19.267   7.120  -2.960
  619    HG2  GLU  79           HG2      GLU  79  18.474   9.379  -3.577
  620    HG3  GLU  79           HG3      GLU  79  18.675   9.925  -1.913
  621    H    LYS  80           H        LYS  80  17.128   5.780  -3.664
  622    HA   LYS  80           HA       LYS  80  15.611   7.297  -5.521
  623    HB2  LYS  80           HB2      LYS  80  15.908   4.325  -4.960
  624    HB3  LYS  80           HB3      LYS  80  14.926   4.904  -6.280
  625    HG2  LYS  80           HG2      LYS  80  17.856   5.640  -6.002
  626    HG3  LYS  80           HG3      LYS  80  17.307   4.194  -6.818
  627    HD2  LYS  80           HD2      LYS  80  16.415   6.999  -7.640
  628    HD3  LYS  80           HD3      LYS  80  17.808   6.152  -8.330
  629    HE2  LYS  80           HE2      LYS  80  16.357   4.263  -9.023
  630    HE3  LYS  80           HE3      LYS  80  14.943   5.096  -8.370
  631    HZ1  LYS  80           HZ1      LYS  80  16.643   6.139 -10.562
  632    HZ2  LYS  80           HZ2      LYS  80  15.287   6.855  -9.978
  633    HZ3  LYS  80           HZ3      LYS  80  15.178   5.416 -10.748
  634    H    GLN  81           H        GLN  81  14.490   5.290  -2.793
  635    HA   GLN  81           HA       GLN  81  11.657   5.699  -3.394
  636    HB2  GLN  81           HB2      GLN  81  13.141   4.525  -1.013
  637    HB3  GLN  81           HB3      GLN  81  11.383   4.640  -1.112
  638    HG2  GLN  81           HG2      GLN  81  11.338   3.253  -3.125
  639    HG3  GLN  81           HG3      GLN  81  13.102   3.149  -3.149
  640   HE21  GLN  81          1HE2      GLN  81  10.172   2.154  -1.315
  641   HE22  GLN  81          2HE2      GLN  81  10.981   0.844  -0.468
  642    H    SER  82           H        SER  82  13.952   7.257  -1.020
  643    HA   SER  82           HA       SER  82  11.808   8.822   0.144
  644    HB2  SER  82           HB2      SER  82  13.528   9.937   1.388
  645    HB3  SER  82           HB3      SER  82  13.825   8.190   1.388
  646    HG   SER  82           HG       SER  82  15.724   9.528   1.019
  647    H    SER  83           H        SER  83  13.931   9.377  -2.606
  648    HA   SER  83           HA       SER  83  13.248  12.210  -2.904
  649    HB2  SER  83           HB2      SER  83  14.474  10.271  -4.903
  650    HB3  SER  83           HB3      SER  83  14.420  12.038  -5.034
  651    HG   SER  83           HG       SER  83  15.883  10.414  -3.229
  652    H    ASP  84           H        ASP  84  11.374   9.439  -3.483
  653    HA   ASP  84           HA       ASP  84  10.161  10.127  -6.002
  654    HB2  ASP  84           HB2      ASP  84  10.239   7.845  -5.051
  655    HB3  ASP  84           HB3      ASP  84   9.154   8.356  -3.747
  656    H    HIS  85           H        HIS  85   8.214  11.073  -6.485
  657    HA   HIS  85           HA       HIS  85   6.397  12.188  -4.518
  658    HB2  HIS  85           HB2      HIS  85   8.306  13.833  -4.580
  659    HB3  HIS  85           HB3      HIS  85   7.979  14.085  -6.294
  660    HD1  HIS  85           HD1      HIS  85   4.645  14.047  -5.484
  661    HD2  HIS  85           HD2      HIS  85   7.810  16.512  -4.249
  662    HE1  HIS  85           HE1      HIS  85   3.571  16.249  -4.710
  Start of MODEL    7
    1    H2   PRO   1           H2       PRO   1   0.655   1.676  -1.253
    2    H3   PRO   1           H3       PRO   1   1.364   1.236   0.162
    3    HA   PRO   1           HA       PRO   1   0.753  -1.000  -0.086
    4    HB2  PRO   1           HB2      PRO   1  -0.883  -0.392  -2.549
    5    HB3  PRO   1           HB3      PRO   1  -1.102  -1.661  -1.312
    6    HG2  PRO   1           HG2      PRO   1  -2.207   1.038  -1.375
    7    HG3  PRO   1           HG3      PRO   1  -2.429  -0.171  -0.073
    8    HD2  PRO   1           HD2      PRO   1  -1.040   2.169   0.327
    9    HD3  PRO   1           HD3      PRO   1  -0.672   0.647   1.174
   10    H    GLY   2           H        GLY   2   1.263  -2.649  -1.903
   11    HA2  GLY   2           HA2      GLY   2   3.849  -1.913  -3.035
   12    HA3  GLY   2           HA3      GLY   2   3.067  -3.512  -3.050
   13    H    SER   3           H        SER   3   0.781  -1.536  -4.298
   14    HA   SER   3           HA       SER   3   1.038  -2.425  -6.981
   15    HB2  SER   3           HB2      SER   3  -0.616  -0.099  -5.933
   16    HB3  SER   3           HB3      SER   3  -0.941  -1.061  -7.377
   17    HG   SER   3           HG       SER   3  -1.386  -2.845  -6.033
   18    H    ALA   4           H        ALA   4   2.606   0.227  -5.494
   19    HA   ALA   4           HA       ALA   4   3.485   1.306  -8.131
   20    HB1  ALA   4           HB1      ALA   4   2.771   2.927  -5.641
   21    HB2  ALA   4           HB2      ALA   4   3.466   3.580  -7.143
   22    HB3  ALA   4           HB3      ALA   4   1.838   2.883  -7.152
   23    H    GLU   5           H        GLU   5   5.579   2.287  -8.076
   24    HA   GLU   5           HA       GLU   5   7.452   1.917  -5.910
   25    HB2  GLU   5           HB2      GLU   5   8.834   0.172  -6.912
   26    HB3  GLU   5           HB3      GLU   5   7.220  -0.428  -6.558
   27    HG2  GLU   5           HG2      GLU   5   6.624  -0.056  -8.999
   28    HG3  GLU   5           HG3      GLU   5   8.310   0.360  -9.297
   29    H    ILE   6           H        ILE   6   9.674   2.423  -6.564
   30    HA   ILE   6           HA       ILE   6   9.816   4.554  -8.624
   31    HB   ILE   6           HB       ILE   6  11.767   3.618  -6.480
   32   HG12  ILE   6          2HG1      ILE   6  11.533   6.071  -5.760
   33   HG13  ILE   6          3HG1      ILE   6  10.177   6.195  -6.864
   34   HG21  ILE   6          1HG2      ILE   6  13.191   5.539  -7.176
   35   HG22  ILE   6          2HG2      ILE   6  13.106   4.272  -8.394
   36   HG23  ILE   6          3HG2      ILE   6  12.151   5.755  -8.600
   37   HD11  ILE   6          3HD1      ILE   6   9.603   5.849  -4.426
   38   HD12  ILE   6          1HD1      ILE   6   8.877   4.646  -5.489
   39   HD13  ILE   6          2HD1      ILE   6  10.329   4.243  -4.517
   40    H    ASP   7           H        ASP   7  10.907   4.368 -10.532
   41    HA   ASP   7           HA       ASP   7  11.602   1.703 -11.494
   42    HB2  ASP   7           HB2      ASP   7  10.403   3.481 -12.826
   43    HB3  ASP   7           HB3      ASP   7  11.922   4.397 -12.875
   44    H    TYR   8           H        TYR   8  13.551   0.786 -11.394
   45    HA   TYR   8           HA       TYR   8  15.936   2.432 -10.705
   46    HB2  TYR   8           HB2      TYR   8  15.447  -0.532 -10.258
   47    HB3  TYR   8           HB3      TYR   8  16.837   0.399  -9.734
   48    HD1  TYR   8           HD2      TYR   8  15.849   2.816  -8.474
   49    HD2  TYR   8           HD1      TYR   8  14.236  -1.189  -8.356
   50    HE1  TYR   8           HE2      TYR   8  14.806   3.299  -6.285
   51    HE2  TYR   8           HE1      TYR   8  13.187  -0.694  -6.160
   52    HH   TYR   8           HH       TYR   8  13.555   2.493  -4.538
   53    H    SER   9           H        SER   9  14.930   1.870 -13.584
   54    HA   SER   9           HA       SER   9  17.007   0.356 -14.889
   55    HB2  SER   9           HB2      SER   9  15.541   2.795 -15.952
   56    HB3  SER   9           HB3      SER   9  16.426   1.598 -16.896
   57    HG   SER   9           HG       SER   9  13.988   1.311 -15.492
   58    H    ASP  10           H        ASP  10  17.161   3.423 -13.290
   59    HA   ASP  10           HA       ASP  10  19.547   4.469 -14.573
   60    HB2  ASP  10           HB2      ASP  10  17.770   5.805 -13.440
   61    HB3  ASP  10           HB3      ASP  10  18.225   5.084 -11.898
   62    H    ALA  11           H        ALA  11  19.145   1.817 -12.434
   63    HA   ALA  11           HA       ALA  11  21.355   2.163 -10.682
   64    HB1  ALA  11           HB1      ALA  11  21.084  -0.232 -10.214
   65    HB2  ALA  11           HB2      ALA  11  19.521   0.591 -10.251
   66    HB3  ALA  11           HB3      ALA  11  20.026  -0.400 -11.638
   67    HA   PRO  12           HA       PRO  12  24.808   1.239 -13.381
   68    HB2  PRO  12           HB2      PRO  12  26.769   0.650 -11.589
   69    HB3  PRO  12           HB3      PRO  12  26.089   2.302 -11.748
   70    HG2  PRO  12           HG2      PRO  12  25.287   0.144  -9.753
   71    HG3  PRO  12           HG3      PRO  12  25.734   1.854  -9.410
   72    HD2  PRO  12           HD2      PRO  12  23.139   1.070  -9.660
   73    HD3  PRO  12           HD3      PRO  12  23.684   2.652 -10.275
   74    H    ASP  13           H        ASP  13  26.103  -0.514 -14.133
   75    HA   ASP  13           HA       ASP  13  24.775  -2.990 -14.288
   76    HB2  ASP  13           HB2      ASP  13  26.319  -2.009 -15.971
   77    HB3  ASP  13           HB3      ASP  13  27.682  -2.304 -14.892
   78    H    GLU  14           H        GLU  14  27.205  -1.982 -11.967
   79    HA   GLU  14           HA       GLU  14  27.916  -4.629 -11.034
   80    HB2  GLU  14           HB2      GLU  14  29.120  -3.516  -9.285
   81    HB3  GLU  14           HB3      GLU  14  29.410  -2.698 -10.821
   82    HG2  GLU  14           HG2      GLU  14  27.647  -0.981 -10.142
   83    HG3  GLU  14           HG3      GLU  14  27.626  -1.744  -8.545
   84    H    PHE  15           H        PHE  15  25.113  -2.706 -10.495
   85    HA   PHE  15           HA       PHE  15  24.307  -4.291  -8.090
   86    HB2  PHE  15           HB2      PHE  15  23.079  -1.826  -9.361
   87    HB3  PHE  15           HB3      PHE  15  22.429  -2.665  -7.974
   88    HD1  PHE  15           HD1      PHE  15  25.746  -2.861  -7.065
   89    HD2  PHE  15           HD2      PHE  15  22.634   0.062  -7.697
   90    HE1  PHE  15           HE1      PHE  15  26.915  -1.298  -5.561
   91    HE2  PHE  15           HE2      PHE  15  23.823   1.636  -6.196
   92    HZ   PHE  15           HZ       PHE  15  25.970   0.970  -5.133
   93    H    ARG  16           H        ARG  16  24.174  -4.674 -11.383
   94    HA   ARG  16           HA       ARG  16  21.378  -5.756 -11.413
   95    HB2  ARG  16           HB2      ARG  16  23.075  -4.454 -13.552
   96    HB3  ARG  16           HB3      ARG  16  21.601  -5.350 -13.924
   97    HG2  ARG  16           HG2      ARG  16  20.200  -3.790 -12.838
   98    HG3  ARG  16           HG3      ARG  16  21.506  -3.136 -11.863
   99    HD2  ARG  16           HD2      ARG  16  20.863  -1.518 -13.495
  100    HD3  ARG  16           HD3      ARG  16  22.503  -2.068 -13.830
  101    HE   ARG  16           HE       ARG  16  20.819  -3.644 -15.427
  102   HH11  ARG  16          1HH1      ARG  16  21.523  -0.187 -15.109
  103   HH12  ARG  16          2HH1      ARG  16  21.217   0.120 -16.802
  104   HH21  ARG  16          1HH2      ARG  16  20.531  -3.199 -17.619
  105   HH22  ARG  16          2HH2      ARG  16  20.649  -1.560 -18.192
  106    H    ASP  17           H        ASP  17  20.968  -7.732 -12.325
  107    HA   ASP  17           HA       ASP  17  23.294  -9.540 -12.819
  108    HB2  ASP  17           HB2      ASP  17  21.547 -10.210 -11.200
  109    HB3  ASP  17           HB3      ASP  17  20.361 -10.243 -12.516
  110    HA   PRO  18           HA       PRO  18  22.593  -8.876 -17.102
  111    HB2  PRO  18           HB2      PRO  18  24.103 -10.868 -18.276
  112    HB3  PRO  18           HB3      PRO  18  24.759  -9.397 -17.490
  113    HG2  PRO  18           HG2      PRO  18  24.452 -12.168 -16.306
  114    HG3  PRO  18           HG3      PRO  18  25.864 -11.080 -16.231
  115    HD2  PRO  18           HD2      PRO  18  24.079 -11.274 -14.183
  116    HD3  PRO  18           HD3      PRO  18  24.829  -9.713 -14.608
  117    H    LEU  19           H        LEU  19  21.272 -11.814 -15.697
  118    HA   LEU  19           HA       LEU  19  19.963 -12.653 -18.198
  119    HB2  LEU  19           HB2      LEU  19  20.349 -14.338 -16.483
  120    HB3  LEU  19           HB3      LEU  19  19.484 -13.390 -15.282
  121    HG   LEU  19           HG       LEU  19  17.380 -13.738 -16.577
  122   HD11  LEU  19          1HD1      LEU  19  17.320 -15.429 -18.396
  123   HD12  LEU  19          2HD1      LEU  19  19.097 -15.554 -18.343
  124   HD13  LEU  19          3HD1      LEU  19  18.311 -14.043 -18.847
  125   HD21  LEU  19          3HD2      LEU  19  17.142 -16.162 -16.061
  126   HD22  LEU  19          1HD2      LEU  19  17.920 -15.252 -14.752
  127   HD23  LEU  19          2HD2      LEU  19  18.899 -16.270 -15.843
  128    H    MET  20           H        MET  20  18.788 -11.171 -15.149
  129    HA   MET  20           HA       MET  20  16.245 -10.428 -16.424
  130    HB2  MET  20           HB2      MET  20  17.308 -10.055 -13.586
  131    HB3  MET  20           HB3      MET  20  15.668  -9.649 -14.114
  132    HG2  MET  20           HG2      MET  20  16.907 -12.419 -14.245
  133    HG3  MET  20           HG3      MET  20  15.783 -11.850 -13.021
  134    HE1  MET  20           HE1      MET  20  14.373 -14.023 -13.423
  135    HE2  MET  20           HE2      MET  20  13.755 -14.524 -15.015
  136    HE3  MET  20           HE3      MET  20  15.492 -14.538 -14.701
  137    H    ASP  21           H        ASP  21  19.211  -8.758 -15.943
  138    HA   ASP  21           HA       ASP  21  19.953  -6.746 -16.457
  139    HB2  ASP  21           HB2      ASP  21  18.833  -7.359 -18.599
  140    HB3  ASP  21           HB3      ASP  21  17.429  -6.393 -18.117
  141    H    THR  22           H        THR  22  18.300  -6.984 -14.065
  142    HA   THR  22           HA       THR  22  17.751  -4.122 -13.509
  143    HB   THR  22           HB       THR  22  15.648  -5.265 -14.261
  144    HG1  THR  22           HG1      THR  22  14.503  -4.239 -12.618
  145   HG21  THR  22          1HG2      THR  22  15.769  -6.663 -11.546
  146   HG22  THR  22          2HG2      THR  22  16.042  -7.474 -13.101
  147   HG23  THR  22          3HG2      THR  22  14.469  -6.748 -12.741
  148    H    LEU  23           H        LEU  23  17.192  -3.884 -11.135
  149    HA   LEU  23           HA       LEU  23  19.632  -4.390  -9.807
  150    HB2  LEU  23           HB2      LEU  23  17.649  -2.557  -9.605
  151    HB3  LEU  23           HB3      LEU  23  17.222  -3.550  -8.226
  152    HG   LEU  23           HG       LEU  23  19.882  -2.169  -8.750
  153   HD11  LEU  23          1HD1      LEU  23  17.721  -1.570  -6.701
  154   HD12  LEU  23          2HD1      LEU  23  18.086  -0.630  -8.158
  155   HD13  LEU  23          3HD1      LEU  23  19.280  -0.724  -6.858
  156   HD21  LEU  23          3HD2      LEU  23  19.016  -3.735  -6.269
  157   HD22  LEU  23          1HD2      LEU  23  20.507  -2.786  -6.447
  158   HD23  LEU  23          2HD2      LEU  23  20.280  -4.238  -7.416
  159    H    MET  24           H        MET  24  20.340  -6.153  -8.739
  160    HA   MET  24           HA       MET  24  18.600  -8.432  -8.436
  161    HB2  MET  24           HB2      MET  24  20.619  -9.625  -7.684
  162    HB3  MET  24           HB3      MET  24  20.801  -8.789  -9.235
  163    HG2  MET  24           HG2      MET  24  22.039  -6.975  -8.043
  164    HG3  MET  24           HG3      MET  24  21.910  -7.886  -6.537
  165    HE1  MET  24           HE1      MET  24  24.504  -6.897  -7.186
  166    HE2  MET  24           HE2      MET  24  25.648  -7.889  -8.129
  167    HE3  MET  24           HE3      MET  24  24.436  -6.893  -8.960
  168    H    THR  25           H        THR  25  19.697  -6.124  -6.121
  169    HA   THR  25           HA       THR  25  19.540  -5.756  -3.920
  170    HB   THR  25           HB       THR  25  17.480  -6.188  -2.772
  171    HG1  THR  25           HG1      THR  25  15.821  -7.309  -3.822
  172   HG21  THR  25          1HG2      THR  25  16.010  -4.946  -4.255
  173   HG22  THR  25          2HG2      THR  25  16.998  -5.376  -5.681
  174   HG23  THR  25          3HG2      THR  25  17.650  -4.324  -4.395
  175    H    ASP  26           H        ASP  26  19.652  -9.118  -4.605
  176    HA   ASP  26           HA       ASP  26  21.073  -9.587  -2.004
  177    HB2  ASP  26           HB2      ASP  26  19.175 -11.418  -3.520
  178    HB3  ASP  26           HB3      ASP  26  20.281 -11.958  -2.256
  179    HA   PRO  27           HA       PRO  27  24.000 -10.419  -5.526
  180    HB2  PRO  27           HB2      PRO  27  26.155  -9.077  -4.504
  181    HB3  PRO  27           HB3      PRO  27  24.881  -8.297  -5.471
  182    HG2  PRO  27           HG2      PRO  27  25.110  -8.359  -2.446
  183    HG3  PRO  27           HG3      PRO  27  24.776  -6.952  -3.514
  184    HD2  PRO  27           HD2      PRO  27  22.792  -8.288  -2.253
  185    HD3  PRO  27           HD3      PRO  27  22.572  -7.660  -3.914
  186    H    VAL  28           H        VAL  28  25.099 -12.294  -5.458
  187    HA   VAL  28           HA       VAL  28  26.298 -13.311  -2.900
  188    HB   VAL  28           HB       VAL  28  24.634 -14.756  -4.999
  189   HG11  VAL  28          1HG1      VAL  28  25.030 -16.836  -3.739
  190   HG12  VAL  28          2HG1      VAL  28  26.514 -16.245  -4.482
  191   HG13  VAL  28          3HG1      VAL  28  26.246 -16.002  -2.747
  192   HG21  VAL  28          3HG2      VAL  28  24.325 -14.525  -1.970
  193   HG22  VAL  28          1HG2      VAL  28  23.376 -13.619  -3.159
  194   HG23  VAL  28          2HG2      VAL  28  23.235 -15.378  -3.076
  195    H    ARG  29           H        ARG  29  28.321 -14.028  -3.031
  196    HA   ARG  29           HA       ARG  29  29.827 -13.743  -5.541
  197    HB2  ARG  29           HB2      ARG  29  30.637 -12.736  -3.487
  198    HB3  ARG  29           HB3      ARG  29  30.655 -14.302  -2.663
  199    HG2  ARG  29           HG2      ARG  29  32.437 -15.086  -4.155
  200    HG3  ARG  29           HG3      ARG  29  32.352 -13.580  -5.100
  201    HD2  ARG  29           HD2      ARG  29  33.037 -12.304  -3.083
  202    HD3  ARG  29           HD3      ARG  29  33.035 -13.785  -2.135
  203    HE   ARG  29           HE       ARG  29  34.930 -14.605  -3.322
  204   HH11  ARG  29          1HH1      ARG  29  34.269 -11.237  -4.218
  205   HH12  ARG  29          2HH1      ARG  29  35.889 -11.001  -4.807
  206   HH21  ARG  29          1HH2      ARG  29  36.975 -14.219  -4.112
  207   HH22  ARG  29          2HH2      ARG  29  37.393 -12.651  -4.737
  208    H    LEU  30           H        LEU  30  30.562 -15.334  -6.715
  209    HA   LEU  30           HA       LEU  30  30.187 -18.201  -6.024
  210    HB2  LEU  30           HB2      LEU  30  31.027 -16.815  -8.620
  211    HB3  LEU  30           HB3      LEU  30  30.629 -18.508  -8.452
  212    HG   LEU  30           HG       LEU  30  28.736 -16.139  -8.275
  213   HD11  LEU  30          1HD1      LEU  30  27.646 -17.304 -10.162
  214   HD12  LEU  30          2HD1      LEU  30  28.882 -18.571 -10.103
  215   HD13  LEU  30          3HD1      LEU  30  29.325 -16.906 -10.530
  216   HD21  LEU  30          3HD2      LEU  30  28.096 -19.050  -7.659
  217   HD22  LEU  30          1HD2      LEU  30  26.902 -17.762  -7.917
  218   HD23  LEU  30          2HD2      LEU  30  27.988 -17.676  -6.533
  219    HA   PRO  31           HA       PRO  31  34.434 -18.837  -5.082
  220    HB2  PRO  31           HB2      PRO  31  35.149 -21.213  -6.279
  221    HB3  PRO  31           HB3      PRO  31  34.059 -21.088  -4.867
  222    HG2  PRO  31           HG2      PRO  31  33.288 -21.284  -7.799
  223    HG3  PRO  31           HG3      PRO  31  32.672 -22.256  -6.424
  224    HD2  PRO  31           HD2      PRO  31  31.295 -20.142  -7.326
  225    HD3  PRO  31           HD3      PRO  31  31.430 -20.401  -5.565
  226    H    SER  32           H        SER  32  33.649 -18.679  -8.523
  227    HA   SER  32           HA       SER  32  36.332 -18.277  -9.543
  228    HB2  SER  32           HB2      SER  32  35.012 -17.391 -11.500
  229    HB3  SER  32           HB3      SER  32  34.545 -19.019 -10.986
  230    HG   SER  32           HG       SER  32  32.706 -17.691 -11.356
  231    H    GLY  33           H        GLY  33  34.404 -16.323  -7.532
  232    HA2  GLY  33           HA2      GLY  33  34.875 -14.184  -6.700
  233    HA3  GLY  33           HA3      GLY  33  35.956 -13.848  -8.083
  234    H    THR  34           H        THR  34  33.313 -15.054  -9.552
  235    HA   THR  34           HA       THR  34  32.231 -12.542 -10.449
  236    HB   THR  34           HB       THR  34  31.238 -15.407 -10.745
  237    HG1  THR  34           HG1      THR  34  32.297 -15.171 -12.763
  238   HG21  THR  34          1HG2      THR  34  30.471 -12.888 -12.307
  239   HG22  THR  34          2HG2      THR  34  29.391 -13.882 -11.304
  240   HG23  THR  34          3HG2      THR  34  30.072 -14.551 -12.786
  241    H    VAL  35           H        VAL  35  30.279 -11.554  -9.942
  242    HA   VAL  35           HA       VAL  35  28.829 -12.508  -7.511
  243    HB   VAL  35           HB       VAL  35  28.784  -9.738  -8.753
  244   HG11  VAL  35          1HG1      VAL  35  26.638 -10.227  -7.662
  245   HG12  VAL  35          2HG1      VAL  35  27.487 -10.809  -6.199
  246   HG13  VAL  35          3HG1      VAL  35  27.560  -9.104  -6.676
  247   HG21  VAL  35          3HG2      VAL  35  30.942 -10.182  -7.621
  248   HG22  VAL  35          1HG2      VAL  35  29.976  -9.058  -6.673
  249   HG23  VAL  35          2HG2      VAL  35  30.082 -10.762  -6.176
  250    H    MET  36           H        MET  36  26.764 -13.050  -7.617
  251    HA   MET  36           HA       MET  36  25.185 -12.848 -10.139
  252    HB2  MET  36           HB2      MET  36  26.447 -15.141  -9.446
  253    HB3  MET  36           HB3      MET  36  25.061 -15.295  -8.375
  254    HG2  MET  36           HG2      MET  36  24.637 -16.485 -10.438
  255    HG3  MET  36           HG3      MET  36  23.539 -15.113 -10.306
  256    HE1  MET  36           HE1      MET  36  27.151 -15.387 -13.243
  257    HE2  MET  36           HE2      MET  36  27.380 -15.264 -11.490
  258    HE3  MET  36           HE3      MET  36  26.613 -16.716 -12.198
  259    H    ASP  37           H        ASP  37  22.862 -12.935  -9.804
  260    HA   ASP  37           HA       ASP  37  21.821 -11.935  -7.263
  261    HB2  ASP  37           HB2      ASP  37  20.857 -11.411  -9.468
  262    HB3  ASP  37           HB3      ASP  37  20.447 -13.104  -9.701
  263    H    ARG  38           H        ARG  38  21.373 -13.117  -5.516
  264    HA   ARG  38           HA       ARG  38  21.674 -15.785  -4.939
  265    HB2  ARG  38           HB2      ARG  38  21.137 -13.937  -3.344
  266    HB3  ARG  38           HB3      ARG  38  19.490 -13.916  -3.949
  267    HG2  ARG  38           HG2      ARG  38  19.627 -16.536  -3.212
  268    HG3  ARG  38           HG3      ARG  38  20.885 -15.897  -2.170
  269    HD2  ARG  38           HD2      ARG  38  18.800 -15.921  -0.976
  270    HD3  ARG  38           HD3      ARG  38  19.226 -14.226  -1.275
  271    HE   ARG  38           HE       ARG  38  17.606 -14.900  -3.430
  272   HH11  ARG  38          1HH1      ARG  38  17.093 -14.983   0.074
  273   HH12  ARG  38          2HH1      ARG  38  15.377 -14.751  -0.091
  274   HH21  ARG  38          1HH2      ARG  38  15.442 -14.641  -3.576
  275   HH22  ARG  38          2HH2      ARG  38  14.444 -14.576  -2.146
  276    H    SER  39           H        SER  39  18.637 -14.295  -6.180
  277    HA   SER  39           HA       SER  39  17.071 -16.722  -5.898
  278    HB2  SER  39           HB2      SER  39  16.499 -14.159  -7.426
  279    HB3  SER  39           HB3      SER  39  15.338 -15.438  -7.034
  280    HG   SER  39           HG       SER  39  15.438 -13.541  -5.573
  281    H    ILE  40           H        ILE  40  19.009 -15.318  -8.496
  282    HA   ILE  40           HA       ILE  40  17.876 -17.106 -10.563
  283    HB   ILE  40           HB       ILE  40  20.208 -15.145 -10.761
  284   HG12  ILE  40          2HG1      ILE  40  17.285 -14.909 -11.649
  285   HG13  ILE  40          3HG1      ILE  40  17.980 -14.084 -10.252
  286   HG21  ILE  40          1HG2      ILE  40  19.925 -15.432 -13.203
  287   HG22  ILE  40          2HG2      ILE  40  20.385 -16.943 -12.429
  288   HG23  ILE  40          3HG2      ILE  40  18.694 -16.688 -12.908
  289   HD11  ILE  40          3HD1      ILE  40  18.635 -13.555 -13.148
  290   HD12  ILE  40          1HD1      ILE  40  17.856 -12.489 -11.974
  291   HD13  ILE  40          2HD1      ILE  40  19.565 -12.898 -11.786
  292    H    ILE  41           H        ILE  41  20.937 -16.936  -8.646
  293    HA   ILE  41           HA       ILE  41  21.967 -19.318  -9.912
  294    HB   ILE  41           HB       ILE  41  23.445 -17.729  -8.794
  295   HG12  ILE  41          2HG1      ILE  41  24.914 -19.301  -7.602
  296   HG13  ILE  41          3HG1      ILE  41  23.632 -20.505  -7.548
  297   HG21  ILE  41          1HG2      ILE  41  22.119 -17.163  -6.797
  298   HG22  ILE  41          2HG2      ILE  41  22.395 -18.789  -6.126
  299   HG23  ILE  41          3HG2      ILE  41  23.747 -17.665  -6.368
  300   HD11  ILE  41          3HD1      ILE  41  23.680 -20.695 -10.011
  301   HD12  ILE  41          1HD1      ILE  41  24.901 -19.405 -10.084
  302   HD13  ILE  41          2HD1      ILE  41  25.284 -20.962  -9.325
  303    H    LEU  42           H        LEU  42  20.053 -18.961  -6.859
  304    HA   LEU  42           HA       LEU  42  20.098 -21.782  -6.363
  305    HB2  LEU  42           HB2      LEU  42  18.595 -21.449  -4.627
  306    HB3  LEU  42           HB3      LEU  42  19.631 -20.038  -4.684
  307    HG   LEU  42           HG       LEU  42  17.658 -18.914  -5.982
  308   HD11  LEU  42          1HD1      LEU  42  16.159 -20.868  -6.328
  309   HD12  LEU  42          2HD1      LEU  42  15.410 -19.719  -5.234
  310   HD13  LEU  42          3HD1      LEU  42  16.156 -21.184  -4.576
  311   HD21  LEU  42          3HD2      LEU  42  18.410 -18.328  -3.685
  312   HD22  LEU  42          1HD2      LEU  42  17.376 -19.618  -3.029
  313   HD23  LEU  42          2HD2      LEU  42  16.655 -18.216  -3.844
  314    H    ARG  43           H        ARG  43  17.966 -19.880  -8.457
  315    HA   ARG  43           HA       ARG  43  16.087 -22.003  -8.944
  316    HB2  ARG  43           HB2      ARG  43  15.527 -19.683  -9.402
  317    HB3  ARG  43           HB3      ARG  43  16.831 -19.551 -10.580
  318    HG2  ARG  43           HG2      ARG  43  14.649 -19.756 -11.685
  319    HG3  ARG  43           HG3      ARG  43  15.703 -21.108 -12.090
  320    HD2  ARG  43           HD2      ARG  43  14.490 -22.492 -10.335
  321    HD3  ARG  43           HD3      ARG  43  13.394 -21.127 -10.105
  322    HE   ARG  43           HE       ARG  43  12.359 -21.621 -12.115
  323   HH11  ARG  43          1HH1      ARG  43  15.320 -23.594 -11.979
  324   HH12  ARG  43          2HH1      ARG  43  14.787 -24.595 -13.297
  325   HH21  ARG  43          1HH2      ARG  43  11.801 -22.938 -13.842
  326   HH22  ARG  43          2HH2      ARG  43  12.865 -24.211 -14.347
  327    H    HIS  44           H        HIS  44  19.228 -21.223 -10.420
  328    HA   HIS  44           HA       HIS  44  18.969 -23.322 -12.477
  329    HB2  HIS  44           HB2      HIS  44  21.268 -21.566 -11.534
  330    HB3  HIS  44           HB3      HIS  44  21.457 -22.852 -12.725
  331    HD1  HIS  44           HD1      HIS  44  19.564 -19.499 -12.362
  332    HD2  HIS  44           HD2      HIS  44  20.611 -22.433 -15.197
  333    HE1  HIS  44           HE1      HIS  44  18.899 -18.568 -14.646
  334    H    LEU  45           H        LEU  45  20.645 -23.053  -9.279
  335    HA   LEU  45           HA       LEU  45  21.734 -25.671  -9.220
  336    HB2  LEU  45           HB2      LEU  45  20.822 -23.798  -7.023
  337    HB3  LEU  45           HB3      LEU  45  21.635 -25.315  -6.700
  338    HG   LEU  45           HG       LEU  45  22.855 -23.084  -8.390
  339   HD11  LEU  45          1HD1      LEU  45  24.279 -22.689  -6.393
  340   HD12  LEU  45          2HD1      LEU  45  23.327 -23.880  -5.494
  341   HD13  LEU  45          3HD1      LEU  45  22.563 -22.382  -6.058
  342   HD21  LEU  45          3HD2      LEU  45  24.972 -24.373  -7.998
  343   HD22  LEU  45          1HD2      LEU  45  23.823 -25.232  -9.003
  344   HD23  LEU  45          2HD2      LEU  45  24.010 -25.688  -7.290
  345    H    LEU  46           H        LEU  46  18.460 -24.633  -8.318
  346    HA   LEU  46           HA       LEU  46  17.445 -27.063  -7.318
  347    HB2  LEU  46           HB2      LEU  46  16.307 -24.854  -7.293
  348    HB3  LEU  46           HB3      LEU  46  16.140 -24.910  -9.042
  349    HG   LEU  46           HG       LEU  46  14.597 -26.834  -8.855
  350   HD11  LEU  46          1HD1      LEU  46  15.389 -27.862  -6.745
  351   HD12  LEU  46          2HD1      LEU  46  13.668 -27.462  -6.643
  352   HD13  LEU  46          3HD1      LEU  46  14.863 -26.418  -5.841
  353   HD21  LEU  46          3HD2      LEU  46  12.707 -25.566  -7.900
  354   HD22  LEU  46          1HD2      LEU  46  13.736 -24.535  -8.907
  355   HD23  LEU  46          2HD2      LEU  46  13.846 -24.435  -7.138
  356    H    ASN  47           H        ASN  47  18.135 -26.186 -10.689
  357    HA   ASN  47           HA       ASN  47  16.817 -28.618 -11.729
  358    HB2  ASN  47           HB2      ASN  47  16.634 -26.322 -12.805
  359    HB3  ASN  47           HB3      ASN  47  18.323 -26.478 -13.271
  360   HD21  ASN  47          1HD2      ASN  47  18.870 -28.489 -14.697
  361   HD22  ASN  47          2HD2      ASN  47  17.597 -29.024 -15.773
  362    H    SER  48           H        SER  48  20.121 -27.153 -11.679
  363    HA   SER  48           HA       SER  48  21.401 -29.816 -11.975
  364    HB2  SER  48           HB2      SER  48  21.819 -27.521 -13.924
  365    HB3  SER  48           HB3      SER  48  22.753 -29.020 -13.876
  366    HG   SER  48           HG       SER  48  21.184 -29.206 -15.462
  367    HA   PRO  49           HA       PRO  49  24.374 -27.670  -9.412
  368    HB2  PRO  49           HB2      PRO  49  26.388 -29.468  -9.241
  369    HB3  PRO  49           HB3      PRO  49  24.741 -29.855  -8.664
  370    HG2  PRO  49           HG2      PRO  49  25.948 -30.553 -11.364
  371    HG3  PRO  49           HG3      PRO  49  25.154 -31.660 -10.197
  372    HD2  PRO  49           HD2      PRO  49  23.799 -30.524 -12.283
  373    HD3  PRO  49           HD3      PRO  49  23.030 -30.827 -10.692
  374    H    THR  50           H        THR  50  24.295 -26.248 -11.604
  375    HA   THR  50           HA       THR  50  27.091 -25.856 -12.535
  376    HB   THR  50           HB       THR  50  26.124 -25.459 -14.861
  377    HG1  THR  50           HG1      THR  50  24.211 -26.521 -15.302
  378   HG21  THR  50          1HG2      THR  50  27.488 -27.453 -14.260
  379   HG22  THR  50          2HG2      THR  50  26.293 -27.768 -15.524
  380   HG23  THR  50          3HG2      THR  50  25.992 -28.331 -13.862
  381    H    ASP  51           H        ASP  51  27.651 -23.958 -13.375
  382    HA   ASP  51           HA       ASP  51  26.455 -21.577 -12.315
  383    HB2  ASP  51           HB2      ASP  51  28.836 -21.810 -12.673
  384    HB3  ASP  51           HB3      ASP  51  28.620 -22.064 -14.407
  385    HA   PRO  52           HA       PRO  52  23.338 -20.939 -15.362
  386    HB2  PRO  52           HB2      PRO  52  22.757 -18.249 -15.069
  387    HB3  PRO  52           HB3      PRO  52  22.334 -19.522 -13.889
  388    HG2  PRO  52           HG2      PRO  52  24.740 -17.690 -13.839
  389    HG3  PRO  52           HG3      PRO  52  23.597 -18.056 -12.509
  390    HD2  PRO  52           HD2      PRO  52  25.946 -19.336 -12.691
  391    HD3  PRO  52           HD3      PRO  52  24.472 -20.245 -12.248
  392    H    PHE  53           H        PHE  53  26.336 -19.169 -15.870
  393    HA   PHE  53           HA       PHE  53  25.462 -18.416 -18.651
  394    HB2  PHE  53           HB2      PHE  53  27.315 -16.998 -16.690
  395    HB3  PHE  53           HB3      PHE  53  27.128 -16.556 -18.385
  396    HD1  PHE  53           HD2      PHE  53  24.804 -15.931 -19.271
  397    HD2  PHE  53           HD1      PHE  53  25.786 -16.101 -15.075
  398    HE1  PHE  53           HE2      PHE  53  22.864 -14.459 -18.743
  399    HE2  PHE  53           HE1      PHE  53  23.784 -14.687 -14.559
  400    HZ   PHE  53           HZ       PHE  53  22.381 -13.850 -16.389
  401    H    ASN  54           H        ASN  54  27.900 -20.018 -16.755
  402    HA   ASN  54           HA       ASN  54  29.656 -20.423 -19.158
  403    HB2  ASN  54           HB2      ASN  54  30.615 -18.987 -17.387
  404    HB3  ASN  54           HB3      ASN  54  30.338 -20.261 -16.191
  405   HD21  ASN  54          1HD2      ASN  54  32.145 -19.511 -19.221
  406   HD22  ASN  54          2HD2      ASN  54  33.440 -20.654 -18.890
  407    H    ARG  55           H        ARG  55  27.891 -22.028 -16.574
  408    HA   ARG  55           HA       ARG  55  27.341 -24.144 -16.176
  409    HB2  ARG  55           HB2      ARG  55  28.149 -24.568 -19.077
  410    HB3  ARG  55           HB3      ARG  55  27.182 -25.682 -18.116
  411    HG2  ARG  55           HG2      ARG  55  25.375 -24.115 -17.870
  412    HG3  ARG  55           HG3      ARG  55  26.340 -22.773 -18.496
  413    HD2  ARG  55           HD2      ARG  55  24.836 -23.429 -20.196
  414    HD3  ARG  55           HD3      ARG  55  26.489 -23.842 -20.690
  415    HE   ARG  55           HE       ARG  55  25.113 -26.055 -19.377
  416   HH11  ARG  55          1HH1      ARG  55  25.446 -24.504 -22.545
  417   HH12  ARG  55          2HH1      ARG  55  25.049 -25.961 -23.397
  418   HH21  ARG  55          1HH2      ARG  55  24.614 -27.904 -20.542
  419   HH22  ARG  55          2HH2      ARG  55  24.576 -27.860 -22.280
  420    H    GLN  56           H        GLN  56  30.197 -23.376 -15.677
  421    HA   GLN  56           HA       GLN  56  31.598 -25.912 -15.353
  422    HB2  GLN  56           HB2      GLN  56  32.902 -24.727 -13.676
  423    HB3  GLN  56           HB3      GLN  56  32.833 -23.787 -15.157
  424    HG2  GLN  56           HG2      GLN  56  31.424 -22.138 -14.191
  425    HG3  GLN  56           HG3      GLN  56  30.850 -23.205 -12.904
  426   HE21  GLN  56          1HE2      GLN  56  32.138 -23.607 -11.029
  427   HE22  GLN  56          2HE2      GLN  56  33.511 -22.558 -10.677
  428    H    MET  57           H        MET  57  31.906 -26.853 -13.137
  429    HA   MET  57           HA       MET  57  29.506 -27.603 -11.819
  430    HB2  MET  57           HB2      MET  57  31.667 -28.867 -11.819
  431    HB3  MET  57           HB3      MET  57  32.383 -27.613 -10.800
  432    HG2  MET  57           HG2      MET  57  31.757 -29.529  -9.471
  433    HG3  MET  57           HG3      MET  57  30.780 -28.147  -9.003
  434    HE1  MET  57           HE1      MET  57  30.189 -31.121  -8.120
  435    HE2  MET  57           HE2      MET  57  29.238 -29.701  -7.641
  436    HE3  MET  57           HE3      MET  57  28.427 -31.143  -8.281
  437    H    LEU  58           H        LEU  58  28.414 -26.838 -10.100
  438    HA   LEU  58           HA       LEU  58  29.432 -24.720  -8.352
  439    HB2  LEU  58           HB2      LEU  58  28.333 -23.819 -10.651
  440    HB3  LEU  58           HB3      LEU  58  26.844 -24.088  -9.769
  441    HG   LEU  58           HG       LEU  58  27.524 -21.791  -9.692
  442   HD11  LEU  58          1HD1      LEU  58  26.454 -22.705  -7.615
  443   HD12  LEU  58          2HD1      LEU  58  27.453 -21.271  -7.362
  444   HD13  LEU  58          3HD1      LEU  58  28.077 -22.856  -6.902
  445   HD21  LEU  58          3HD2      LEU  58  29.955 -22.044 -10.002
  446   HD22  LEU  58          1HD2      LEU  58  30.122 -22.589  -8.316
  447   HD23  LEU  58          2HD2      LEU  58  29.550 -20.948  -8.671
  448    H    THR  59           H        THR  59  28.400 -24.768  -6.348
  449    HA   THR  59           HA       THR  59  25.936 -26.399  -5.961
  450    HB   THR  59           HB       THR  59  28.452 -26.778  -4.279
  451    HG1  THR  59           HG1      THR  59  27.372 -28.340  -6.406
  452   HG21  THR  59          1HG2      THR  59  25.816 -28.315  -4.411
  453   HG22  THR  59          2HG2      THR  59  26.466 -27.418  -3.027
  454   HG23  THR  59          3HG2      THR  59  27.271 -28.886  -3.564
  455    H    GLU  60           H        GLU  60  24.796 -25.886  -4.034
  456    HA   GLU  60           HA       GLU  60  24.737 -23.164  -3.332
  457    HB2  GLU  60           HB2      GLU  60  23.110 -23.776  -1.652
  458    HB3  GLU  60           HB3      GLU  60  22.819 -24.648  -3.152
  459    HG2  GLU  60           HG2      GLU  60  23.902 -26.688  -2.180
  460    HG3  GLU  60           HG3      GLU  60  24.167 -25.816  -0.669
  461    H    SER  61           H        SER  61  26.769 -25.658  -1.943
  462    HA   SER  61           HA       SER  61  27.412 -24.299   0.545
  463    HB2  SER  61           HB2      SER  61  29.221 -26.017   0.608
  464    HB3  SER  61           HB3      SER  61  27.591 -26.685   0.396
  465    HG   SER  61           HG       SER  61  29.173 -27.632  -1.047
  466    H    MET  62           H        MET  62  28.397 -23.785  -2.732
  467    HA   MET  62           HA       MET  62  31.041 -22.642  -2.088
  468    HB2  MET  62           HB2      MET  62  29.492 -22.643  -4.726
  469    HB3  MET  62           HB3      MET  62  31.204 -22.285  -4.477
  470    HG2  MET  62           HG2      MET  62  31.625 -24.583  -3.765
  471    HG3  MET  62           HG3      MET  62  29.923 -24.988  -3.994
  472    HE1  MET  62           HE1      MET  62  30.577 -27.030  -5.509
  473    HE2  MET  62           HE2      MET  62  31.652 -26.917  -6.924
  474    HE3  MET  62           HE3      MET  62  32.304 -26.631  -5.300
  475    H    LEU  63           H        LEU  63  27.870 -21.499  -1.958
  476    HA   LEU  63           HA       LEU  63  28.284 -18.811  -3.051
  477    HB2  LEU  63           HB2      LEU  63  25.931 -20.035  -1.553
  478    HB3  LEU  63           HB3      LEU  63  25.914 -18.538  -2.457
  479    HG   LEU  63           HG       LEU  63  26.201 -21.356  -3.576
  480   HD11  LEU  63          1HD1      LEU  63  23.920 -20.687  -2.874
  481   HD12  LEU  63          2HD1      LEU  63  24.023 -20.844  -4.633
  482   HD13  LEU  63          3HD1      LEU  63  24.031 -19.233  -3.888
  483   HD21  LEU  63          3HD2      LEU  63  26.256 -18.710  -5.099
  484   HD22  LEU  63          1HD2      LEU  63  26.083 -20.330  -5.827
  485   HD23  LEU  63          2HD2      LEU  63  27.578 -19.899  -5.000
  486    H    GLU  64           H        GLU  64  28.142 -16.873  -1.947
  487    HA   GLU  64           HA       GLU  64  27.631 -16.776   0.928
  488    HB2  GLU  64           HB2      GLU  64  30.043 -17.204   0.920
  489    HB3  GLU  64           HB3      GLU  64  30.311 -15.823  -0.163
  490    HG2  GLU  64           HG2      GLU  64  29.522 -14.276   1.572
  491    HG3  GLU  64           HG3      GLU  64  29.067 -15.632   2.614
  492    HA   PRO  65           HA       PRO  65  25.689 -13.063  -0.858
  493    HB2  PRO  65           HB2      PRO  65  25.343 -12.432   2.065
  494    HB3  PRO  65           HB3      PRO  65  24.163 -12.286   0.724
  495    HG2  PRO  65           HG2      PRO  65  24.025 -14.387   2.425
  496    HG3  PRO  65           HG3      PRO  65  23.832 -14.656   0.658
  497    HD2  PRO  65           HD2      PRO  65  26.303 -15.069   2.361
  498    HD3  PRO  65           HD3      PRO  65  25.594 -16.139   1.108
  499    H    VAL  66           H        VAL  66  26.414 -11.053  -1.329
  500    HA   VAL  66           HA       VAL  66  29.041 -10.239  -0.253
  501    HB   VAL  66           HB       VAL  66  27.462  -9.002  -2.535
  502   HG11  VAL  66          1HG1      VAL  66  29.103  -7.429  -1.592
  503   HG12  VAL  66          2HG1      VAL  66  30.367  -8.670  -1.642
  504   HG13  VAL  66          3HG1      VAL  66  29.680  -8.033  -3.150
  505   HG21  VAL  66          3HG2      VAL  66  29.758 -10.985  -2.551
  506   HG22  VAL  66          1HG2      VAL  66  28.078 -11.333  -3.047
  507   HG23  VAL  66          2HG2      VAL  66  29.063 -10.197  -3.987
  508    HA   PRO  67           HA       PRO  67  26.692  -7.252   2.281
  509    HB2  PRO  67           HB2      PRO  67  28.668  -6.499   4.013
  510    HB3  PRO  67           HB3      PRO  67  27.854  -8.095   4.104
  511    HG2  PRO  67           HG2      PRO  67  30.526  -7.418   2.821
  512    HG3  PRO  67           HG3      PRO  67  30.131  -8.765   3.935
  513    HD2  PRO  67           HD2      PRO  67  30.192  -9.077   1.204
  514    HD3  PRO  67           HD3      PRO  67  29.064  -9.987   2.259
  515    H    GLU  68           H        GLU  68  29.941  -6.491   0.912
  516    HA   GLU  68           HA       GLU  68  29.672  -3.695   1.200
  517    HB2  GLU  68           HB2      GLU  68  31.612  -3.512  -0.246
  518    HB3  GLU  68           HB3      GLU  68  31.821  -4.776   0.960
  519    HG2  GLU  68           HG2      GLU  68  31.352  -6.502  -0.725
  520    HG3  GLU  68           HG3      GLU  68  31.088  -5.266  -1.961
  521    H    LEU  69           H        LEU  69  28.253  -5.749  -1.196
  522    HA   LEU  69           HA       LEU  69  27.490  -3.424  -2.904
  523    HB2  LEU  69           HB2      LEU  69  27.139  -6.428  -3.226
  524    HB3  LEU  69           HB3      LEU  69  26.372  -5.248  -4.286
  525    HG   LEU  69           HG       LEU  69  29.376  -5.551  -3.907
  526   HD11  LEU  69          1HD1      LEU  69  29.337  -6.511  -6.179
  527   HD12  LEU  69          2HD1      LEU  69  27.560  -6.349  -6.235
  528   HD13  LEU  69          3HD1      LEU  69  28.314  -7.462  -5.078
  529   HD21  LEU  69          3HD2      LEU  69  28.861  -3.233  -4.524
  530   HD22  LEU  69          1HD2      LEU  69  27.766  -3.784  -5.815
  531   HD23  LEU  69          2HD2      LEU  69  29.515  -4.073  -5.929
  532    H    LYS  70           H        LYS  70  25.946  -5.958  -0.824
  533    HA   LYS  70           HA       LYS  70  23.310  -5.015  -1.304
  534    HB2  LYS  70           HB2      LYS  70  23.954  -7.234  -0.346
  535    HB3  LYS  70           HB3      LYS  70  24.361  -6.436   1.183
  536    HG2  LYS  70           HG2      LYS  70  22.024  -5.629   1.389
  537    HG3  LYS  70           HG3      LYS  70  21.624  -6.339  -0.175
  538    HD2  LYS  70           HD2      LYS  70  22.075  -8.609   0.730
  539    HD3  LYS  70           HD3      LYS  70  22.558  -7.887   2.274
  540    HE2  LYS  70           HE2      LYS  70  20.319  -8.594   2.611
  541    HE3  LYS  70           HE3      LYS  70  20.247  -6.840   2.422
  542    HZ1  LYS  70           HZ1      LYS  70  19.672  -7.328   0.005
  543    HZ2  LYS  70           HZ2      LYS  70  18.532  -7.792   1.098
  544    HZ3  LYS  70           HZ3      LYS  70  19.513  -8.898   0.416
  545    H    GLU  71           H        GLU  71  25.618  -4.037   1.229
  546    HA   GLU  71           HA       GLU  71  23.883  -2.167   2.562
  547    HB2  GLU  71           HB2      GLU  71  26.919  -2.371   2.397
  548    HB3  GLU  71           HB3      GLU  71  26.073  -1.205   3.411
  549    HG2  GLU  71           HG2      GLU  71  25.707  -4.225   3.660
  550    HG3  GLU  71           HG3      GLU  71  26.831  -3.269   4.611
  551    H    GLN  72           H        GLN  72  25.951  -1.814  -0.318
  552    HA   GLN  72           HA       GLN  72  25.494   1.090  -0.524
  553    HB2  GLN  72           HB2      GLN  72  26.622  -0.959  -2.472
  554    HB3  GLN  72           HB3      GLN  72  26.345   0.746  -2.870
  555    HG2  GLN  72           HG2      GLN  72  27.800   1.440  -0.970
  556    HG3  GLN  72           HG3      GLN  72  28.165  -0.259  -0.658
  557   HE21  GLN  72          1HE2      GLN  72  29.477  -1.423  -2.261
  558   HE22  GLN  72          2HE2      GLN  72  30.408  -0.530  -3.471
  559    H    ILE  73           H        ILE  73  24.043  -1.816  -2.021
  560    HA   ILE  73           HA       ILE  73  22.245  -0.468  -3.758
  561    HB   ILE  73           HB       ILE  73  22.273  -3.209  -2.468
  562   HG12  ILE  73          2HG1      ILE  73  22.532  -2.342  -5.368
  563   HG13  ILE  73          3HG1      ILE  73  23.908  -2.506  -4.305
  564   HG21  ILE  73          1HG2      ILE  73  19.937  -2.863  -2.699
  565   HG22  ILE  73          2HG2      ILE  73  20.128  -2.079  -4.293
  566   HG23  ILE  73          3HG2      ILE  73  20.411  -3.817  -4.092
  567   HD11  ILE  73          3HD1      ILE  73  22.090  -4.779  -5.201
  568   HD12  ILE  73          1HD1      ILE  73  23.794  -4.482  -5.621
  569   HD13  ILE  73          2HD1      ILE  73  23.344  -4.933  -3.961
  570    H    GLN  74           H        GLN  74  21.629  -1.563  -0.391
  571    HA   GLN  74           HA       GLN  74  18.918  -0.614  -0.375
  572    HB2  GLN  74           HB2      GLN  74  18.940  -1.020   1.994
  573    HB3  GLN  74           HB3      GLN  74  19.745  -2.325   1.135
  574    HG2  GLN  74           HG2      GLN  74  21.155  -2.051   2.941
  575    HG3  GLN  74           HG3      GLN  74  21.960  -1.104   1.723
  576   HE21  GLN  74          1HE2      GLN  74  22.964   0.573   2.838
  577   HE22  GLN  74          2HE2      GLN  74  22.141   1.574   4.041
  578    H    ALA  75           H        ALA  75  21.948   1.082   0.327
  579    HA   ALA  75           HA       ALA  75  20.674   3.526   1.260
  580    HB1  ALA  75           HB1      ALA  75  22.936   4.477   0.930
  581    HB2  ALA  75           HB2      ALA  75  23.005   2.948   1.835
  582    HB3  ALA  75           HB3      ALA  75  23.456   2.985   0.113
  583    H    TRP  76           H        TRP  76  21.886   2.379  -1.922
  584    HA   TRP  76           HA       TRP  76  21.341   4.781  -3.348
  585    HB2  TRP  76           HB2      TRP  76  22.859   2.981  -4.092
  586    HB3  TRP  76           HB3      TRP  76  21.473   1.935  -4.401
  587    HD1  TRP  76           HD1      TRP  76  23.321   4.965  -5.758
  588    HE1  TRP  76           HE1      TRP  76  22.497   5.549  -8.121
  589    HE3  TRP  76           HE3      TRP  76  19.384   1.707  -6.067
  590    HZ2  TRP  76           HZ2      TRP  76  20.357   4.748  -9.889
  591    HZ3  TRP  76           HZ3      TRP  76  17.972   1.638  -8.096
  592    HH2  TRP  76           HH2      TRP  76  18.423   3.170 -10.008
  593    H    MET  77           H        MET  77  19.278   1.815  -3.010
  594    HA   MET  77           HA       MET  77  17.052   2.816  -4.517
  595    HB2  MET  77           HB2      MET  77  17.147   0.888  -2.160
  596    HB3  MET  77           HB3      MET  77  15.701   1.215  -3.114
  597    HG2  MET  77           HG2      MET  77  16.968   0.519  -5.181
  598    HG3  MET  77           HG3      MET  77  18.284  -0.027  -4.141
  599    HE1  MET  77           HE1      MET  77  16.569  -2.962  -2.149
  600    HE2  MET  77           HE2      MET  77  17.978  -1.887  -2.292
  601    HE3  MET  77           HE3      MET  77  16.454  -1.275  -1.614
  602    H    ARG  78           H        ARG  78  17.859   3.253  -1.033
  603    HA   ARG  78           HA       ARG  78  15.507   4.750  -0.404
  604    HB2  ARG  78           HB2      ARG  78  16.981   3.656   1.239
  605    HB3  ARG  78           HB3      ARG  78  18.249   4.845   0.917
  606    HG2  ARG  78           HG2      ARG  78  16.813   6.653   1.718
  607    HG3  ARG  78           HG3      ARG  78  15.437   5.550   1.920
  608    HD2  ARG  78           HD2      ARG  78  18.084   5.409   3.438
  609    HD3  ARG  78           HD3      ARG  78  16.607   6.122   4.060
  610    HE   ARG  78           HE       ARG  78  17.257   3.278   3.844
  611   HH11  ARG  78          1HH1      ARG  78  14.531   5.516   4.184
  612   HH12  ARG  78          2HH1      ARG  78  13.491   4.291   4.849
  613   HH21  ARG  78          1HH2      ARG  78  15.875   1.761   4.723
  614   HH22  ARG  78          2HH2      ARG  78  14.237   2.205   5.127
  615    H    GLU  79           H        GLU  79  18.746   5.847  -1.534
  616    HA   GLU  79           HA       GLU  79  18.182   8.635  -1.478
  617    HB2  GLU  79           HB2      GLU  79  20.415   7.574  -1.670
  618    HB3  GLU  79           HB3      GLU  79  20.069   7.143  -3.348
  619    HG2  GLU  79           HG2      GLU  79  19.855   9.523  -3.942
  620    HG3  GLU  79           HG3      GLU  79  20.059   9.985  -2.250
  621    H    LYS  80           H        LYS  80  17.536   6.222  -4.079
  622    HA   LYS  80           HA       LYS  80  16.414   8.153  -5.950
  623    HB2  LYS  80           HB2      LYS  80  16.120   5.128  -5.643
  624    HB3  LYS  80           HB3      LYS  80  15.484   6.047  -7.001
  625    HG2  LYS  80           HG2      LYS  80  18.430   5.791  -6.280
  626    HG3  LYS  80           HG3      LYS  80  17.591   4.882  -7.518
  627    HD2  LYS  80           HD2      LYS  80  18.009   7.897  -7.533
  628    HD3  LYS  80           HD3      LYS  80  18.950   6.716  -8.438
  629    HE2  LYS  80           HE2      LYS  80  16.883   5.975  -9.626
  630    HE3  LYS  80           HE3      LYS  80  15.959   7.218  -8.778
  631    HZ1  LYS  80           HZ1      LYS  80  18.238   7.730 -10.620
  632    HZ2  LYS  80           HZ2      LYS  80  17.384   8.888  -9.835
  633    HZ3  LYS  80           HZ3      LYS  80  16.651   7.966 -10.972
  634    H    GLN  81           H        GLN  81  15.040   6.378  -3.221
  635    HA   GLN  81           HA       GLN  81  12.274   7.002  -3.881
  636    HB2  GLN  81           HB2      GLN  81  12.944   4.920  -2.821
  637    HB3  GLN  81           HB3      GLN  81  13.596   5.775  -1.435
  638    HG2  GLN  81           HG2      GLN  81  10.669   5.983  -2.261
  639    HG3  GLN  81           HG3      GLN  81  11.270   4.658  -1.267
  640   HE21  GLN  81          1HE2      GLN  81   9.274   6.748  -0.526
  641   HE22  GLN  81          2HE2      GLN  81   9.950   7.490   0.917
  642    H    SER  82           H        SER  82  14.720   8.458  -1.714
  643    HA   SER  82           HA       SER  82  12.852   9.987  -0.188
  644    HB2  SER  82           HB2      SER  82  14.831  10.971   0.837
  645    HB3  SER  82           HB3      SER  82  14.993   9.227   0.661
  646    HG   SER  82           HG       SER  82  16.237  11.272  -0.910
  647    H    SER  83           H        SER  83  13.100  10.576  -3.259
  648    HA   SER  83           HA       SER  83  13.524  13.465  -3.417
  649    HB2  SER  83           HB2      SER  83  12.207  11.510  -5.332
  650    HB3  SER  83           HB3      SER  83  12.605  13.206  -5.697
  651    HG   SER  83           HG       SER  83  14.207  11.736  -6.459
  652    H    ASP  84           H        ASP  84  12.155  13.758  -1.488
  653    HA   ASP  84           HA       ASP  84  10.585  15.206  -0.714
  654    HB2  ASP  84           HB2      ASP  84   8.746  14.624  -3.060
  655    HB3  ASP  84           HB3      ASP  84   8.509  15.809  -1.794
  656    H    HIS  85           H        HIS  85   8.558  15.105   0.460
  657    HA   HIS  85           HA       HIS  85   8.306  12.579   1.823
  658    HB2  HIS  85           HB2      HIS  85   8.179  14.880   2.833
  659    HB3  HIS  85           HB3      HIS  85   6.604  15.087   2.067
  660    HD1  HIS  85           HD1      HIS  85   5.950  11.833   2.961
  661    HD2  HIS  85           HD2      HIS  85   6.868  15.254   5.225
  662    HE1  HIS  85           HE1      HIS  85   5.059  11.385   5.327
  Start of MODEL    8
    1    H2   PRO   1           H2       PRO   1  -3.955  -1.930  -5.698
    2    H3   PRO   1           H3       PRO   1  -4.771  -1.381  -7.009
    3    HA   PRO   1           HA       PRO   1  -2.842  -0.784  -8.161
    4    HB2  PRO   1           HB2      PRO   1  -1.014  -1.335  -5.825
    5    HB3  PRO   1           HB3      PRO   1  -0.923  -0.106  -7.115
    6    HG2  PRO   1           HG2      PRO   1  -2.187   0.101  -4.483
    7    HG3  PRO   1           HG3      PRO   1  -2.078   1.380  -5.727
    8    HD2  PRO   1           HD2      PRO   1  -4.470   0.248  -5.009
    9    HD3  PRO   1           HD3      PRO   1  -4.127   0.846  -6.653
   10    H    GLY   2           H        GLY   2  -1.960  -3.373  -5.771
   11    HA2  GLY   2           HA2      GLY   2  -1.791  -5.686  -6.110
   12    HA3  GLY   2           HA3      GLY   2  -2.129  -5.469  -7.841
   13    H    SER   3           H        SER   3   0.096  -3.306  -7.718
   14    HA   SER   3           HA       SER   3   2.613  -4.623  -7.092
   15    HB2  SER   3           HB2      SER   3   1.773  -4.231  -9.987
   16    HB3  SER   3           HB3      SER   3   3.466  -4.278  -9.479
   17    HG   SER   3           HG       SER   3   1.608  -6.369  -8.892
   18    H    ALA   4           H        ALA   4   4.299  -3.125  -6.974
   19    HA   ALA   4           HA       ALA   4   4.164  -0.465  -8.087
   20    HB1  ALA   4           HB1      ALA   4   4.185   0.742  -5.890
   21    HB2  ALA   4           HB2      ALA   4   2.638  -0.069  -6.204
   22    HB3  ALA   4           HB3      ALA   4   3.800  -0.785  -5.070
   23    H    GLU   5           H        GLU   5   6.142   0.636  -7.924
   24    HA   GLU   5           HA       GLU   5   8.440  -0.224  -6.456
   25    HB2  GLU   5           HB2      GLU   5   9.788  -1.120  -8.319
   26    HB3  GLU   5           HB3      GLU   5   8.433  -2.171  -7.950
   27    HG2  GLU   5           HG2      GLU   5   7.167  -1.185  -9.898
   28    HG3  GLU   5           HG3      GLU   5   8.587  -0.211 -10.279
   29    H    ILE   6           H        ILE   6  10.359   0.971  -7.027
   30    HA   ILE   6           HA       ILE   6   9.876   3.594  -8.373
   31    HB   ILE   6           HB       ILE   6  12.265   2.534  -6.830
   32   HG12  ILE   6          2HG1      ILE   6  10.407   2.872  -5.291
   33   HG13  ILE   6          3HG1      ILE   6  11.675   4.042  -5.023
   34   HG21  ILE   6          1HG2      ILE   6  11.760   5.294  -8.026
   35   HG22  ILE   6          2HG2      ILE   6  12.991   4.951  -6.797
   36   HG23  ILE   6          3HG2      ILE   6  13.091   4.160  -8.363
   37   HD11  ILE   6          3HD1      ILE   6   9.437   5.069  -4.845
   38   HD12  ILE   6          1HD1      ILE   6  10.351   5.798  -6.176
   39   HD13  ILE   6          2HD1      ILE   6   9.071   4.612  -6.518
   40    H    ASP   7           H        ASP   7  10.984   4.199 -10.222
   41    HA   ASP   7           HA       ASP   7  11.808   2.030 -12.003
   42    HB2  ASP   7           HB2      ASP   7  10.384   3.874 -12.768
   43    HB3  ASP   7           HB3      ASP   7  11.678   5.034 -12.436
   44    H    TYR   8           H        TYR   8  13.661   1.211 -11.021
   45    HA   TYR   8           HA       TYR   8  16.042   2.788 -10.538
   46    HB2  TYR   8           HB2      TYR   8  15.706  -0.229 -10.601
   47    HB3  TYR   8           HB3      TYR   8  17.069   0.664  -9.951
   48    HD1  TYR   8           HD1      TYR   8  16.204   2.666  -8.192
   49    HD2  TYR   8           HD2      TYR   8  14.354  -1.155  -8.931
   50    HE1  TYR   8           HE1      TYR   8  15.182   2.727  -5.937
   51    HE2  TYR   8           HE2      TYR   8  13.313  -1.087  -6.674
   52    HH   TYR   8           HH       TYR   8  13.818   1.675  -4.421
   53    H    SER   9           H        SER   9  15.153   3.016 -13.289
   54    HA   SER   9           HA       SER   9  16.788   1.528 -15.107
   55    HB2  SER   9           HB2      SER   9  16.230   3.356 -16.687
   56    HB3  SER   9           HB3      SER   9  14.815   2.702 -15.859
   57    HG   SER   9           HG       SER   9  14.740   4.975 -15.871
   58    H    ASP  10           H        ASP  10  17.593   4.226 -13.044
   59    HA   ASP  10           HA       ASP  10  20.052   4.993 -14.399
   60    HB2  ASP  10           HB2      ASP  10  18.962   5.587 -11.620
   61    HB3  ASP  10           HB3      ASP  10  20.390   6.344 -12.317
   62    H    ALA  11           H        ALA  11  19.388   2.192 -12.610
   63    HA   ALA  11           HA       ALA  11  21.494   2.077 -10.769
   64    HB1  ALA  11           HB1      ALA  11  21.100  -0.380 -10.772
   65    HB2  ALA  11           HB2      ALA  11  19.589   0.539 -10.730
   66    HB3  ALA  11           HB3      ALA  11  20.129  -0.225 -12.247
   67    HA   PRO  12           HA       PRO  12  25.074   1.442 -13.455
   68    HB2  PRO  12           HB2      PRO  12  26.970   0.786 -11.627
   69    HB3  PRO  12           HB3      PRO  12  26.289   2.439 -11.733
   70    HG2  PRO  12           HG2      PRO  12  25.440   0.201  -9.856
   71    HG3  PRO  12           HG3      PRO  12  25.859   1.888  -9.423
   72    HD2  PRO  12           HD2      PRO  12  23.279   1.108  -9.803
   73    HD3  PRO  12           HD3      PRO  12  23.839   2.728 -10.351
   74    H    ASP  13           H        ASP  13  26.396  -0.312 -14.227
   75    HA   ASP  13           HA       ASP  13  25.019  -2.751 -14.520
   76    HB2  ASP  13           HB2      ASP  13  26.636  -1.791 -16.118
   77    HB3  ASP  13           HB3      ASP  13  27.957  -2.111 -14.988
   78    H    GLU  14           H        GLU  14  27.437  -1.888 -12.108
   79    HA   GLU  14           HA       GLU  14  28.032  -4.573 -11.226
   80    HB2  GLU  14           HB2      GLU  14  29.223  -3.521  -9.411
   81    HB3  GLU  14           HB3      GLU  14  29.571  -2.710 -10.934
   82    HG2  GLU  14           HG2      GLU  14  27.917  -0.908 -10.287
   83    HG3  GLU  14           HG3      GLU  14  27.733  -1.693  -8.719
   84    H    PHE  15           H        PHE  15  25.263  -2.591 -10.676
   85    HA   PHE  15           HA       PHE  15  24.420  -4.115  -8.241
   86    HB2  PHE  15           HB2      PHE  15  23.208  -1.781  -9.777
   87    HB3  PHE  15           HB3      PHE  15  22.415  -2.601  -8.449
   88    HD1  PHE  15           HD2      PHE  15  25.800  -2.521  -7.402
   89    HD2  PHE  15           HD1      PHE  15  22.341  -0.003  -7.975
   90    HE1  PHE  15           HE2      PHE  15  26.675  -0.931  -5.733
   91    HE2  PHE  15           HE1      PHE  15  23.227   1.577  -6.289
   92    HZ   PHE  15           HZ       PHE  15  25.389   1.127  -5.157
   93    H    ARG  16           H        ARG  16  24.274  -4.510 -11.608
   94    HA   ARG  16           HA       ARG  16  21.570  -5.733 -11.596
   95    HB2  ARG  16           HB2      ARG  16  23.398  -4.965 -13.891
   96    HB3  ARG  16           HB3      ARG  16  21.769  -5.647 -14.055
   97    HG2  ARG  16           HG2      ARG  16  20.787  -3.661 -12.979
   98    HG3  ARG  16           HG3      ARG  16  22.391  -2.990 -12.692
   99    HD2  ARG  16           HD2      ARG  16  22.828  -2.992 -15.126
  100    HD3  ARG  16           HD3      ARG  16  21.188  -3.579 -15.412
  101    HE   ARG  16           HE       ARG  16  21.942  -0.929 -14.228
  102   HH11  ARG  16          1HH1      ARG  16  19.484  -2.778 -16.073
  103   HH12  ARG  16          2HH1      ARG  16  18.635  -1.307 -16.454
  104   HH21  ARG  16          1HH2      ARG  16  20.834   0.790 -14.761
  105   HH22  ARG  16          2HH2      ARG  16  19.396   0.718 -15.754
  106    H    ASP  17           H        ASP  17  21.171  -7.800 -12.349
  107    HA   ASP  17           HA       ASP  17  23.499  -9.652 -12.676
  108    HB2  ASP  17           HB2      ASP  17  21.880 -10.291 -10.967
  109    HB3  ASP  17           HB3      ASP  17  20.578 -10.293 -12.152
  110    HA   PRO  18           HA       PRO  18  22.659  -9.247 -16.967
  111    HB2  PRO  18           HB2      PRO  18  24.109 -11.370 -18.033
  112    HB3  PRO  18           HB3      PRO  18  24.774  -9.814 -17.464
  113    HG2  PRO  18           HG2      PRO  18  24.658 -12.448 -16.004
  114    HG3  PRO  18           HG3      PRO  18  25.992 -11.266 -16.055
  115    HD2  PRO  18           HD2      PRO  18  24.267 -11.418 -13.957
  116    HD3  PRO  18           HD3      PRO  18  24.943  -9.855 -14.504
  117    H    LEU  19           H        LEU  19  21.306 -12.072 -15.382
  118    HA   LEU  19           HA       LEU  19  19.924 -12.984 -17.834
  119    HB2  LEU  19           HB2      LEU  19  20.219 -13.959 -15.063
  120    HB3  LEU  19           HB3      LEU  19  18.545 -13.981 -15.572
  121    HG   LEU  19           HG       LEU  19  20.753 -15.185 -17.287
  122   HD11  LEU  19          1HD1      LEU  19  20.066 -17.382 -16.381
  123   HD12  LEU  19          2HD1      LEU  19  18.980 -16.577 -15.229
  124   HD13  LEU  19          3HD1      LEU  19  20.739 -16.351 -15.127
  125   HD21  LEU  19          3HD2      LEU  19  17.725 -15.592 -17.242
  126   HD22  LEU  19          1HD2      LEU  19  18.866 -16.427 -18.311
  127   HD23  LEU  19          2HD2      LEU  19  18.622 -14.678 -18.471
  128    H    MET  20           H        MET  20  19.013 -11.212 -14.865
  129    HA   MET  20           HA       MET  20  16.362 -10.530 -15.986
  130    HB2  MET  20           HB2      MET  20  17.767 -10.086 -13.338
  131    HB3  MET  20           HB3      MET  20  16.276  -9.219 -13.725
  132    HG2  MET  20           HG2      MET  20  16.561 -12.246 -13.839
  133    HG3  MET  20           HG3      MET  20  15.964 -11.349 -12.440
  134    HE1  MET  20           HE1      MET  20  13.898 -12.935 -12.407
  135    HE2  MET  20           HE2      MET  20  12.811 -13.185 -13.779
  136    HE3  MET  20           HE3      MET  20  14.486 -13.767 -13.859
  137    H    ASP  21           H        ASP  21  19.460  -9.000 -15.929
  138    HA   ASP  21           HA       ASP  21  20.282  -7.144 -16.853
  139    HB2  ASP  21           HB2      ASP  21  18.788  -7.853 -18.756
  140    HB3  ASP  21           HB3      ASP  21  17.592  -6.686 -18.196
  141    H    THR  22           H        THR  22  18.574  -7.045 -14.315
  142    HA   THR  22           HA       THR  22  18.674  -4.141 -13.845
  143    HB   THR  22           HB       THR  22  16.404  -4.692 -14.782
  144    HG1  THR  22           HG1      THR  22  15.437  -3.371 -13.245
  145   HG21  THR  22          1HG2      THR  22  16.003  -6.862 -13.652
  146   HG22  THR  22          2HG2      THR  22  14.734  -5.685 -13.329
  147   HG23  THR  22          3HG2      THR  22  15.944  -6.034 -12.082
  148    H    LEU  23           H        LEU  23  17.699  -3.874 -11.483
  149    HA   LEU  23           HA       LEU  23  19.898  -4.498  -9.914
  150    HB2  LEU  23           HB2      LEU  23  17.637  -2.853  -9.726
  151    HB3  LEU  23           HB3      LEU  23  17.447  -3.919  -8.342
  152    HG   LEU  23           HG       LEU  23  19.922  -2.255  -8.980
  153   HD11  LEU  23          1HD1      LEU  23  18.012  -0.846  -8.385
  154   HD12  LEU  23          2HD1      LEU  23  19.205  -0.848  -7.080
  155   HD13  LEU  23          3HD1      LEU  23  17.714  -1.807  -6.924
  156   HD21  LEU  23          3HD2      LEU  23  19.227  -3.791  -6.432
  157   HD22  LEU  23          1HD2      LEU  23  20.672  -2.800  -6.710
  158   HD23  LEU  23          2HD2      LEU  23  20.451  -4.289  -7.610
  159    H    MET  24           H        MET  24  20.589  -6.309  -8.954
  160    HA   MET  24           HA       MET  24  18.874  -8.626  -8.615
  161    HB2  MET  24           HB2      MET  24  20.846  -9.696  -7.633
  162    HB3  MET  24           HB3      MET  24  21.180  -8.921  -9.190
  163    HG2  MET  24           HG2      MET  24  22.144  -6.979  -7.852
  164    HG3  MET  24           HG3      MET  24  21.995  -7.986  -6.414
  165    HE1  MET  24           HE1      MET  24  24.534  -6.835  -6.690
  166    HE2  MET  24           HE2      MET  24  25.809  -7.587  -7.689
  167    HE3  MET  24           HE3      MET  24  24.563  -6.587  -8.444
  168    H    THR  25           H        THR  25  19.980  -6.147  -6.397
  169    HA   THR  25           HA       THR  25  19.375  -5.485  -4.317
  170    HB   THR  25           HB       THR  25  17.148  -7.543  -4.319
  171    HG1  THR  25           HG1      THR  25  16.866  -6.367  -6.166
  172   HG21  THR  25          1HG2      THR  25  16.018  -5.786  -2.974
  173   HG22  THR  25          2HG2      THR  25  17.492  -4.792  -3.022
  174   HG23  THR  25          3HG2      THR  25  17.496  -6.354  -2.180
  175    H    ASP  26           H        ASP  26  19.440  -8.983  -4.629
  176    HA   ASP  26           HA       ASP  26  20.917  -9.286  -2.031
  177    HB2  ASP  26           HB2      ASP  26  18.958 -11.098  -3.478
  178    HB3  ASP  26           HB3      ASP  26  20.034 -11.652  -2.194
  179    HA   PRO  27           HA       PRO  27  23.922 -10.493  -5.353
  180    HB2  PRO  27           HB2      PRO  27  26.162  -9.373  -4.188
  181    HB3  PRO  27           HB3      PRO  27  25.056  -8.486  -5.262
  182    HG2  PRO  27           HG2      PRO  27  25.077  -8.526  -2.240
  183    HG3  PRO  27           HG3      PRO  27  24.932  -7.114  -3.338
  184    HD2  PRO  27           HD2      PRO  27  22.765  -8.234  -2.169
  185    HD3  PRO  27           HD3      PRO  27  22.701  -7.625  -3.856
  186    H    VAL  28           H        VAL  28  24.851 -12.434  -5.305
  187    HA   VAL  28           HA       VAL  28  26.121 -13.488  -2.804
  188    HB   VAL  28           HB       VAL  28  24.369 -14.959  -4.808
  189   HG11  VAL  28          1HG1      VAL  28  24.810 -17.016  -3.512
  190   HG12  VAL  28          2HG1      VAL  28  26.275 -16.438  -4.321
  191   HG13  VAL  28          3HG1      VAL  28  26.050 -16.157  -2.572
  192   HG21  VAL  28          3HG2      VAL  28  23.029 -15.512  -2.816
  193   HG22  VAL  28          1HG2      VAL  28  24.174 -14.668  -1.771
  194   HG23  VAL  28          2HG2      VAL  28  23.201 -13.755  -2.930
  195    H    ARG  29           H        ARG  29  28.103 -14.122  -2.990
  196    HA   ARG  29           HA       ARG  29  29.557 -13.790  -5.502
  197    HB2  ARG  29           HB2      ARG  29  30.113 -12.765  -3.288
  198    HB3  ARG  29           HB3      ARG  29  30.567 -14.351  -2.679
  199    HG2  ARG  29           HG2      ARG  29  32.454 -14.450  -4.166
  200    HG3  ARG  29           HG3      ARG  29  31.822 -13.126  -5.163
  201    HD2  ARG  29           HD2      ARG  29  33.637 -12.274  -3.826
  202    HD3  ARG  29           HD3      ARG  29  32.107 -11.541  -3.290
  203    HE   ARG  29           HE       ARG  29  32.590 -13.794  -1.647
  204   HH11  ARG  29          1HH2      ARG  29  34.096 -10.644  -2.243
  205   HH12  ARG  29          2HH2      ARG  29  34.722 -10.540  -0.626
  206   HH21  ARG  29          1HH1      ARG  29  33.360 -13.555   0.444
  207   HH22  ARG  29          2HH1      ARG  29  34.333 -12.159   0.857
  208    H    LEU  30           H        LEU  30  30.553 -15.312  -6.612
  209    HA   LEU  30           HA       LEU  30  30.431 -18.193  -5.813
  210    HB2  LEU  30           HB2      LEU  30  30.390 -16.680  -8.455
  211    HB3  LEU  30           HB3      LEU  30  30.981 -18.315  -8.417
  212    HG   LEU  30           HG       LEU  30  28.805 -19.059  -7.365
  213   HD11  LEU  30          1HD1      LEU  30  27.946 -16.211  -8.036
  214   HD12  LEU  30          2HD1      LEU  30  27.876 -17.024  -6.456
  215   HD13  LEU  30          3HD1      LEU  30  26.817 -17.553  -7.749
  216   HD21  LEU  30          3HD2      LEU  30  28.682 -17.724 -10.096
  217   HD22  LEU  30          1HD2      LEU  30  27.573 -18.990  -9.501
  218   HD23  LEU  30          2HD2      LEU  30  29.290 -19.356  -9.752
  219    HA   PRO  31           HA       PRO  31  34.712 -18.390  -5.216
  220    HB2  PRO  31           HB2      PRO  31  35.561 -20.785  -6.256
  221    HB3  PRO  31           HB3      PRO  31  34.472 -20.653  -4.836
  222    HG2  PRO  31           HG2      PRO  31  33.701 -21.074  -7.752
  223    HG3  PRO  31           HG3      PRO  31  33.171 -22.021  -6.330
  224    HD2  PRO  31           HD2      PRO  31  31.645 -20.035  -7.342
  225    HD3  PRO  31           HD3      PRO  31  31.785 -20.213  -5.573
  226    H    SER  32           H        SER  32  33.764 -18.508  -8.602
  227    HA   SER  32           HA       SER  32  36.329 -18.037  -9.824
  228    HB2  SER  32           HB2      SER  32  34.839 -17.249 -11.705
  229    HB3  SER  32           HB3      SER  32  34.469 -18.879 -11.109
  230    HG   SER  32           HG       SER  32  32.581 -17.510 -11.403
  231    H    GLY  33           H        GLY  33  34.472 -16.062  -7.756
  232    HA2  GLY  33           HA2      GLY  33  34.976 -13.882  -7.037
  233    HA3  GLY  33           HA3      GLY  33  35.886 -13.562  -8.534
  234    H    THR  34           H        THR  34  33.160 -14.941  -9.666
  235    HA   THR  34           HA       THR  34  31.856 -12.520 -10.523
  236    HB   THR  34           HB       THR  34  30.951 -15.431 -10.528
  237    HG1  THR  34           HG1      THR  34  32.144 -13.766 -12.522
  238   HG21  THR  34          1HG2      THR  34  28.970 -14.077 -10.908
  239   HG22  THR  34          2HG2      THR  34  29.496 -14.749 -12.454
  240   HG23  THR  34          3HG2      THR  34  29.844 -13.042 -12.075
  241    H    VAL  35           H        VAL  35  30.027 -11.523  -9.795
  242    HA   VAL  35           HA       VAL  35  28.681 -12.589  -7.337
  243    HB   VAL  35           HB       VAL  35  28.871  -9.691  -8.241
  244   HG11  VAL  35          1HG1      VAL  35  26.681 -10.144  -7.190
  245   HG12  VAL  35          2HG1      VAL  35  27.474 -10.952  -5.824
  246   HG13  VAL  35          3HG1      VAL  35  27.696  -9.207  -6.101
  247   HG21  VAL  35          3HG2      VAL  35  30.975 -10.458  -7.187
  248   HG22  VAL  35          1HG2      VAL  35  30.109  -9.378  -6.089
  249   HG23  VAL  35          2HG2      VAL  35  30.064 -11.134  -5.815
  250    H    MET  36           H        MET  36  26.579 -12.954  -7.445
  251    HA   MET  36           HA       MET  36  25.035 -12.498  -9.966
  252    HB2  MET  36           HB2      MET  36  26.367 -14.758  -9.664
  253    HB3  MET  36           HB3      MET  36  25.119 -15.133  -8.468
  254    HG2  MET  36           HG2      MET  36  23.382 -14.938 -10.178
  255    HG3  MET  36           HG3      MET  36  24.563 -14.387 -11.369
  256    HE1  MET  36           HE1      MET  36  27.077 -16.328 -11.058
  257    HE2  MET  36           HE2      MET  36  26.606 -17.526 -12.268
  258    HE3  MET  36           HE3      MET  36  26.293 -15.797 -12.557
  259    H    ASP  37           H        ASP  37  22.745 -12.831  -9.716
  260    HA   ASP  37           HA       ASP  37  21.568 -11.881  -7.257
  261    HB2  ASP  37           HB2      ASP  37  20.646 -11.471  -9.491
  262    HB3  ASP  37           HB3      ASP  37  20.393 -13.196  -9.724
  263    H    ARG  38           H        ARG  38  21.120 -12.973  -5.492
  264    HA   ARG  38           HA       ARG  38  21.597 -15.585  -4.768
  265    HB2  ARG  38           HB2      ARG  38  20.983 -13.722  -3.235
  266    HB3  ARG  38           HB3      ARG  38  19.361 -13.720  -3.880
  267    HG2  ARG  38           HG2      ARG  38  19.339 -16.259  -3.028
  268    HG3  ARG  38           HG3      ARG  38  20.722 -15.750  -2.071
  269    HD2  ARG  38           HD2      ARG  38  18.655 -15.597  -0.784
  270    HD3  ARG  38           HD3      ARG  38  19.314 -13.976  -1.064
  271    HE   ARG  38           HE       ARG  38  17.351 -14.844  -3.070
  272   HH11  ARG  38          1HH1      ARG  38  17.595 -13.257   0.089
  273   HH12  ARG  38          2HH1      ARG  38  16.102 -12.394  -0.148
  274   HH21  ARG  38          1HH2      ARG  38  15.494 -13.726  -3.303
  275   HH22  ARG  38          2HH2      ARG  38  14.905 -12.676  -2.034
  276    H    SER  39           H        SER  39  18.442 -14.354  -6.019
  277    HA   SER  39           HA       SER  39  17.088 -16.890  -5.579
  278    HB2  SER  39           HB2      SER  39  16.250 -14.460  -7.202
  279    HB3  SER  39           HB3      SER  39  15.222 -15.831  -6.751
  280    HG   SER  39           HG       SER  39  14.926 -14.076  -5.349
  281    H    ILE  40           H        ILE  40  18.611 -15.257  -8.390
  282    HA   ILE  40           HA       ILE  40  17.719 -17.232 -10.328
  283    HB   ILE  40           HB       ILE  40  20.063 -15.297 -10.484
  284   HG12  ILE  40          2HG1      ILE  40  17.207 -15.126 -11.567
  285   HG13  ILE  40          3HG1      ILE  40  17.816 -14.205 -10.200
  286   HG21  ILE  40          1HG2      ILE  40  18.702 -16.900 -12.688
  287   HG22  ILE  40          2HG2      ILE  40  19.965 -15.667 -12.917
  288   HG23  ILE  40          3HG2      ILE  40  20.357 -17.159 -12.084
  289   HD11  ILE  40          3HD1      ILE  40  18.535 -13.854 -13.100
  290   HD12  ILE  40          1HD1      ILE  40  17.874 -12.686 -11.931
  291   HD13  ILE  40          2HD1      ILE  40  19.556 -13.208 -11.791
  292    H    ILE  41           H        ILE  41  20.847 -16.977  -8.487
  293    HA   ILE  41           HA       ILE  41  21.817 -19.396  -9.686
  294    HB   ILE  41           HB       ILE  41  23.307 -17.730  -8.670
  295   HG12  ILE  41          2HG1      ILE  41  24.928 -19.241  -7.676
  296   HG13  ILE  41          3HG1      ILE  41  23.699 -20.474  -7.399
  297   HG21  ILE  41          1HG2      ILE  41  23.767 -17.675  -6.274
  298   HG22  ILE  41          2HG2      ILE  41  22.103 -17.190  -6.596
  299   HG23  ILE  41          3HG2      ILE  41  22.447 -18.810  -5.955
  300   HD11  ILE  41          3HD1      ILE  41  24.566 -19.473 -10.140
  301   HD12  ILE  41          1HD1      ILE  41  25.195 -20.924  -9.354
  302   HD13  ILE  41          2HD1      ILE  41  23.491 -20.860  -9.802
  303    H    LEU  42           H        LEU  42  20.045 -18.988  -6.554
  304    HA   LEU  42           HA       LEU  42  20.191 -21.819  -6.039
  305    HB2  LEU  42           HB2      LEU  42  18.860 -21.473  -4.169
  306    HB3  LEU  42           HB3      LEU  42  19.866 -20.059  -4.338
  307    HG   LEU  42           HG       LEU  42  17.773 -18.965  -5.454
  308   HD11  LEU  42          1HD1      LEU  42  15.616 -19.756  -4.505
  309   HD12  LEU  42          2HD1      LEU  42  16.431 -21.200  -3.861
  310   HD13  LEU  42          3HD1      LEU  42  16.294 -20.946  -5.608
  311   HD21  LEU  42          3HD2      LEU  42  18.790 -18.372  -3.228
  312   HD22  LEU  42          1HD2      LEU  42  17.771 -19.595  -2.459
  313   HD23  LEU  42          2HD2      LEU  42  17.035 -18.174  -3.244
  314    H    ARG  43           H        ARG  43  17.826 -19.901  -7.889
  315    HA   ARG  43           HA       ARG  43  15.963 -22.045  -8.335
  316    HB2  ARG  43           HB2      ARG  43  15.469 -19.669  -8.838
  317    HB3  ARG  43           HB3      ARG  43  16.678 -19.690 -10.139
  318    HG2  ARG  43           HG2      ARG  43  15.286 -21.549 -11.231
  319    HG3  ARG  43           HG3      ARG  43  14.056 -21.208  -9.992
  320    HD2  ARG  43           HD2      ARG  43  14.021 -18.829 -10.790
  321    HD3  ARG  43           HD3      ARG  43  15.224 -19.266 -12.022
  322    HE   ARG  43           HE       ARG  43  13.028 -21.042 -12.264
  323   HH11  ARG  43          1HH1      ARG  43  13.639 -17.604 -12.807
  324   HH12  ARG  43          2HH1      ARG  43  12.405 -17.484 -14.029
  325   HH21  ARG  43          1HH2      ARG  43  11.481 -20.831 -13.883
  326   HH22  ARG  43          2HH2      ARG  43  11.199 -19.284 -14.624
  327    H    HIS  44           H        HIS  44  18.907 -20.997 -10.164
  328    HA   HIS  44           HA       HIS  44  18.632 -23.045 -12.140
  329    HB2  HIS  44           HB2      HIS  44  20.048 -20.950 -12.297
  330    HB3  HIS  44           HB3      HIS  44  21.259 -21.775 -11.306
  331    HD1  HIS  44           HD1      HIS  44  19.785 -21.783 -14.829
  332    HD2  HIS  44           HD2      HIS  44  22.320 -24.106 -12.423
  333    HE1  HIS  44           HE1      HIS  44  20.924 -23.447 -16.388
  334    H    LEU  45           H        LEU  45  20.473 -23.036  -9.026
  335    HA   LEU  45           HA       LEU  45  21.662 -25.582  -9.276
  336    HB2  LEU  45           HB2      LEU  45  20.769 -23.967  -6.873
  337    HB3  LEU  45           HB3      LEU  45  21.581 -25.523  -6.697
  338    HG   LEU  45           HG       LEU  45  22.812 -23.155  -8.177
  339   HD11  LEU  45          1HD1      LEU  45  24.249 -22.935  -6.175
  340   HD12  LEU  45          2HD1      LEU  45  23.334 -24.216  -5.366
  341   HD13  LEU  45          3HD1      LEU  45  22.541 -22.678  -5.769
  342   HD21  LEU  45          3HD2      LEU  45  23.939 -25.859  -7.326
  343   HD22  LEU  45          1HD2      LEU  45  24.907 -24.483  -7.897
  344   HD23  LEU  45          2HD2      LEU  45  23.750 -25.249  -8.986
  345    H    LEU  46           H        LEU  46  18.336 -24.846  -8.229
  346    HA   LEU  46           HA       LEU  46  17.667 -27.564  -7.505
  347    HB2  LEU  46           HB2      LEU  46  16.012 -25.160  -8.351
  348    HB3  LEU  46           HB3      LEU  46  15.286 -26.676  -7.845
  349    HG   LEU  46           HG       LEU  46  17.174 -25.096  -6.055
  350   HD11  LEU  46          1HD1      LEU  46  14.126 -25.074  -6.113
  351   HD12  LEU  46          2HD1      LEU  46  15.185 -23.727  -6.596
  352   HD13  LEU  46          3HD1      LEU  46  15.168 -24.271  -4.915
  353   HD21  LEU  46          3HD2      LEU  46  16.160 -26.433  -4.255
  354   HD22  LEU  46          1HD2      LEU  46  16.969 -27.465  -5.435
  355   HD23  LEU  46          2HD2      LEU  46  15.195 -27.335  -5.450
  356    H    ASN  47           H        ASN  47  18.048 -26.064 -10.634
  357    HA   ASN  47           HA       ASN  47  16.645 -28.284 -12.033
  358    HB2  ASN  47           HB2      ASN  47  16.290 -26.001 -12.855
  359    HB3  ASN  47           HB3      ASN  47  18.017 -25.774 -13.093
  360   HD21  ASN  47          1HD2      ASN  47  15.153 -27.557 -14.269
  361   HD22  ASN  47          2HD2      ASN  47  15.884 -28.036 -15.790
  362    H    SER  48           H        SER  48  19.963 -26.843 -11.863
  363    HA   SER  48           HA       SER  48  21.179 -29.504 -12.340
  364    HB2  SER  48           HB2      SER  48  21.619 -27.096 -14.153
  365    HB3  SER  48           HB3      SER  48  22.672 -28.513 -14.097
  366    HG   SER  48           HG       SER  48  19.946 -28.378 -14.924
  367    HA   PRO  49           HA       PRO  49  24.051 -27.577  -9.483
  368    HB2  PRO  49           HB2      PRO  49  25.945 -29.478  -9.224
  369    HB3  PRO  49           HB3      PRO  49  24.249 -29.785  -8.750
  370    HG2  PRO  49           HG2      PRO  49  25.584 -30.498 -11.389
  371    HG3  PRO  49           HG3      PRO  49  24.657 -31.583 -10.302
  372    HD2  PRO  49           HD2      PRO  49  23.509 -30.331 -12.445
  373    HD3  PRO  49           HD3      PRO  49  22.612 -30.620 -10.922
  374    H    THR  50           H        THR  50  24.206 -26.066 -11.527
  375    HA   THR  50           HA       THR  50  27.026 -25.824 -12.427
  376    HB   THR  50           HB       THR  50  26.064 -25.297 -14.763
  377    HG1  THR  50           HG1      THR  50  23.839 -25.394 -13.931
  378   HG21  THR  50          1HG2      THR  50  27.402 -27.323 -14.291
  379   HG22  THR  50          2HG2      THR  50  26.130 -27.606 -15.481
  380   HG23  THR  50          3HG2      THR  50  25.931 -28.190 -13.814
  381    H    ASP  51           H        ASP  51  27.591 -23.861 -13.363
  382    HA   ASP  51           HA       ASP  51  26.341 -21.468 -12.288
  383    HB2  ASP  51           HB2      ASP  51  28.770 -21.707 -12.620
  384    HB3  ASP  51           HB3      ASP  51  28.534 -21.868 -14.357
  385    HA   PRO  52           HA       PRO  52  23.227 -21.350 -15.512
  386    HB2  PRO  52           HB2      PRO  52  22.433 -18.651 -15.253
  387    HB3  PRO  52           HB3      PRO  52  21.828 -20.047 -14.306
  388    HG2  PRO  52           HG2      PRO  52  23.929 -18.041 -13.586
  389    HG3  PRO  52           HG3      PRO  52  22.687 -18.763 -12.536
  390    HD2  PRO  52           HD2      PRO  52  25.281 -19.583 -12.531
  391    HD3  PRO  52           HD3      PRO  52  23.942 -20.753 -12.303
  392    H    PHE  53           H        PHE  53  25.955 -19.123 -15.649
  393    HA   PHE  53           HA       PHE  53  25.289 -18.357 -18.470
  394    HB2  PHE  53           HB2      PHE  53  27.238 -17.146 -16.474
  395    HB3  PHE  53           HB3      PHE  53  26.899 -16.538 -18.084
  396    HD1  PHE  53           HD1      PHE  53  24.719 -15.467 -18.617
  397    HD2  PHE  53           HD2      PHE  53  25.691 -16.775 -14.626
  398    HE1  PHE  53           HE1      PHE  53  22.870 -14.079 -17.709
  399    HE2  PHE  53           HE2      PHE  53  23.817 -15.401 -13.725
  400    HZ   PHE  53           HZ       PHE  53  22.424 -14.060 -15.261
  401    H    ASN  54           H        ASN  54  27.923 -19.669 -16.438
  402    HA   ASN  54           HA       ASN  54  29.708 -19.890 -18.793
  403    HB2  ASN  54           HB2      ASN  54  30.478 -18.899 -16.639
  404    HB3  ASN  54           HB3      ASN  54  30.192 -20.432 -15.827
  405   HD21  ASN  54          1HD2      ASN  54  32.192 -18.819 -18.336
  406   HD22  ASN  54          2HD2      ASN  54  33.488 -19.997 -18.270
  407    H    ARG  55           H        ARG  55  27.778 -21.955 -16.756
  408    HA   ARG  55           HA       ARG  55  27.074 -24.028 -16.890
  409    HB2  ARG  55           HB2      ARG  55  28.629 -24.491 -19.456
  410    HB3  ARG  55           HB3      ARG  55  27.244 -25.384 -18.865
  411    HG2  ARG  55           HG2      ARG  55  27.267 -22.529 -19.906
  412    HG3  ARG  55           HG3      ARG  55  26.538 -23.934 -20.661
  413    HD2  ARG  55           HD2      ARG  55  25.620 -22.587 -18.088
  414    HD3  ARG  55           HD3      ARG  55  24.854 -22.480 -19.664
  415    HE   ARG  55           HE       ARG  55  24.511 -24.982 -19.533
  416   HH11  ARG  55          1HH1      ARG  55  24.746 -23.180 -16.476
  417   HH12  ARG  55          2HH1      ARG  55  23.509 -24.171 -15.744
  418   HH21  ARG  55          1HH2      ARG  55  23.135 -26.346 -18.378
  419   HH22  ARG  55          2HH2      ARG  55  22.792 -25.997 -16.707
  420    H    GLN  56           H        GLN  56  30.113 -23.374 -16.068
  421    HA   GLN  56           HA       GLN  56  31.265 -26.011 -15.670
  422    HB2  GLN  56           HB2      GLN  56  32.640 -24.949 -13.985
  423    HB3  GLN  56           HB3      GLN  56  32.622 -23.965 -15.436
  424    HG2  GLN  56           HG2      GLN  56  31.256 -22.277 -14.399
  425    HG3  GLN  56           HG3      GLN  56  30.751 -23.342 -13.101
  426   HE21  GLN  56          1HE2      GLN  56  32.260 -23.918 -11.379
  427   HE22  GLN  56          2HE2      GLN  56  33.642 -22.867 -11.082
  428    H    MET  57           H        MET  57  31.381 -27.115 -13.530
  429    HA   MET  57           HA       MET  57  28.779 -27.303 -12.252
  430    HB2  MET  57           HB2      MET  57  31.455 -28.562 -11.556
  431    HB3  MET  57           HB3      MET  57  29.951 -28.843 -10.673
  432    HG2  MET  57           HG2      MET  57  28.873 -29.582 -12.820
  433    HG3  MET  57           HG3      MET  57  30.432 -29.429 -13.618
  434    HE1  MET  57           HE1      MET  57  29.289 -31.002 -10.054
  435    HE2  MET  57           HE2      MET  57  28.108 -31.463 -11.298
  436    HE3  MET  57           HE3      MET  57  29.178 -32.690 -10.583
  437    H    LEU  58           H        LEU  58  28.191 -26.827 -10.183
  438    HA   LEU  58           HA       LEU  58  29.688 -24.971  -8.486
  439    HB2  LEU  58           HB2      LEU  58  28.730 -23.753 -10.593
  440    HB3  LEU  58           HB3      LEU  58  27.148 -24.065  -9.935
  441    HG   LEU  58           HG       LEU  58  28.023 -21.778  -9.668
  442   HD11  LEU  58          1HD1      LEU  58  26.270 -22.639  -8.118
  443   HD12  LEU  58          2HD1      LEU  58  27.278 -21.346  -7.445
  444   HD13  LEU  58          3HD1      LEU  58  27.540 -23.014  -6.932
  445   HD21  LEU  58          3HD2      LEU  58  29.752 -21.213  -8.065
  446   HD22  LEU  58          1HD2      LEU  58  30.413 -22.380  -9.234
  447   HD23  LEU  58          2HD2      LEU  58  29.950 -22.911  -7.602
  448    H    THR  59           H        THR  59  28.845 -25.072  -6.364
  449    HA   THR  59           HA       THR  59  26.198 -26.394  -5.937
  450    HB   THR  59           HB       THR  59  27.241 -27.470  -3.870
  451    HG1  THR  59           HG1      THR  59  29.264 -27.162  -3.527
  452   HG21  THR  59          1HG2      THR  59  28.113 -29.369  -5.079
  453   HG22  THR  59          2HG2      THR  59  28.259 -28.403  -6.573
  454   HG23  THR  59          3HG2      THR  59  26.661 -28.753  -5.871
  455    H    GLU  60           H        GLU  60  25.289 -26.110  -3.853
  456    HA   GLU  60           HA       GLU  60  25.014 -23.463  -2.973
  457    HB2  GLU  60           HB2      GLU  60  23.818 -24.483  -1.065
  458    HB3  GLU  60           HB3      GLU  60  23.331 -25.142  -2.618
  459    HG2  GLU  60           HG2      GLU  60  24.737 -27.163  -2.233
  460    HG3  GLU  60           HG3      GLU  60  25.244 -26.508  -0.671
  461    H    SER  61           H        SER  61  27.445 -25.832  -1.966
  462    HA   SER  61           HA       SER  61  28.259 -24.460   0.470
  463    HB2  SER  61           HB2      SER  61  30.176 -26.083   0.306
  464    HB3  SER  61           HB3      SER  61  28.574 -26.822   0.332
  465    HG   SER  61           HG       SER  61  29.980 -27.730  -1.281
  466    H    MET  62           H        MET  62  28.843 -23.847  -2.853
  467    HA   MET  62           HA       MET  62  31.428 -22.441  -2.416
  468    HB2  MET  62           HB2      MET  62  29.761 -22.854  -4.938
  469    HB3  MET  62           HB3      MET  62  31.384 -22.167  -4.850
  470    HG2  MET  62           HG2      MET  62  32.264 -24.286  -3.950
  471    HG3  MET  62           HG3      MET  62  30.660 -25.009  -4.064
  472    HE1  MET  62           HE1      MET  62  33.247 -26.320  -5.299
  473    HE2  MET  62           HE2      MET  62  31.624 -27.036  -5.423
  474    HE3  MET  62           HE3      MET  62  32.639 -26.864  -6.874
  475    H    LEU  63           H        LEU  63  28.180 -21.626  -2.073
  476    HA   LEU  63           HA       LEU  63  28.328 -18.882  -3.148
  477    HB2  LEU  63           HB2      LEU  63  26.130 -20.315  -1.590
  478    HB3  LEU  63           HB3      LEU  63  25.980 -18.765  -2.400
  479    HG   LEU  63           HG       LEU  63  26.398 -21.459  -3.735
  480   HD11  LEU  63          1HD1      LEU  63  24.022 -19.540  -3.719
  481   HD12  LEU  63          2HD1      LEU  63  24.131 -21.089  -2.851
  482   HD13  LEU  63          3HD1      LEU  63  24.124 -21.063  -4.619
  483   HD21  LEU  63          3HD2      LEU  63  26.109 -18.708  -5.017
  484   HD22  LEU  63          1HD2      LEU  63  26.041 -20.255  -5.874
  485   HD23  LEU  63          2HD2      LEU  63  27.540 -19.755  -5.088
  486    H    GLU  64           H        GLU  64  28.041 -16.995  -1.965
  487    HA   GLU  64           HA       GLU  64  27.846 -16.976   0.947
  488    HB2  GLU  64           HB2      GLU  64  30.245 -17.349   0.697
  489    HB3  GLU  64           HB3      GLU  64  30.377 -16.030  -0.462
  490    HG2  GLU  64           HG2      GLU  64  29.818 -14.393   1.294
  491    HG3  GLU  64           HG3      GLU  64  29.547 -15.706   2.448
  492    HA   PRO  65           HA       PRO  65  25.779 -13.305  -0.720
  493    HB2  PRO  65           HB2      PRO  65  24.717 -12.222   1.547
  494    HB3  PRO  65           HB3      PRO  65  24.086 -13.702   0.766
  495    HG2  PRO  65           HG2      PRO  65  25.997 -13.503   3.120
  496    HG3  PRO  65           HG3      PRO  65  24.523 -14.516   2.965
  497    HD2  PRO  65           HD2      PRO  65  27.028 -15.497   2.474
  498    HD3  PRO  65           HD3      PRO  65  25.611 -16.043   1.528
  499    H    VAL  66           H        VAL  66  26.318 -11.174  -1.103
  500    HA   VAL  66           HA       VAL  66  28.881 -10.280   0.076
  501    HB   VAL  66           HB       VAL  66  27.369  -9.008  -2.228
  502   HG11  VAL  66          1HG1      VAL  66  28.953  -7.458  -1.140
  503   HG12  VAL  66          2HG1      VAL  66  30.220  -8.706  -1.171
  504   HG13  VAL  66          3HG1      VAL  66  29.623  -7.990  -2.681
  505   HG21  VAL  66          3HG2      VAL  66  28.068 -11.306  -2.835
  506   HG22  VAL  66          1HG2      VAL  66  29.064 -10.113  -3.666
  507   HG23  VAL  66          2HG2      VAL  66  29.711 -10.943  -2.233
  508    HA   PRO  67           HA       PRO  67  26.391  -7.338   2.533
  509    HB2  PRO  67           HB2      PRO  67  28.253  -6.613   4.369
  510    HB3  PRO  67           HB3      PRO  67  27.520  -8.248   4.371
  511    HG2  PRO  67           HG2      PRO  67  30.199  -7.423   3.234
  512    HG3  PRO  67           HG3      PRO  67  29.825  -8.828   4.277
  513    HD2  PRO  67           HD2      PRO  67  29.998  -9.029   1.506
  514    HD3  PRO  67           HD3      PRO  67  28.889 -10.025   2.494
  515    H    GLU  68           H        GLU  68  29.690  -6.445   1.339
  516    HA   GLU  68           HA       GLU  68  29.257  -3.663   1.681
  517    HB2  GLU  68           HB2      GLU  68  31.238  -3.329   0.344
  518    HB3  GLU  68           HB3      GLU  68  31.470  -4.607   1.530
  519    HG2  GLU  68           HG2      GLU  68  31.128  -6.319  -0.262
  520    HG3  GLU  68           HG3      GLU  68  30.975  -5.011  -1.448
  521    H    LEU  69           H        LEU  69  28.422  -5.757  -1.069
  522    HA   LEU  69           HA       LEU  69  27.516  -3.493  -2.717
  523    HB2  LEU  69           HB2      LEU  69  27.244  -6.512  -2.982
  524    HB3  LEU  69           HB3      LEU  69  26.527  -5.372  -4.123
  525    HG   LEU  69           HG       LEU  69  29.503  -5.614  -3.545
  526   HD11  LEU  69          1HD1      LEU  69  27.853  -6.497  -5.954
  527   HD12  LEU  69          2HD1      LEU  69  28.567  -7.567  -4.731
  528   HD13  LEU  69          3HD1      LEU  69  29.619  -6.630  -5.788
  529   HD21  LEU  69          3HD2      LEU  69  29.737  -4.192  -5.606
  530   HD22  LEU  69          1HD2      LEU  69  28.978  -3.318  -4.278
  531   HD23  LEU  69          2HD2      LEU  69  27.985  -3.934  -5.612
  532    H    LYS  70           H        LYS  70  25.846  -6.013  -0.696
  533    HA   LYS  70           HA       LYS  70  23.247  -5.042  -1.330
  534    HB2  LYS  70           HB2      LYS  70  23.727  -7.240  -0.317
  535    HB3  LYS  70           HB3      LYS  70  24.188  -6.458   1.207
  536    HG2  LYS  70           HG2      LYS  70  21.952  -5.642   1.556
  537    HG3  LYS  70           HG3      LYS  70  21.454  -6.067  -0.098
  538    HD2  LYS  70           HD2      LYS  70  21.668  -8.444   0.409
  539    HD3  LYS  70           HD3      LYS  70  22.235  -8.077   2.062
  540    HE2  LYS  70           HE2      LYS  70  20.110  -6.954   2.582
  541    HE3  LYS  70           HE3      LYS  70  19.555  -7.195   0.918
  542    HZ1  LYS  70           HZ1      LYS  70  20.190  -9.432   2.752
  543    HZ2  LYS  70           HZ2      LYS  70  19.486  -9.533   1.265
  544    HZ3  LYS  70           HZ3      LYS  70  18.677  -8.849   2.508
  545    H    GLU  71           H        GLU  71  25.436  -4.064   1.324
  546    HA   GLU  71           HA       GLU  71  23.654  -2.184   2.550
  547    HB2  GLU  71           HB2      GLU  71  25.668  -3.205   3.601
  548    HB3  GLU  71           HB3      GLU  71  26.696  -2.213   2.551
  549    HG2  GLU  71           HG2      GLU  71  25.794  -0.167   3.576
  550    HG3  GLU  71           HG3      GLU  71  24.631  -1.109   4.518
  551    H    GLN  72           H        GLN  72  25.985  -1.842  -0.144
  552    HA   GLN  72           HA       GLN  72  25.575   1.061  -0.417
  553    HB2  GLN  72           HB2      GLN  72  26.830  -1.065  -2.191
  554    HB3  GLN  72           HB3      GLN  72  26.602   0.593  -2.733
  555    HG2  GLN  72           HG2      GLN  72  28.144  -0.119  -0.199
  556    HG3  GLN  72           HG3      GLN  72  28.887   0.065  -1.778
  557   HE21  GLN  72          1HE2      GLN  72  28.703   2.284  -2.857
  558   HE22  GLN  72          2HE2      GLN  72  28.531   3.673  -1.789
  559    H    ILE  73           H        ILE  73  24.211  -1.801  -2.072
  560    HA   ILE  73           HA       ILE  73  22.548  -0.437  -3.920
  561    HB   ILE  73           HB       ILE  73  22.456  -3.174  -2.626
  562   HG12  ILE  73          2HG1      ILE  73  22.831  -2.341  -5.529
  563   HG13  ILE  73          3HG1      ILE  73  24.170  -2.513  -4.417
  564   HG21  ILE  73          1HG2      ILE  73  20.131  -2.754  -2.977
  565   HG22  ILE  73          2HG2      ILE  73  20.432  -2.042  -4.573
  566   HG23  ILE  73          3HG2      ILE  73  20.677  -3.783  -4.289
  567   HD11  ILE  73          3HD1      ILE  73  24.067  -4.533  -5.687
  568   HD12  ILE  73          1HD1      ILE  73  23.526  -4.921  -4.041
  569   HD13  ILE  73          2HD1      ILE  73  22.348  -4.752  -5.369
  570    H    GLN  74           H        GLN  74  21.644  -1.575  -0.622
  571    HA   GLN  74           HA       GLN  74  18.964  -0.613  -0.824
  572    HB2  GLN  74           HB2      GLN  74  18.778  -1.039   1.551
  573    HB3  GLN  74           HB3      GLN  74  19.644  -2.335   0.741
  574    HG2  GLN  74           HG2      GLN  74  20.908  -2.090   2.662
  575    HG3  GLN  74           HG3      GLN  74  21.805  -1.133   1.518
  576   HE21  GLN  74          1HE2      GLN  74  22.723   0.539   2.703
  577   HE22  GLN  74          2HE2      GLN  74  21.819   1.504   3.872
  578    H    ALA  75           H        ALA  75  21.912   1.111   0.201
  579    HA   ALA  75           HA       ALA  75  20.554   3.469   1.171
  580    HB1  ALA  75           HB1      ALA  75  23.362   3.080   0.016
  581    HB2  ALA  75           HB2      ALA  75  22.801   4.492   0.942
  582    HB3  ALA  75           HB3      ALA  75  22.907   2.903   1.722
  583    H    TRP  76           H        TRP  76  21.907   2.571  -2.032
  584    HA   TRP  76           HA       TRP  76  21.197   5.028  -3.342
  585    HB2  TRP  76           HB2      TRP  76  22.937   3.444  -4.117
  586    HB3  TRP  76           HB3      TRP  76  21.700   2.243  -4.461
  587    HD1  TRP  76           HD1      TRP  76  23.166   5.494  -5.785
  588    HE1  TRP  76           HE1      TRP  76  22.359   5.919  -8.177
  589    HE3  TRP  76           HE3      TRP  76  19.699   1.727  -6.157
  590    HZ2  TRP  76           HZ2      TRP  76  20.393   4.832  -9.983
  591    HZ3  TRP  76           HZ3      TRP  76  18.388   1.452  -8.218
  592    HH2  TRP  76           HH2      TRP  76  18.696   3.005 -10.146
  593    H    MET  77           H        MET  77  19.454   1.877  -3.083
  594    HA   MET  77           HA       MET  77  17.159   2.600  -4.635
  595    HB2  MET  77           HB2      MET  77  17.494   0.696  -2.288
  596    HB3  MET  77           HB3      MET  77  15.998   0.860  -3.217
  597    HG2  MET  77           HG2      MET  77  17.119   0.169  -5.275
  598    HG3  MET  77           HG3      MET  77  18.682   0.146  -4.454
  599    HE1  MET  77           HE1      MET  77  15.055  -1.303  -3.595
  600    HE2  MET  77           HE2      MET  77  15.450  -1.781  -5.259
  601    HE3  MET  77           HE3      MET  77  15.347  -3.012  -3.979
  602    H    ARG  78           H        ARG  78  17.850   3.115  -1.135
  603    HA   ARG  78           HA       ARG  78  15.353   4.391  -0.562
  604    HB2  ARG  78           HB2      ARG  78  16.996   3.384   1.051
  605    HB3  ARG  78           HB3      ARG  78  18.006   4.808   0.870
  606    HG2  ARG  78           HG2      ARG  78  15.167   5.460   1.510
  607    HG3  ARG  78           HG3      ARG  78  15.902   4.368   2.675
  608    HD2  ARG  78           HD2      ARG  78  16.252   6.488   3.552
  609    HD3  ARG  78           HD3      ARG  78  17.817   5.999   2.943
  610    HE   ARG  78           HE       ARG  78  15.906   7.925   1.629
  611   HH11  ARG  78          1HH1      ARG  78  19.321   6.917   1.935
  612   HH12  ARG  78          2HH1      ARG  78  19.838   8.332   1.060
  613   HH21  ARG  78          1HH2      ARG  78  16.697   9.664   0.637
  614   HH22  ARG  78          2HH2      ARG  78  18.428   9.811   0.311
  615    H    GLU  79           H        GLU  79  18.517   5.756  -1.613
  616    HA   GLU  79           HA       GLU  79  17.723   8.486  -1.592
  617    HB2  GLU  79           HB2      GLU  79  20.055   7.535  -1.738
  618    HB3  GLU  79           HB3      GLU  79  19.748   7.166  -3.432
  619    HG2  GLU  79           HG2      GLU  79  21.003   9.236  -3.232
  620    HG3  GLU  79           HG3      GLU  79  19.421   9.556  -3.932
  621    H    LYS  80           H        LYS  80  17.375   6.035  -4.173
  622    HA   LYS  80           HA       LYS  80  16.097   7.776  -6.096
  623    HB2  LYS  80           HB2      LYS  80  16.288   4.785  -5.632
  624    HB3  LYS  80           HB3      LYS  80  15.261   5.422  -6.897
  625    HG2  LYS  80           HG2      LYS  80  18.200   6.173  -6.700
  626    HG3  LYS  80           HG3      LYS  80  17.676   4.688  -7.471
  627    HD2  LYS  80           HD2      LYS  80  16.630   7.424  -8.311
  628    HD3  LYS  80           HD3      LYS  80  18.055   6.664  -9.035
  629    HE2  LYS  80           HE2      LYS  80  16.796   4.791  -9.851
  630    HE3  LYS  80           HE3      LYS  80  15.359   5.243  -8.919
  631    HZ1  LYS  80           HZ1      LYS  80  16.465   6.761 -11.217
  632    HZ2  LYS  80           HZ2      LYS  80  15.172   7.223 -10.307
  633    HZ3  LYS  80           HZ3      LYS  80  15.099   5.853 -11.203
  634    H    GLN  81           H        GLN  81  14.802   5.915  -3.350
  635    HA   GLN  81           HA       GLN  81  12.004   6.295  -4.085
  636    HB2  GLN  81           HB2      GLN  81  12.917   4.341  -2.815
  637    HB3  GLN  81           HB3      GLN  81  13.271   5.418  -1.450
  638    HG2  GLN  81           HG2      GLN  81  10.854   5.919  -1.216
  639    HG3  GLN  81           HG3      GLN  81  10.501   4.935  -2.641
  640   HE21  GLN  81          1HE2      GLN  81   8.982   3.920  -0.940
  641   HE22  GLN  81          2HE2      GLN  81   9.673   2.594  -0.014
  642    H    SER  82           H        SER  82  14.237   7.968  -1.797
  643    HA   SER  82           HA       SER  82  12.354   9.636  -0.529
  644    HB2  SER  82           HB2      SER  82  15.268  10.131  -1.247
  645    HB3  SER  82           HB3      SER  82  14.319  11.219  -0.239
  646    HG   SER  82           HG       SER  82  14.009   9.530   1.253
  647    H    SER  83           H        SER  83  11.355  11.505  -0.952
  648    HA   SER  83           HA       SER  83  10.559  13.383  -1.922
  649    HB2  SER  83           HB2      SER  83  13.016  13.373  -3.702
  650    HB3  SER  83           HB3      SER  83  11.904  14.721  -3.424
  651    HG   SER  83           HG       SER  83  13.822  14.820  -2.112
  652    H    ASP  84           H        ASP  84  10.528  10.527  -3.568
  653    HA   ASP  84           HA       ASP  84   9.588  11.300  -6.166
  654    HB2  ASP  84           HB2      ASP  84  10.464   9.076  -5.610
  655    HB3  ASP  84           HB3      ASP  84   9.093   8.774  -4.544
  656    H    HIS  85           H        HIS  85   7.623  11.745  -6.972
  657    HA   HIS  85           HA       HIS  85   5.165  11.697  -5.300
  658    HB2  HIS  85           HB2      HIS  85   6.361  14.132  -6.682
  659    HB3  HIS  85           HB3      HIS  85   4.661  14.014  -6.268
  660    HD1  HIS  85           HD1      HIS  85   8.079  14.094  -4.419
  661    HD2  HIS  85           HD2      HIS  85   3.952  14.676  -3.840
  662    HE1  HIS  85           HE1      HIS  85   7.817  15.122  -2.098
  Start of MODEL    9
    1    H2   PRO   1           H2       PRO   1   5.540   1.996 -16.307
    2    H3   PRO   1           H3       PRO   1   6.789   2.973 -16.751
    3    HA   PRO   1           HA       PRO   1   5.697   4.910 -16.074
    4    HB2  PRO   1           HB2      PRO   1   3.122   3.440 -15.517
    5    HB3  PRO   1           HB3      PRO   1   3.396   5.114 -16.100
    6    HG2  PRO   1           HG2      PRO   1   2.987   2.697 -17.660
    7    HG3  PRO   1           HG3      PRO   1   3.291   4.329 -18.297
    8    HD2  PRO   1           HD2      PRO   1   5.097   2.274 -18.595
    9    HD3  PRO   1           HD3      PRO   1   5.570   3.983 -18.470
   10    H    GLY   2           H        GLY   2   4.784   5.584 -13.874
   11    HA2  GLY   2           HA2      GLY   2   6.276   4.158 -11.776
   12    HA3  GLY   2           HA3      GLY   2   5.476   5.752 -11.670
   13    H    SER   3           H        SER   3   3.383   3.311 -12.822
   14    HA   SER   3           HA       SER   3   1.496   3.650 -10.784
   15    HB2  SER   3           HB2      SER   3   1.743   1.281 -12.674
   16    HB3  SER   3           HB3      SER   3   0.269   1.886 -11.894
   17    HG   SER   3           HG       SER   3   0.437   2.614 -14.067
   18    H    ALA   4           H        ALA   4   4.156   1.351 -10.821
   19    HA   ALA   4           HA       ALA   4   3.622   0.599  -8.071
   20    HB1  ALA   4           HB1      ALA   4   2.203  -1.072  -9.208
   21    HB2  ALA   4           HB2      ALA   4   3.566  -1.550 -10.251
   22    HB3  ALA   4           HB3      ALA   4   3.626  -1.859  -8.500
   23    H    GLU   5           H        GLU   5   5.444  -0.042  -7.027
   24    HA   GLU   5           HA       GLU   5   7.582  -0.253  -6.448
   25    HB2  GLU   5           HB2      GLU   5   8.191  -1.171  -9.282
   26    HB3  GLU   5           HB3      GLU   5   9.229  -1.355  -7.868
   27    HG2  GLU   5           HG2      GLU   5   7.444  -2.721  -6.760
   28    HG3  GLU   5           HG3      GLU   5   6.505  -2.662  -8.255
   29    H    ILE   6           H        ILE   6   9.922   0.462  -6.951
   30    HA   ILE   6           HA       ILE   6   9.941   3.297  -7.877
   31    HB   ILE   6           HB       ILE   6  12.015   1.673  -6.374
   32   HG12  ILE   6          2HG1      ILE   6  10.082   1.891  -4.939
   33   HG13  ILE   6          3HG1      ILE   6  11.411   2.851  -4.355
   34   HG21  ILE   6          1HG2      ILE   6  11.871   4.655  -6.977
   35   HG22  ILE   6          2HG2      ILE   6  12.995   3.923  -5.807
   36   HG23  ILE   6          3HG2      ILE   6  13.109   3.492  -7.516
   37   HD11  ILE   6          3HD1      ILE   6   8.985   3.960  -5.857
   38   HD12  ILE   6          1HD1      ILE   6   9.261   4.039  -4.120
   39   HD13  ILE   6          2HD1      ILE   6  10.325   4.933  -5.224
   40    H    ASP   7           H        ASP   7  11.239   3.982  -9.574
   41    HA   ASP   7           HA       ASP   7  11.949   1.993 -11.567
   42    HB2  ASP   7           HB2      ASP   7  11.011   4.265 -12.072
   43    HB3  ASP   7           HB3      ASP   7  12.532   4.983 -11.568
   44    H    TYR   8           H        TYR   8  13.789   0.918 -11.709
   45    HA   TYR   8           HA       TYR   8  16.326   2.085 -10.636
   46    HB2  TYR   8           HB2      TYR   8  15.638  -0.864 -10.759
   47    HB3  TYR   8           HB3      TYR   8  17.073  -0.134 -10.092
   48    HD1  TYR   8           HD1      TYR   8  16.068   2.060  -8.364
   49    HD2  TYR   8           HD2      TYR   8  14.526  -1.924  -8.996
   50    HE1  TYR   8           HE1      TYR   8  15.124   2.074  -6.087
   51    HE2  TYR   8           HE2      TYR   8  13.542  -1.893  -6.713
   52    HH   TYR   8           HH       TYR   8  13.917   0.924  -4.500
   53    H    SER   9           H        SER   9  15.078   2.137 -13.487
   54    HA   SER   9           HA       SER   9  17.022   0.670 -15.119
   55    HB2  SER   9           HB2      SER   9  15.280   3.088 -15.755
   56    HB3  SER   9           HB3      SER   9  16.222   2.165 -16.934
   57    HG   SER   9           HG       SER   9  14.015   1.488 -16.857
   58    H    ASP  10           H        ASP  10  17.129   3.601 -13.272
   59    HA   ASP  10           HA       ASP  10  19.493   4.788 -14.484
   60    HB2  ASP  10           HB2      ASP  10  17.664   5.985 -13.238
   61    HB3  ASP  10           HB3      ASP  10  18.180   5.155 -11.770
   62    H    ALA  11           H        ALA  11  19.155   1.954 -12.576
   63    HA   ALA  11           HA       ALA  11  21.384   2.295 -10.799
   64    HB1  ALA  11           HB1      ALA  11  19.531   0.726 -10.339
   65    HB2  ALA  11           HB2      ALA  11  20.012  -0.261 -11.733
   66    HB3  ALA  11           HB3      ALA  11  21.090  -0.095 -10.333
   67    HA   PRO  12           HA       PRO  12  24.726   1.343 -13.595
   68    HB2  PRO  12           HB2      PRO  12  26.727   0.693 -11.892
   69    HB3  PRO  12           HB3      PRO  12  26.070   2.348 -11.979
   70    HG2  PRO  12           HG2      PRO  12  25.296   0.153 -10.005
   71    HG3  PRO  12           HG3      PRO  12  25.765   1.845  -9.637
   72    HD2  PRO  12           HD2      PRO  12  23.160   1.117  -9.835
   73    HD3  PRO  12           HD3      PRO  12  23.721   2.699 -10.449
   74    H    ASP  13           H        ASP  13  25.962  -0.431 -14.435
   75    HA   ASP  13           HA       ASP  13  24.570  -2.893 -14.483
   76    HB2  ASP  13           HB2      ASP  13  26.294  -3.628 -15.976
   77    HB3  ASP  13           HB3      ASP  13  25.899  -1.950 -16.339
   78    H    GLU  14           H        GLU  14  27.053  -1.864 -12.276
   79    HA   GLU  14           HA       GLU  14  27.882  -4.525 -11.425
   80    HB2  GLU  14           HB2      GLU  14  29.060  -3.403  -9.649
   81    HB3  GLU  14           HB3      GLU  14  29.320  -2.558 -11.174
   82    HG2  GLU  14           HG2      GLU  14  27.562  -0.875 -10.453
   83    HG3  GLU  14           HG3      GLU  14  27.481  -1.700  -8.898
   84    H    PHE  15           H        PHE  15  25.072  -2.595 -10.743
   85    HA   PHE  15           HA       PHE  15  24.320  -4.261  -8.367
   86    HB2  PHE  15           HB2      PHE  15  23.092  -1.780  -9.640
   87    HB3  PHE  15           HB3      PHE  15  22.399  -2.647  -8.289
   88    HD1  PHE  15           HD2      PHE  15  25.741  -2.828  -7.364
   89    HD2  PHE  15           HD1      PHE  15  22.552   0.036  -7.872
   90    HE1  PHE  15           HE2      PHE  15  26.838  -1.328  -5.755
   91    HE2  PHE  15           HE1      PHE  15  23.653   1.533  -6.242
   92    HZ   PHE  15           HZ       PHE  15  25.803   0.879  -5.187
   93    H    ARG  16           H        ARG  16  23.976  -4.380 -11.752
   94    HA   ARG  16           HA       ARG  16  21.230  -5.559 -11.642
   95    HB2  ARG  16           HB2      ARG  16  22.808  -4.181 -13.833
   96    HB3  ARG  16           HB3      ARG  16  21.339  -5.101 -14.161
   97    HG2  ARG  16           HG2      ARG  16  19.947  -3.618 -12.987
   98    HG3  ARG  16           HG3      ARG  16  21.267  -2.954 -12.024
   99    HD2  ARG  16           HD2      ARG  16  20.474  -1.329 -13.661
  100    HD3  ARG  16           HD3      ARG  16  22.169  -1.756 -13.898
  101    HE   ARG  16           HE       ARG  16  20.375  -3.334 -15.560
  102   HH11  ARG  16          1HH1      ARG  16  21.754  -0.080 -15.333
  103   HH12  ARG  16          2HH1      ARG  16  21.820   0.112 -17.061
  104   HH21  ARG  16          1HH2      ARG  16  20.592  -3.088 -17.776
  105   HH22  ARG  16          2HH2      ARG  16  21.141  -1.566 -18.432
  106    H    ASP  17           H        ASP  17  20.825  -7.606 -12.312
  107    HA   ASP  17           HA       ASP  17  23.105  -9.400 -12.627
  108    HB2  ASP  17           HB2      ASP  17  21.157  -9.978 -11.252
  109    HB3  ASP  17           HB3      ASP  17  20.140 -10.030 -12.689
  110    HA   PRO  18           HA       PRO  18  23.169  -9.271 -17.031
  111    HB2  PRO  18           HB2      PRO  18  24.523 -11.652 -17.624
  112    HB3  PRO  18           HB3      PRO  18  25.258 -10.099 -17.130
  113    HG2  PRO  18           HG2      PRO  18  24.623 -12.510 -15.440
  114    HG3  PRO  18           HG3      PRO  18  26.058 -11.440 -15.381
  115    HD2  PRO  18           HD2      PRO  18  24.023 -11.226 -13.613
  116    HD3  PRO  18           HD3      PRO  18  24.893  -9.786 -14.205
  117    H    LEU  19           H        LEU  19  21.338 -11.898 -15.557
  118    HA   LEU  19           HA       LEU  19  20.233 -12.739 -18.186
  119    HB2  LEU  19           HB2      LEU  19  20.516 -14.464 -16.532
  120    HB3  LEU  19           HB3      LEU  19  19.640 -13.546 -15.314
  121    HG   LEU  19           HG       LEU  19  17.542 -13.829 -16.579
  122   HD11  LEU  19          1HD1      LEU  19  17.445 -15.415 -18.491
  123   HD12  LEU  19          2HD1      LEU  19  19.220 -15.514 -18.510
  124   HD13  LEU  19          3HD1      LEU  19  18.407 -13.982 -18.891
  125   HD21  LEU  19          3HD2      LEU  19  18.131 -15.461 -14.875
  126   HD22  LEU  19          1HD2      LEU  19  19.044 -16.425 -16.053
  127   HD23  LEU  19          2HD2      LEU  19  17.273 -16.249 -16.202
  128    H    MET  20           H        MET  20  18.873 -11.285 -15.181
  129    HA   MET  20           HA       MET  20  16.434 -10.573 -16.657
  130    HB2  MET  20           HB2      MET  20  17.245 -10.307 -13.735
  131    HB3  MET  20           HB3      MET  20  15.648  -9.861 -14.368
  132    HG2  MET  20           HG2      MET  20  16.878 -12.641 -14.520
  133    HG3  MET  20           HG3      MET  20  15.664 -12.107 -13.364
  134    HE1  MET  20           HE1      MET  20  14.220 -14.195 -13.934
  135    HE2  MET  20           HE2      MET  20  13.724 -14.650 -15.585
  136    HE3  MET  20           HE3      MET  20  15.439 -14.723 -15.111
  137    H    ASP  21           H        ASP  21  19.300  -8.846 -15.994
  138    HA   ASP  21           HA       ASP  21  20.020  -6.787 -16.473
  139    HB2  ASP  21           HB2      ASP  21  18.729  -7.177 -18.566
  140    HB3  ASP  21           HB3      ASP  21  17.357  -6.322 -17.854
  141    H    THR  22           H        THR  22  17.688  -7.236 -14.256
  142    HA   THR  22           HA       THR  22  17.341  -4.378 -13.487
  143    HB   THR  22           HB       THR  22  15.332  -5.814 -13.974
  144    HG1  THR  22           HG1      THR  22  14.254  -4.891 -12.245
  145   HG21  THR  22          1HG2      THR  22  14.531  -7.347 -12.267
  146   HG22  THR  22          2HG2      THR  22  15.967  -7.073 -11.263
  147   HG23  THR  22          3HG2      THR  22  16.108  -7.917 -12.825
  148    H    LEU  23           H        LEU  23  17.130  -4.039 -11.129
  149    HA   LEU  23           HA       LEU  23  19.687  -4.454  -9.955
  150    HB2  LEU  23           HB2      LEU  23  17.785  -2.570  -9.732
  151    HB3  LEU  23           HB3      LEU  23  17.322  -3.516  -8.328
  152    HG   LEU  23           HG       LEU  23  20.027  -2.233  -8.883
  153   HD11  LEU  23          1HD1      LEU  23  19.471  -0.773  -6.982
  154   HD12  LEU  23          2HD1      LEU  23  17.877  -1.553  -6.843
  155   HD13  LEU  23          3HD1      LEU  23  18.301  -0.624  -8.293
  156   HD21  LEU  23          3HD2      LEU  23  20.629  -2.835  -6.553
  157   HD22  LEU  23          1HD2      LEU  23  20.414  -4.271  -7.529
  158   HD23  LEU  23          2HD2      LEU  23  19.132  -3.780  -6.395
  159    H    MET  24           H        MET  24  20.419  -6.236  -8.932
  160    HA   MET  24           HA       MET  24  18.713  -8.479  -8.467
  161    HB2  MET  24           HB2      MET  24  20.731  -9.603  -7.619
  162    HB3  MET  24           HB3      MET  24  20.977  -8.778  -9.167
  163    HG2  MET  24           HG2      MET  24  22.091  -6.910  -7.938
  164    HG3  MET  24           HG3      MET  24  21.932  -7.827  -6.432
  165    HE1  MET  24           HE1      MET  24  24.501  -6.674  -8.605
  166    HE2  MET  24           HE2      MET  24  24.511  -6.812  -6.834
  167    HE3  MET  24           HE3      MET  24  25.723  -7.673  -7.814
  168    H    THR  25           H        THR  25  19.791  -6.076  -6.236
  169    HA   THR  25           HA       THR  25  19.604  -5.608  -4.057
  170    HB   THR  25           HB       THR  25  17.576  -6.027  -2.853
  171    HG1  THR  25           HG1      THR  25  17.059  -8.112  -3.535
  172   HG21  THR  25          1HG2      THR  25  17.666  -4.218  -4.507
  173   HG22  THR  25          2HG2      THR  25  16.040  -4.894  -4.369
  174   HG23  THR  25          3HG2      THR  25  17.051  -5.315  -5.771
  175    H    ASP  26           H        ASP  26  19.506  -9.026  -4.576
  176    HA   ASP  26           HA       ASP  26  20.937  -9.500  -1.977
  177    HB2  ASP  26           HB2      ASP  26  19.000 -11.249  -3.544
  178    HB3  ASP  26           HB3      ASP  26  20.062 -11.852  -2.275
  179    HA   PRO  27           HA       PRO  27  23.908 -10.454  -5.425
  180    HB2  PRO  27           HB2      PRO  27  26.130  -9.282  -4.276
  181    HB3  PRO  27           HB3      PRO  27  24.949  -8.397  -5.275
  182    HG2  PRO  27           HG2      PRO  27  25.072  -8.562  -2.255
  183    HG3  PRO  27           HG3      PRO  27  24.850  -7.108  -3.280
  184    HD2  PRO  27           HD2      PRO  27  22.750  -8.348  -2.116
  185    HD3  PRO  27           HD3      PRO  27  22.624  -7.683  -3.780
  186    H    VAL  28           H        VAL  28  24.923 -12.369  -5.432
  187    HA   VAL  28           HA       VAL  28  26.127 -13.480  -2.913
  188    HB   VAL  28           HB       VAL  28  24.412 -14.937  -4.971
  189   HG11  VAL  28          1HG1      VAL  28  26.263 -16.421  -4.363
  190   HG12  VAL  28          2HG1      VAL  28  25.986 -16.100  -2.639
  191   HG13  VAL  28          3HG1      VAL  28  24.765 -16.967  -3.605
  192   HG21  VAL  28          3HG2      VAL  28  23.144 -13.701  -3.204
  193   HG22  VAL  28          1HG2      VAL  28  22.969 -15.456  -3.031
  194   HG23  VAL  28          2HG2      VAL  28  24.068 -14.561  -1.958
  195    H    ARG  29           H        ARG  29  28.089 -14.239  -3.083
  196    HA   ARG  29           HA       ARG  29  29.592 -13.837  -5.566
  197    HB2  ARG  29           HB2      ARG  29  30.208 -13.047  -3.216
  198    HB3  ARG  29           HB3      ARG  29  30.552 -14.736  -2.827
  199    HG2  ARG  29           HG2      ARG  29  32.281 -14.761  -4.615
  200    HG3  ARG  29           HG3      ARG  29  31.878 -13.094  -5.043
  201    HD2  ARG  29           HD2      ARG  29  33.857 -13.072  -3.637
  202    HD3  ARG  29           HD3      ARG  29  32.515 -12.342  -2.759
  203    HE   ARG  29           HE       ARG  29  32.677 -13.996  -1.151
  204   HH11  ARG  29          1HH1      ARG  29  34.364 -15.300  -4.002
  205   HH12  ARG  29          2HH1      ARG  29  34.990 -16.643  -3.080
  206   HH21  ARG  29          1HH2      ARG  29  33.459 -15.679  -0.101
  207   HH22  ARG  29          2HH2      ARG  29  34.497 -16.862  -0.880
  208    H    LEU  30           H        LEU  30  30.438 -15.352  -6.783
  209    HA   LEU  30           HA       LEU  30  30.027 -18.252  -6.290
  210    HB2  LEU  30           HB2      LEU  30  31.044 -16.690  -8.726
  211    HB3  LEU  30           HB3      LEU  30  30.660 -18.398  -8.702
  212    HG   LEU  30           HG       LEU  30  28.703 -16.078  -8.467
  213   HD11  LEU  30          1HD1      LEU  30  29.014 -18.301 -10.525
  214   HD12  LEU  30          2HD1      LEU  30  29.545 -16.618 -10.738
  215   HD13  LEU  30          3HD1      LEU  30  27.819 -16.996 -10.566
  216   HD21  LEU  30          3HD2      LEU  30  26.904 -17.777  -8.450
  217   HD22  LEU  30          1HD2      LEU  30  27.871 -17.826  -6.974
  218   HD23  LEU  30          2HD2      LEU  30  28.116 -19.064  -8.235
  219    HA   PRO  31           HA       PRO  31  34.206 -19.017  -5.127
  220    HB2  PRO  31           HB2      PRO  31  34.976 -21.284  -6.519
  221    HB3  PRO  31           HB3      PRO  31  33.851 -21.268  -5.127
  222    HG2  PRO  31           HG2      PRO  31  33.163 -21.251  -8.093
  223    HG3  PRO  31           HG3      PRO  31  32.494 -22.303  -6.801
  224    HD2  PRO  31           HD2      PRO  31  31.186 -20.100  -7.622
  225    HD3  PRO  31           HD3      PRO  31  31.223 -20.481  -5.891
  226    H    SER  32           H        SER  32  33.662 -18.630  -8.625
  227    HA   SER  32           HA       SER  32  36.374 -18.075  -9.382
  228    HB2  SER  32           HB2      SER  32  33.810 -17.029 -10.624
  229    HB3  SER  32           HB3      SER  32  35.376 -17.245 -11.418
  230    HG   SER  32           HG       SER  32  35.128 -19.519 -11.147
  231    H    GLY  33           H        GLY  33  34.364 -16.257  -7.337
  232    HA2  GLY  33           HA2      GLY  33  34.832 -14.188  -6.341
  233    HA3  GLY  33           HA3      GLY  33  35.942 -13.765  -7.669
  234    H    THR  34           H        THR  34  33.491 -14.769  -9.419
  235    HA   THR  34           HA       THR  34  32.376 -12.229 -10.100
  236    HB   THR  34           HB       THR  34  31.269 -14.991 -10.740
  237    HG1  THR  34           HG1      THR  34  32.681 -14.856 -12.547
  238   HG21  THR  34          1HG2      THR  34  30.609 -13.918 -12.886
  239   HG22  THR  34          2HG2      THR  34  31.214 -12.355 -12.294
  240   HG23  THR  34          3HG2      THR  34  29.819 -13.135 -11.513
  241    H    VAL  35           H        VAL  35  30.271 -11.398  -9.722
  242    HA   VAL  35           HA       VAL  35  28.767 -12.616  -7.426
  243    HB   VAL  35           HB       VAL  35  28.919  -9.694  -8.241
  244   HG11  VAL  35          1HG1      VAL  35  26.683 -10.197  -7.325
  245   HG12  VAL  35          2HG1      VAL  35  27.417 -11.048  -5.938
  246   HG13  VAL  35          3HG1      VAL  35  27.618  -9.296  -6.153
  247   HG21  VAL  35          3HG2      VAL  35  30.028  -9.423  -6.028
  248   HG22  VAL  35          1HG2      VAL  35  30.040 -11.180  -5.821
  249   HG23  VAL  35          2HG2      VAL  35  30.971 -10.421  -7.132
  250    H    MET  36           H        MET  36  26.646 -12.978  -7.618
  251    HA   MET  36           HA       MET  36  25.131 -12.286 -10.076
  252    HB2  MET  36           HB2      MET  36  26.362 -14.795  -9.645
  253    HB3  MET  36           HB3      MET  36  24.710 -15.052  -9.086
  254    HG2  MET  36           HG2      MET  36  24.891 -15.620 -11.439
  255    HG3  MET  36           HG3      MET  36  23.846 -14.226 -11.240
  256    HE1  MET  36           HE1      MET  36  28.093 -14.240 -13.117
  257    HE2  MET  36           HE2      MET  36  27.868 -14.566 -11.394
  258    HE3  MET  36           HE3      MET  36  27.176 -15.670 -12.602
  259    H    ASP  37           H        ASP  37  22.800 -12.677  -9.859
  260    HA   ASP  37           HA       ASP  37  21.642 -11.829  -7.358
  261    HB2  ASP  37           HB2      ASP  37  20.683 -11.339  -9.548
  262    HB3  ASP  37           HB3      ASP  37  20.481 -13.049  -9.878
  263    H    ARG  38           H        ARG  38  21.033 -12.948  -5.643
  264    HA   ARG  38           HA       ARG  38  21.545 -15.579  -4.982
  265    HB2  ARG  38           HB2      ARG  38  20.937 -13.808  -3.386
  266    HB3  ARG  38           HB3      ARG  38  19.301 -13.748  -4.023
  267    HG2  ARG  38           HG2      ARG  38  18.877 -16.057  -3.237
  268    HG3  ARG  38           HG3      ARG  38  20.544 -16.163  -2.628
  269    HD2  ARG  38           HD2      ARG  38  20.063 -14.271  -1.117
  270    HD3  ARG  38           HD3      ARG  38  18.402 -14.191  -1.755
  271    HE   ARG  38           HE       ARG  38  18.907 -16.824  -0.810
  272   HH11  ARG  38          1HH1      ARG  38  18.415 -13.572   0.541
  273   HH12  ARG  38          2HH1      ARG  38  17.772 -14.204   2.030
  274   HH21  ARG  38          1HH2      ARG  38  18.051 -17.546   1.132
  275   HH22  ARG  38          2HH2      ARG  38  17.579 -16.412   2.359
  276    H    SER  39           H        SER  39  18.371 -14.360  -6.206
  277    HA   SER  39           HA       SER  39  17.064 -16.919  -5.838
  278    HB2  SER  39           HB2      SER  39  16.230 -14.502  -7.498
  279    HB3  SER  39           HB3      SER  39  15.206 -15.881  -7.057
  280    HG   SER  39           HG       SER  39  14.927 -14.061  -5.647
  281    H    ILE  40           H        ILE  40  18.608 -15.289  -8.633
  282    HA   ILE  40           HA       ILE  40  17.817 -17.316 -10.563
  283    HB   ILE  40           HB       ILE  40  20.022 -15.216 -10.684
  284   HG12  ILE  40          2HG1      ILE  40  17.206 -15.252 -11.912
  285   HG13  ILE  40          3HG1      ILE  40  17.614 -14.386 -10.445
  286   HG21  ILE  40          1HG2      ILE  40  19.986 -15.577 -13.134
  287   HG22  ILE  40          2HG2      ILE  40  20.496 -17.027 -12.287
  288   HG23  ILE  40          3HG2      ILE  40  18.835 -16.921 -12.917
  289   HD11  ILE  40          3HD1      ILE  40  18.580 -13.773 -13.235
  290   HD12  ILE  40          1HD1      ILE  40  17.607 -12.774 -12.146
  291   HD13  ILE  40          2HD1      ILE  40  19.304 -13.065 -11.774
  292    H    ILE  41           H        ILE  41  20.872 -16.880  -8.649
  293    HA   ILE  41           HA       ILE  41  22.053 -19.231  -9.814
  294    HB   ILE  41           HB       ILE  41  23.421 -17.511  -8.743
  295   HG12  ILE  41          2HG1      ILE  41  25.007 -18.958  -7.562
  296   HG13  ILE  41          3HG1      ILE  41  23.815 -20.249  -7.438
  297   HG21  ILE  41          1HG2      ILE  41  22.071 -17.033  -6.719
  298   HG22  ILE  41          2HG2      ILE  41  22.519 -18.618  -6.042
  299   HG23  ILE  41          3HG2      ILE  41  23.749 -17.377  -6.332
  300   HD11  ILE  41          3HD1      ILE  41  25.501 -20.569  -9.251
  301   HD12  ILE  41          1HD1      ILE  41  23.845 -20.541  -9.870
  302   HD13  ILE  41          2HD1      ILE  41  24.887 -19.114 -10.062
  303    H    LEU  42           H        LEU  42  20.158 -18.901  -6.759
  304    HA   LEU  42           HA       LEU  42  20.397 -21.723  -6.213
  305    HB2  LEU  42           HB2      LEU  42  19.030 -21.406  -4.371
  306    HB3  LEU  42           HB3      LEU  42  19.978 -19.943  -4.540
  307    HG   LEU  42           HG       LEU  42  17.847 -18.967  -5.687
  308   HD11  LEU  42          1HD1      LEU  42  16.592 -21.251  -4.097
  309   HD12  LEU  42          2HD1      LEU  42  16.469 -21.012  -5.848
  310   HD13  LEU  42          3HD1      LEU  42  15.720 -19.845  -4.759
  311   HD21  LEU  42          3HD2      LEU  42  18.815 -18.306  -3.458
  312   HD22  LEU  42          1HD2      LEU  42  17.859 -19.581  -2.690
  313   HD23  LEU  42          2HD2      LEU  42  17.049 -18.207  -3.476
  314    H    ARG  43           H        ARG  43  18.012 -19.912  -8.147
  315    HA   ARG  43           HA       ARG  43  16.314 -22.187  -8.550
  316    HB2  ARG  43           HB2      ARG  43  15.517 -19.887  -8.914
  317    HB3  ARG  43           HB3      ARG  43  16.676 -19.667 -10.230
  318    HG2  ARG  43           HG2      ARG  43  14.388 -20.078 -11.046
  319    HG3  ARG  43           HG3      ARG  43  15.505 -21.329 -11.596
  320    HD2  ARG  43           HD2      ARG  43  14.660 -22.798  -9.670
  321    HD3  ARG  43           HD3      ARG  43  13.482 -21.535  -9.321
  322    HE   ARG  43           HE       ARG  43  12.265 -22.154 -11.212
  323   HH11  ARG  43          1HH1      ARG  43  15.375 -23.876 -11.340
  324   HH12  ARG  43          2HH1      ARG  43  14.777 -25.006 -12.527
  325   HH21  ARG  43          1HH2      ARG  43  11.604 -23.629 -12.744
  326   HH22  ARG  43          2HH2      ARG  43  12.700 -24.856 -13.318
  327    H    HIS  44           H        HIS  44  19.210 -21.018 -10.325
  328    HA   HIS  44           HA       HIS  44  18.968 -23.113 -12.313
  329    HB2  HIS  44           HB2      HIS  44  20.287 -20.962 -12.555
  330    HB3  HIS  44           HB3      HIS  44  21.545 -21.708 -11.555
  331    HD1  HIS  44           HD1      HIS  44  23.037 -23.609 -12.842
  332    HD2  HIS  44           HD2      HIS  44  19.660 -22.200 -14.922
  333    HE1  HIS  44           HE1      HIS  44  23.173 -24.587 -15.174
  334    H    LEU  45           H        LEU  45  20.692 -22.974  -9.144
  335    HA   LEU  45           HA       LEU  45  21.867 -25.559  -9.314
  336    HB2  LEU  45           HB2      LEU  45  20.899 -23.891  -6.973
  337    HB3  LEU  45           HB3      LEU  45  21.657 -25.459  -6.747
  338    HG   LEU  45           HG       LEU  45  23.008 -23.148  -8.217
  339   HD11  LEU  45          1HD1      LEU  45  22.627 -22.581  -5.856
  340   HD12  LEU  45          2HD1      LEU  45  24.346 -22.897  -6.148
  341   HD13  LEU  45          3HD1      LEU  45  23.337 -24.128  -5.352
  342   HD21  LEU  45          3HD2      LEU  45  24.052 -25.839  -7.221
  343   HD22  LEU  45          1HD2      LEU  45  25.073 -24.510  -7.789
  344   HD23  LEU  45          2HD2      LEU  45  23.960 -25.287  -8.912
  345    H    LEU  46           H        LEU  46  18.533 -24.685  -8.436
  346    HA   LEU  46           HA       LEU  46  17.674 -27.415  -7.941
  347    HB2  LEU  46           HB2      LEU  46  16.210 -24.851  -8.696
  348    HB3  LEU  46           HB3      LEU  46  15.374 -26.360  -8.360
  349    HG   LEU  46           HG       LEU  46  17.197 -24.991  -6.339
  350   HD11  LEU  46          1HD1      LEU  46  14.156 -24.887  -6.589
  351   HD12  LEU  46          2HD1      LEU  46  15.273 -23.535  -6.888
  352   HD13  LEU  46          3HD1      LEU  46  15.115 -24.206  -5.261
  353   HD21  LEU  46          3HD2      LEU  46  15.129 -27.222  -6.032
  354   HD22  LEU  46          1HD2      LEU  46  16.007 -26.445  -4.712
  355   HD23  LEU  46          2HD2      LEU  46  16.892 -27.399  -5.898
  356    H    ASN  47           H        ASN  47  18.391 -25.777 -10.933
  357    HA   ASN  47           HA       ASN  47  16.902 -27.747 -12.570
  358    HB2  ASN  47           HB2      ASN  47  16.932 -25.397 -13.268
  359    HB3  ASN  47           HB3      ASN  47  18.683 -25.398 -13.318
  360   HD21  ASN  47          1HD2      ASN  47  19.492 -25.567 -15.360
  361   HD22  ASN  47          2HD2      ASN  47  18.738 -26.493 -16.650
  362    H    SER  48           H        SER  48  20.324 -26.888 -11.831
  363    HA   SER  48           HA       SER  48  21.260 -29.632 -12.170
  364    HB2  SER  48           HB2      SER  48  21.831 -27.520 -14.272
  365    HB3  SER  48           HB3      SER  48  23.039 -28.756 -13.905
  366    HG   SER  48           HG       SER  48  20.340 -29.354 -14.609
  367    HA   PRO  49           HA       PRO  49  24.277 -27.841  -9.398
  368    HB2  PRO  49           HB2      PRO  49  26.177 -29.764  -9.225
  369    HB3  PRO  49           HB3      PRO  49  24.492 -30.062  -8.728
  370    HG2  PRO  49           HG2      PRO  49  25.764 -30.712 -11.410
  371    HG3  PRO  49           HG3      PRO  49  24.853 -31.828 -10.335
  372    HD2  PRO  49           HD2      PRO  49  23.655 -30.525 -12.420
  373    HD3  PRO  49           HD3      PRO  49  22.797 -30.833 -10.879
  374    H    THR  50           H        THR  50  24.353 -26.334 -11.504
  375    HA   THR  50           HA       THR  50  27.177 -25.890 -12.222
  376    HB   THR  50           HB       THR  50  26.483 -25.577 -14.643
  377    HG1  THR  50           HG1      THR  50  24.652 -26.852 -15.251
  378   HG21  THR  50          1HG2      THR  50  26.272 -28.450 -13.653
  379   HG22  THR  50          2HG2      THR  50  27.792 -27.553 -13.897
  380   HG23  THR  50          3HG2      THR  50  26.729 -27.884 -15.270
  381    H    ASP  51           H        ASP  51  27.629 -23.942 -13.192
  382    HA   ASP  51           HA       ASP  51  26.292 -21.640 -12.131
  383    HB2  ASP  51           HB2      ASP  51  28.703 -21.947 -12.430
  384    HB3  ASP  51           HB3      ASP  51  28.492 -21.986 -14.187
  385    HA   PRO  52           HA       PRO  52  23.262 -21.338 -15.449
  386    HB2  PRO  52           HB2      PRO  52  22.506 -18.646 -15.105
  387    HB3  PRO  52           HB3      PRO  52  21.816 -20.061 -14.290
  388    HG2  PRO  52           HG2      PRO  52  23.897 -18.151 -13.289
  389    HG3  PRO  52           HG3      PRO  52  22.587 -18.938 -12.367
  390    HD2  PRO  52           HD2      PRO  52  25.173 -19.798 -12.266
  391    HD3  PRO  52           HD3      PRO  52  23.816 -20.957 -12.199
  392    H    PHE  53           H        PHE  53  25.982 -19.041 -15.336
  393    HA   PHE  53           HA       PHE  53  25.324 -18.042 -18.050
  394    HB2  PHE  53           HB2      PHE  53  27.154 -17.040 -15.843
  395    HB3  PHE  53           HB3      PHE  53  27.014 -16.284 -17.418
  396    HD1  PHE  53           HD2      PHE  53  24.813 -15.346 -18.195
  397    HD2  PHE  53           HD1      PHE  53  25.462 -16.638 -14.130
  398    HE1  PHE  53           HE2      PHE  53  22.823 -14.051 -17.470
  399    HE2  PHE  53           HE1      PHE  53  23.435 -15.353 -13.422
  400    HZ   PHE  53           HZ       PHE  53  22.155 -14.055 -15.074
  401    H    ASN  54           H        ASN  54  27.306 -20.475 -16.904
  402    HA   ASN  54           HA       ASN  54  28.806 -20.583 -19.418
  403    HB2  ASN  54           HB2      ASN  54  31.043 -20.476 -18.420
  404    HB3  ASN  54           HB3      ASN  54  30.165 -18.962 -18.201
  405   HD21  ASN  54          1HD2      ASN  54  30.067 -18.146 -16.091
  406   HD22  ASN  54          2HD2      ASN  54  30.292 -19.129 -14.658
  407    H    ARG  55           H        ARG  55  27.795 -22.146 -16.484
  408    HA   ARG  55           HA       ARG  55  27.363 -24.241 -16.030
  409    HB2  ARG  55           HB2      ARG  55  28.184 -25.014 -18.851
  410    HB3  ARG  55           HB3      ARG  55  27.170 -25.941 -17.759
  411    HG2  ARG  55           HG2      ARG  55  26.442 -23.216 -18.903
  412    HG3  ARG  55           HG3      ARG  55  25.879 -24.753 -19.524
  413    HD2  ARG  55           HD2      ARG  55  24.478 -25.175 -17.707
  414    HD3  ARG  55           HD3      ARG  55  25.332 -24.093 -16.631
  415    HE   ARG  55           HE       ARG  55  24.308 -22.218 -17.509
  416   HH11  ARG  55          1HH1      ARG  55  23.121 -25.058 -19.291
  417   HH12  ARG  55          2HH1      ARG  55  21.801 -24.150 -19.977
  418   HH21  ARG  55          1HH2      ARG  55  22.638 -21.148 -18.449
  419   HH22  ARG  55          2HH2      ARG  55  21.534 -21.970 -19.515
  420    H    GLN  56           H        GLN  56  30.111 -23.198 -15.574
  421    HA   GLN  56           HA       GLN  56  31.710 -25.592 -15.135
  422    HB2  GLN  56           HB2      GLN  56  32.913 -24.315 -13.515
  423    HB3  GLN  56           HB3      GLN  56  32.609 -23.266 -14.900
  424    HG2  GLN  56           HG2      GLN  56  30.744 -22.191 -13.654
  425    HG3  GLN  56           HG3      GLN  56  31.025 -23.235 -12.282
  426   HE21  GLN  56          1HE2      GLN  56  31.147 -20.236 -12.461
  427   HE22  GLN  56          2HE2      GLN  56  32.781 -19.869 -11.889
  428    H    MET  57           H        MET  57  31.865 -26.756 -13.065
  429    HA   MET  57           HA       MET  57  29.311 -27.502 -11.972
  430    HB2  MET  57           HB2      MET  57  31.312 -28.977 -12.224
  431    HB3  MET  57           HB3      MET  57  32.107 -28.099 -10.915
  432    HG2  MET  57           HG2      MET  57  29.395 -29.451 -10.583
  433    HG3  MET  57           HG3      MET  57  30.905 -30.334 -10.423
  434    HE1  MET  57           HE1      MET  57  29.653 -30.174  -6.763
  435    HE2  MET  57           HE2      MET  57  28.637 -30.269  -8.219
  436    HE3  MET  57           HE3      MET  57  30.152 -31.206  -8.127
  437    H    LEU  58           H        LEU  58  28.269 -26.931 -10.140
  438    HA   LEU  58           HA       LEU  58  29.386 -24.909  -8.290
  439    HB2  LEU  58           HB2      LEU  58  28.168 -24.052 -10.581
  440    HB3  LEU  58           HB3      LEU  58  26.741 -24.272  -9.601
  441    HG   LEU  58           HG       LEU  58  27.426 -21.979  -9.629
  442   HD11  LEU  58          1HD1      LEU  58  28.185 -22.994  -6.864
  443   HD12  LEU  58          2HD1      LEU  58  26.517 -22.776  -7.451
  444   HD13  LEU  58          3HD1      LEU  58  27.605 -21.387  -7.315
  445   HD21  LEU  58          3HD2      LEU  58  30.107 -22.775  -8.433
  446   HD22  LEU  58          1HD2      LEU  58  29.536 -21.133  -8.812
  447   HD23  LEU  58          2HD2      LEU  58  29.829 -22.290 -10.123
  448    H    THR  59           H        THR  59  28.284 -24.813  -6.304
  449    HA   THR  59           HA       THR  59  25.915 -26.513  -5.796
  450    HB   THR  59           HB       THR  59  28.447 -26.814  -4.117
  451    HG1  THR  59           HG1      THR  59  27.449 -28.375  -6.263
  452   HG21  THR  59          1HG2      THR  59  27.306 -28.934  -3.379
  453   HG22  THR  59          2HG2      THR  59  25.850 -28.418  -4.265
  454   HG23  THR  59          3HG2      THR  59  26.453 -27.476  -2.888
  455    H    GLU  60           H        GLU  60  24.830 -25.934  -3.832
  456    HA   GLU  60           HA       GLU  60  24.801 -23.200  -3.185
  457    HB2  GLU  60           HB2      GLU  60  23.268 -23.817  -1.402
  458    HB3  GLU  60           HB3      GLU  60  22.906 -24.696  -2.876
  459    HG2  GLU  60           HG2      GLU  60  24.041 -26.717  -1.955
  460    HG3  GLU  60           HG3      GLU  60  24.394 -25.846  -0.465
  461    H    SER  61           H        SER  61  26.898 -25.681  -1.845
  462    HA   SER  61           HA       SER  61  27.702 -24.244   0.555
  463    HB2  SER  61           HB2      SER  61  29.516 -25.993   0.538
  464    HB3  SER  61           HB3      SER  61  27.879 -26.638   0.504
  465    HG   SER  61           HG       SER  61  29.284 -27.678  -1.021
  466    H    MET  62           H        MET  62  28.502 -23.852  -2.785
  467    HA   MET  62           HA       MET  62  31.159 -22.641  -2.307
  468    HB2  MET  62           HB2      MET  62  29.532 -22.716  -4.874
  469    HB3  MET  62           HB3      MET  62  31.260 -22.406  -4.693
  470    HG2  MET  62           HG2      MET  62  29.867 -25.048  -4.144
  471    HG3  MET  62           HG3      MET  62  30.804 -24.652  -5.577
  472    HE1  MET  62           HE1      MET  62  32.035 -26.979  -5.205
  473    HE2  MET  62           HE2      MET  62  32.869 -27.406  -3.692
  474    HE3  MET  62           HE3      MET  62  31.101 -27.226  -3.712
  475    H    LEU  63           H        LEU  63  27.970 -21.579  -2.073
  476    HA   LEU  63           HA       LEU  63  28.314 -18.877  -3.183
  477    HB2  LEU  63           HB2      LEU  63  25.998 -20.186  -1.710
  478    HB3  LEU  63           HB3      LEU  63  25.945 -18.651  -2.544
  479    HG   LEU  63           HG       LEU  63  26.267 -21.413  -3.798
  480   HD11  LEU  63          1HD1      LEU  63  24.083 -19.301  -3.988
  481   HD12  LEU  63          2HD1      LEU  63  23.994 -20.825  -3.081
  482   HD13  LEU  63          3HD1      LEU  63  24.104 -20.845  -4.847
  483   HD21  LEU  63          3HD2      LEU  63  26.154 -20.253  -6.004
  484   HD22  LEU  63          1HD2      LEU  63  27.652 -19.915  -5.142
  485   HD23  LEU  63          2HD2      LEU  63  26.349 -18.688  -5.182
  486    H    GLU  64           H        GLU  64  28.043 -16.959  -2.043
  487    HA   GLU  64           HA       GLU  64  27.825 -16.927   0.872
  488    HB2  GLU  64           HB2      GLU  64  30.216 -17.279   0.613
  489    HB3  GLU  64           HB3      GLU  64  30.344 -15.924  -0.520
  490    HG2  GLU  64           HG2      GLU  64  29.726 -14.339   1.288
  491    HG3  GLU  64           HG3      GLU  64  29.469 -15.697   2.396
  492    HA   PRO  65           HA       PRO  65  25.709 -13.287  -0.811
  493    HB2  PRO  65           HB2      PRO  65  24.612 -12.231   1.459
  494    HB3  PRO  65           HB3      PRO  65  23.997 -13.712   0.680
  495    HG2  PRO  65           HG2      PRO  65  25.894 -13.504   3.028
  496    HG3  PRO  65           HG3      PRO  65  24.432 -14.531   2.871
  497    HD2  PRO  65           HD2      PRO  65  26.951 -15.488   2.398
  498    HD3  PRO  65           HD3      PRO  65  25.546 -16.049   1.434
  499    H    VAL  66           H        VAL  66  26.327 -11.193  -1.208
  500    HA   VAL  66           HA       VAL  66  28.908 -10.393  -0.017
  501    HB   VAL  66           HB       VAL  66  27.434  -9.103  -2.337
  502   HG11  VAL  66          1HG1      VAL  66  29.048  -7.565  -1.286
  503   HG12  VAL  66          2HG1      VAL  66  30.293  -8.822  -1.313
  504   HG13  VAL  66          3HG1      VAL  66  29.689  -8.133  -2.830
  505   HG21  VAL  66          3HG2      VAL  66  28.068 -11.438  -2.878
  506   HG22  VAL  66          1HG2      VAL  66  29.063 -10.278  -3.770
  507   HG23  VAL  66          2HG2      VAL  66  29.728 -11.090  -2.334
  508    HA   PRO  67           HA       PRO  67  26.539  -7.387   2.454
  509    HB2  PRO  67           HB2      PRO  67  28.462  -6.665   4.245
  510    HB3  PRO  67           HB3      PRO  67  27.684  -8.278   4.296
  511    HG2  PRO  67           HG2      PRO  67  30.365  -7.539   3.070
  512    HG3  PRO  67           HG3      PRO  67  29.987  -8.914   4.147
  513    HD2  PRO  67           HD2      PRO  67  30.082  -9.185   1.409
  514    HD3  PRO  67           HD3      PRO  67  28.949 -10.116   2.435
  515    H    GLU  68           H        GLU  68  29.813  -6.544   1.140
  516    HA   GLU  68           HA       GLU  68  29.427  -3.753   1.485
  517    HB2  GLU  68           HB2      GLU  68  31.334  -3.451   0.021
  518    HB3  GLU  68           HB3      GLU  68  31.615  -4.692   1.240
  519    HG2  GLU  68           HG2      GLU  68  31.245  -6.461  -0.475
  520    HG3  GLU  68           HG3      GLU  68  30.998  -5.205  -1.706
  521    H    LEU  69           H        LEU  69  28.583  -5.825  -1.306
  522    HA   LEU  69           HA       LEU  69  27.566  -3.586  -2.878
  523    HB2  LEU  69           HB2      LEU  69  27.270  -6.604  -3.118
  524    HB3  LEU  69           HB3      LEU  69  26.522  -5.482  -4.232
  525    HG   LEU  69           HG       LEU  69  29.531  -5.715  -3.764
  526   HD11  LEU  69          1HD1      LEU  69  28.553  -7.680  -4.877
  527   HD12  LEU  69          2HD1      LEU  69  29.562  -6.759  -5.997
  528   HD13  LEU  69          3HD1      LEU  69  27.789  -6.634  -6.095
  529   HD21  LEU  69          3HD2      LEU  69  28.997  -3.435  -4.480
  530   HD22  LEU  69          1HD2      LEU  69  27.938  -4.048  -5.771
  531   HD23  LEU  69          2HD2      LEU  69  29.690  -4.315  -5.838
  532    H    LYS  70           H        LYS  70  25.989  -6.053  -0.751
  533    HA   LYS  70           HA       LYS  70  23.338  -5.127  -1.249
  534    HB2  LYS  70           HB2      LYS  70  23.939  -7.269  -0.209
  535    HB3  LYS  70           HB3      LYS  70  24.514  -6.428   1.244
  536    HG2  LYS  70           HG2      LYS  70  22.213  -5.633   1.704
  537    HG3  LYS  70           HG3      LYS  70  21.655  -6.265   0.152
  538    HD2  LYS  70           HD2      LYS  70  20.962  -7.755   1.934
  539    HD3  LYS  70           HD3      LYS  70  22.130  -8.577   0.888
  540    HE2  LYS  70           HE2      LYS  70  23.926  -8.146   2.533
  541    HE3  LYS  70           HE3      LYS  70  22.805  -7.214   3.542
  542    HZ1  LYS  70           HZ1      LYS  70  21.507  -9.239   3.861
  543    HZ2  LYS  70           HZ2      LYS  70  23.047  -9.477   4.355
  544    HZ3  LYS  70           HZ3      LYS  70  22.541 -10.105   2.935
  545    H    GLU  71           H        GLU  71  25.672  -4.069   1.255
  546    HA   GLU  71           HA       GLU  71  23.989  -2.135   2.522
  547    HB2  GLU  71           HB2      GLU  71  26.036  -3.147   3.480
  548    HB3  GLU  71           HB3      GLU  71  27.030  -2.196   2.354
  549    HG2  GLU  71           HG2      GLU  71  26.145  -0.103   3.358
  550    HG3  GLU  71           HG3      GLU  71  25.109  -1.053   4.434
  551    H    GLN  72           H        GLN  72  26.214  -1.904  -0.281
  552    HA   GLN  72           HA       GLN  72  25.814   1.001  -0.599
  553    HB2  GLN  72           HB2      GLN  72  26.992  -1.164  -2.383
  554    HB3  GLN  72           HB3      GLN  72  26.790   0.493  -2.927
  555    HG2  GLN  72           HG2      GLN  72  28.399  -0.237  -0.440
  556    HG3  GLN  72           HG3      GLN  72  29.091  -0.054  -2.054
  557   HE21  GLN  72          1HE2      GLN  72  27.956   1.673   0.790
  558   HE22  GLN  72          2HE2      GLN  72  28.260   3.281   0.145
  559    H    ILE  73           H        ILE  73  24.277  -1.871  -2.065
  560    HA   ILE  73           HA       ILE  73  22.576  -0.459  -3.879
  561    HB   ILE  73           HB       ILE  73  22.482  -3.194  -2.567
  562   HG12  ILE  73          2HG1      ILE  73  22.730  -2.369  -5.500
  563   HG13  ILE  73          3HG1      ILE  73  24.124  -2.561  -4.445
  564   HG21  ILE  73          1HG2      ILE  73  20.155  -2.739  -2.810
  565   HG22  ILE  73          2HG2      ILE  73  20.378  -1.968  -4.401
  566   HG23  ILE  73          3HG2      ILE  73  20.580  -3.712  -4.201
  567   HD11  ILE  73          3HD1      ILE  73  23.900  -4.570  -5.724
  568   HD12  ILE  73          1HD1      ILE  73  23.480  -4.943  -4.043
  569   HD13  ILE  73          2HD1      ILE  73  22.203  -4.770  -5.280
  570    H    GLN  74           H        GLN  74  21.867  -1.516  -0.497
  571    HA   GLN  74           HA       GLN  74  19.256  -0.300  -0.547
  572    HB2  GLN  74           HB2      GLN  74  19.149  -0.768   1.813
  573    HB3  GLN  74           HB3      GLN  74  19.839  -2.135   0.954
  574    HG2  GLN  74           HG2      GLN  74  21.258  -2.056   2.764
  575    HG3  GLN  74           HG3      GLN  74  22.153  -1.112   1.610
  576   HE21  GLN  74          1HE2      GLN  74  23.186   0.538   2.698
  577   HE22  GLN  74          2HE2      GLN  74  22.440   1.500   3.977
  578    H    ALA  75           H        ALA  75  22.445   1.060   0.263
  579    HA   ALA  75           HA       ALA  75  21.434   3.566   1.271
  580    HB1  ALA  75           HB1      ALA  75  24.090   2.872  -0.058
  581    HB2  ALA  75           HB2      ALA  75  23.742   4.350   0.854
  582    HB3  ALA  75           HB3      ALA  75  23.745   2.781   1.683
  583    H    TRP  76           H        TRP  76  22.236   2.409  -2.032
  584    HA   TRP  76           HA       TRP  76  21.752   4.966  -3.312
  585    HB2  TRP  76           HB2      TRP  76  23.206   3.194  -4.227
  586    HB3  TRP  76           HB3      TRP  76  21.807   2.137  -4.422
  587    HD1  TRP  76           HD1      TRP  76  23.443   5.282  -5.857
  588    HE1  TRP  76           HE1      TRP  76  22.502   5.792  -8.187
  589    HE3  TRP  76           HE3      TRP  76  19.724   1.758  -6.012
  590    HZ2  TRP  76           HZ2      TRP  76  20.354   4.850  -9.871
  591    HZ3  TRP  76           HZ3      TRP  76  18.239   1.611  -7.977
  592    HH2  TRP  76           HH2      TRP  76  18.525   3.162  -9.908
  593    H    MET  77           H        MET  77  19.723   1.989  -2.999
  594    HA   MET  77           HA       MET  77  17.410   2.968  -4.328
  595    HB2  MET  77           HB2      MET  77  17.666   0.945  -2.068
  596    HB3  MET  77           HB3      MET  77  16.172   1.269  -2.953
  597    HG2  MET  77           HG2      MET  77  17.380   0.719  -5.103
  598    HG3  MET  77           HG3      MET  77  18.739   0.159  -4.138
  599    HE1  MET  77           HE1      MET  77  18.371  -1.650  -2.179
  600    HE2  MET  77           HE2      MET  77  16.747  -1.214  -1.622
  601    HE3  MET  77           HE3      MET  77  17.066  -2.870  -2.187
  602    H    ARG  78           H        ARG  78  18.400   3.515  -0.933
  603    HA   ARG  78           HA       ARG  78  16.043   4.705   0.065
  604    HB2  ARG  78           HB2      ARG  78  18.095   4.178   1.381
  605    HB3  ARG  78           HB3      ARG  78  18.931   5.520   0.591
  606    HG2  ARG  78           HG2      ARG  78  17.130   7.070   1.526
  607    HG3  ARG  78           HG3      ARG  78  16.520   5.678   2.443
  608    HD2  ARG  78           HD2      ARG  78  18.742   5.461   3.539
  609    HD3  ARG  78           HD3      ARG  78  19.361   6.802   2.591
  610    HE   ARG  78           HE       ARG  78  17.585   6.909   4.917
  611   HH11  ARG  78          1HH1      ARG  78  18.783   8.871   2.162
  612   HH12  ARG  78          2HH1      ARG  78  18.376  10.346   2.979
  613   HH21  ARG  78          1HH2      ARG  78  17.071   8.854   5.837
  614   HH22  ARG  78          2HH2      ARG  78  17.406  10.345   4.995
  615    H    GLU  79           H        GLU  79  18.696   6.239  -1.852
  616    HA   GLU  79           HA       GLU  79  17.468   8.849  -1.771
  617    HB2  GLU  79           HB2      GLU  79  19.595   7.860  -3.709
  618    HB3  GLU  79           HB3      GLU  79  19.187   9.531  -3.321
  619    HG2  GLU  79           HG2      GLU  79  20.507   7.483  -1.510
  620    HG3  GLU  79           HG3      GLU  79  21.216   8.941  -2.161
  621    H    LYS  80           H        LYS  80  17.030   6.095  -3.966
  622    HA   LYS  80           HA       LYS  80  15.662   7.611  -6.034
  623    HB2  LYS  80           HB2      LYS  80  15.544   4.634  -5.392
  624    HB3  LYS  80           HB3      LYS  80  15.002   5.400  -6.877
  625    HG2  LYS  80           HG2      LYS  80  17.855   5.106  -5.895
  626    HG3  LYS  80           HG3      LYS  80  17.111   4.314  -7.273
  627    HD2  LYS  80           HD2      LYS  80  17.695   7.301  -7.035
  628    HD3  LYS  80           HD3      LYS  80  18.666   6.117  -7.912
  629    HE2  LYS  80           HE2      LYS  80  16.749   5.602  -9.407
  630    HE3  LYS  80           HE3      LYS  80  15.751   6.773  -8.536
  631    HZ1  LYS  80           HZ1      LYS  80  17.351   8.509  -9.217
  632    HZ2  LYS  80           HZ2      LYS  80  16.675   7.781 -10.507
  633    HZ3  LYS  80           HZ3      LYS  80  18.211   7.417 -10.079
  634    H    GLN  81           H        GLN  81  14.589   6.045  -3.070
  635    HA   GLN  81           HA       GLN  81  11.746   6.487  -3.795
  636    HB2  GLN  81           HB2      GLN  81  11.197   4.886  -2.180
  637    HB3  GLN  81           HB3      GLN  81  12.606   4.270  -3.030
  638    HG2  GLN  81           HG2      GLN  81  14.017   5.174  -1.082
  639    HG3  GLN  81           HG3      GLN  81  12.494   5.448  -0.226
  640   HE21  GLN  81          1HE2      GLN  81  14.541   2.946  -1.786
  641   HE22  GLN  81          2HE2      GLN  81  13.891   1.606  -0.841
  642    H    SER  82           H        SER  82  14.124   7.937  -1.634
  643    HA   SER  82           HA       SER  82  12.149   9.194   0.106
  644    HB2  SER  82           HB2      SER  82  15.121   9.731  -0.222
  645    HB3  SER  82           HB3      SER  82  14.070  10.399   1.041
  646    HG   SER  82           HG       SER  82  14.780   7.676   0.590
  647    H    SER  83           H        SER  83  11.034   9.870  -2.114
  648    HA   SER  83           HA       SER  83  11.904  12.428  -3.254
  649    HB2  SER  83           HB2      SER  83   9.660  12.334  -4.342
  650    HB3  SER  83           HB3      SER  83  10.646  10.889  -4.606
  651    HG   SER  83           HG       SER  83   8.473  10.363  -4.075
  652    H    ASP  84           H        ASP  84  10.114  11.555  -0.404
  653    HA   ASP  84           HA       ASP  84   9.177  14.354   0.050
  654    HB2  ASP  84           HB2      ASP  84   7.493  12.582   0.291
  655    HB3  ASP  84           HB3      ASP  84   8.507  11.766   1.485
  656    H    HIS  85           H        HIS  85   9.875  15.539   1.805
  657    HA   HIS  85           HA       HIS  85  11.678  14.524   3.834
  658    HB2  HIS  85           HB2      HIS  85  13.589  15.988   3.217
  659    HB3  HIS  85           HB3      HIS  85  13.317  14.660   2.100
  660    HD1  HIS  85           HD1      HIS  85  11.324  17.927   1.793
  661    HD2  HIS  85           HD2      HIS  85  14.527  15.844   0.041
  662    HE1  HIS  85           HE1      HIS  85  11.863  19.159  -0.401
  Start of MODEL   10
    1    H2   PRO   1           H2       PRO   1  -0.238  12.568  -1.854
    2    H3   PRO   1           H3       PRO   1  -0.857  11.086  -1.483
    3    HA   PRO   1           HA       PRO   1  -1.039  10.458  -3.719
    4    HB2  PRO   1           HB2      PRO   1  -0.304  13.213  -4.685
    5    HB3  PRO   1           HB3      PRO   1  -1.415  12.014  -5.416
    6    HG2  PRO   1           HG2      PRO   1  -2.018  14.177  -3.537
    7    HG3  PRO   1           HG3      PRO   1  -3.176  12.992  -4.219
    8    HD2  PRO   1           HD2      PRO   1  -2.531  13.057  -1.557
    9    HD3  PRO   1           HD3      PRO   1  -2.954  11.555  -2.429
   10    H    GLY   2           H        GLY   2   0.663  10.211  -5.474
   11    HA2  GLY   2           HA2      GLY   2   2.859  10.027  -6.215
   12    HA3  GLY   2           HA3      GLY   2   3.427  10.976  -4.830
   13    H    SER   3           H        SER   3   1.392   8.280  -4.090
   14    HA   SER   3           HA       SER   3   3.340   7.201  -2.344
   15    HB2  SER   3           HB2      SER   3   0.683   5.968  -3.145
   16    HB3  SER   3           HB3      SER   3   1.582   5.732  -1.630
   17    HG   SER   3           HG       SER   3  -0.145   7.221  -1.368
   18    H    ALA   4           H        ALA   4   2.998   6.447  -5.637
   19    HA   ALA   4           HA       ALA   4   3.488   3.607  -5.600
   20    HB1  ALA   4           HB1      ALA   4   2.426   4.777  -7.501
   21    HB2  ALA   4           HB2      ALA   4   3.936   5.692  -7.794
   22    HB3  ALA   4           HB3      ALA   4   3.895   3.934  -8.031
   23    H    GLU   5           H        GLU   5   5.351   2.497  -6.375
   24    HA   GLU   5           HA       GLU   5   7.786   3.159  -5.045
   25    HB2  GLU   5           HB2      GLU   5   7.218   1.094  -7.225
   26    HB3  GLU   5           HB3      GLU   5   8.699   1.209  -6.296
   27    HG2  GLU   5           HG2      GLU   5   7.443  -0.513  -5.287
   28    HG3  GLU   5           HG3      GLU   5   7.420   0.859  -4.188
   29    H    ILE   6           H        ILE   6   9.858   3.632  -5.858
   30    HA   ILE   6           HA       ILE   6   9.972   5.422  -8.197
   31    HB   ILE   6           HB       ILE   6  12.075   4.524  -6.183
   32   HG12  ILE   6          2HG1      ILE   6  12.103   6.976  -5.597
   33   HG13  ILE   6          3HG1      ILE   6  10.680   7.213  -6.606
   34   HG21  ILE   6          1HG2      ILE   6  13.527   6.296  -7.201
   35   HG22  ILE   6          2HG2      ILE   6  13.259   4.934  -8.263
   36   HG23  ILE   6          3HG2      ILE   6  12.357   6.454  -8.526
   37   HD11  ILE   6          3HD1      ILE   6   9.310   5.956  -5.069
   38   HD12  ILE   6          1HD1      ILE   6  10.739   5.308  -4.224
   39   HD13  ILE   6          2HD1      ILE   6  10.303   7.025  -4.092
   40    H    ASP   7           H        ASP   7  10.818   4.988 -10.166
   41    HA   ASP   7           HA       ASP   7  11.399   2.214 -10.929
   42    HB2  ASP   7           HB2      ASP   7  10.076   3.785 -12.351
   43    HB3  ASP   7           HB3      ASP   7  11.517   4.773 -12.568
   44    H    TYR   8           H        TYR   8  13.372   1.319 -10.980
   45    HA   TYR   8           HA       TYR   8  15.767   3.048 -10.559
   46    HB2  TYR   8           HB2      TYR   8  15.408   0.108  -9.907
   47    HB3  TYR   8           HB3      TYR   8  16.791   1.118  -9.553
   48    HD1  TYR   8           HD2      TYR   8  16.133   3.438  -8.207
   49    HD2  TYR   8           HD1      TYR   8  13.989  -0.317  -8.074
   50    HE1  TYR   8           HE2      TYR   8  15.178   4.043  -5.997
   51    HE2  TYR   8           HE1      TYR   8  13.054   0.297  -5.854
   52    HH   TYR   8           HH       TYR   8  12.957   1.876  -4.194
   53    H    SER   9           H        SER   9  14.622   2.410 -13.321
   54    HA   SER   9           HA       SER   9  16.454   0.684 -14.690
   55    HB2  SER   9           HB2      SER   9  15.117   3.211 -15.732
   56    HB3  SER   9           HB3      SER   9  15.878   1.949 -16.716
   57    HG   SER   9           HG       SER   9  13.522   1.856 -15.155
   58    H    ASP  10           H        ASP  10  17.049   3.802 -13.297
   59    HA   ASP  10           HA       ASP  10  19.441   4.488 -14.804
   60    HB2  ASP  10           HB2      ASP  10  18.422   5.391 -12.074
   61    HB3  ASP  10           HB3      ASP  10  19.751   6.145 -12.957
   62    H    ALA  11           H        ALA  11  18.919   2.003 -12.493
   63    HA   ALA  11           HA       ALA  11  21.229   2.205 -10.888
   64    HB1  ALA  11           HB1      ALA  11  19.331   0.792 -10.289
   65    HB2  ALA  11           HB2      ALA  11  19.617  -0.247 -11.699
   66    HB3  ALA  11           HB3      ALA  11  20.812  -0.185 -10.378
   67    HA   PRO  12           HA       PRO  12  24.449   1.001 -13.737
   68    HB2  PRO  12           HB2      PRO  12  26.507   0.451 -12.046
   69    HB3  PRO  12           HB3      PRO  12  25.839   2.098 -12.233
   70    HG2  PRO  12           HG2      PRO  12  25.135   0.050 -10.096
   71    HG3  PRO  12           HG3      PRO  12  25.628   1.755  -9.847
   72    HD2  PRO  12           HD2      PRO  12  23.009   1.045  -9.920
   73    HD3  PRO  12           HD3      PRO  12  23.572   2.578 -10.658
   74    H    ASP  13           H        ASP  13  25.648  -0.838 -14.473
   75    HA   ASP  13           HA       ASP  13  24.229  -3.265 -14.430
   76    HB2  ASP  13           HB2      ASP  13  25.693  -2.441 -16.239
   77    HB3  ASP  13           HB3      ASP  13  27.110  -2.708 -15.211
   78    H    GLU  14           H        GLU  14  26.854  -2.224 -12.316
   79    HA   GLU  14           HA       GLU  14  27.527  -4.840 -11.278
   80    HB2  GLU  14           HB2      GLU  14  28.881  -3.650  -9.664
   81    HB3  GLU  14           HB3      GLU  14  29.094  -2.967 -11.272
   82    HG2  GLU  14           HG2      GLU  14  27.473  -1.120 -10.613
   83    HG3  GLU  14           HG3      GLU  14  27.464  -1.790  -8.977
   84    H    PHE  15           H        PHE  15  24.864  -2.735 -10.617
   85    HA   PHE  15           HA       PHE  15  24.150  -4.182  -8.102
   86    HB2  PHE  15           HB2      PHE  15  22.966  -1.726  -9.449
   87    HB3  PHE  15           HB3      PHE  15  22.327  -2.467  -8.005
   88    HD1  PHE  15           HD2      PHE  15  25.692  -2.774  -7.242
   89    HD2  PHE  15           HD1      PHE  15  22.666   0.245  -7.836
   90    HE1  PHE  15           HE2      PHE  15  26.976  -1.219  -5.834
   91    HE2  PHE  15           HE1      PHE  15  23.985   1.815  -6.446
   92    HZ   PHE  15           HZ       PHE  15  26.138   1.098  -5.442
   93    H    ARG  16           H        ARG  16  23.799  -4.730 -11.353
   94    HA   ARG  16           HA       ARG  16  20.970  -5.665 -11.127
   95    HB2  ARG  16           HB2      ARG  16  22.536  -4.527 -13.469
   96    HB3  ARG  16           HB3      ARG  16  20.998  -5.379 -13.673
   97    HG2  ARG  16           HG2      ARG  16  19.762  -3.751 -12.491
   98    HG3  ARG  16           HG3      ARG  16  21.192  -3.060 -11.730
   99    HD2  ARG  16           HD2      ARG  16  20.418  -1.533 -13.359
  100    HD3  ARG  16           HD3      ARG  16  21.960  -2.200 -13.912
  101    HE   ARG  16           HE       ARG  16  20.054  -3.774 -15.168
  102   HH11  ARG  16          1HH1      ARG  16  20.741  -0.294 -15.078
  103   HH12  ARG  16          2HH1      ARG  16  20.028  -0.024 -16.637
  104   HH21  ARG  16          1HH2      ARG  16  19.276  -3.382 -17.252
  105   HH22  ARG  16          2HH2      ARG  16  19.238  -1.749 -17.860
  106    H    ASP  17           H        ASP  17  20.330  -7.553 -12.062
  107    HA   ASP  17           HA       ASP  17  22.381  -9.629 -12.550
  108    HB2  ASP  17           HB2      ASP  17  20.322 -11.099 -12.930
  109    HB3  ASP  17           HB3      ASP  17  20.730 -10.562 -11.312
  110    HA   PRO  18           HA       PRO  18  22.263  -8.991 -16.915
  111    HB2  PRO  18           HB2      PRO  18  23.310 -11.323 -17.889
  112    HB3  PRO  18           HB3      PRO  18  24.255 -10.141 -16.925
  113    HG2  PRO  18           HG2      PRO  18  22.882 -12.683 -15.984
  114    HG3  PRO  18           HG3      PRO  18  24.557 -12.131 -15.646
  115    HD2  PRO  18           HD2      PRO  18  22.470 -11.736 -13.891
  116    HD3  PRO  18           HD3      PRO  18  23.798 -10.553 -14.059
  117    H    LEU  19           H        LEU  19  20.748 -12.079 -15.857
  118    HA   LEU  19           HA       LEU  19  19.427 -12.521 -18.411
  119    HB2  LEU  19           HB2      LEU  19  20.306 -14.339 -17.154
  120    HB3  LEU  19           HB3      LEU  19  19.432 -13.880 -15.693
  121    HG   LEU  19           HG       LEU  19  17.297 -14.532 -16.741
  122   HD11  LEU  19          1HD1      LEU  19  19.044 -15.490 -19.058
  123   HD12  LEU  19          2HD1      LEU  19  17.848 -14.177 -19.147
  124   HD13  LEU  19          3HD1      LEU  19  17.311 -15.840 -18.862
  125   HD21  LEU  19          3HD2      LEU  19  17.690 -16.955 -16.694
  126   HD22  LEU  19          1HD2      LEU  19  18.553 -16.126 -15.385
  127   HD23  LEU  19          2HD2      LEU  19  19.447 -16.686 -16.813
  128    H    MET  20           H        MET  20  18.283 -11.495 -15.177
  129    HA   MET  20           HA       MET  20  15.546 -11.038 -16.240
  130    HB2  MET  20           HB2      MET  20  16.740 -11.003 -13.446
  131    HB3  MET  20           HB3      MET  20  15.106 -10.482 -13.806
  132    HG2  MET  20           HG2      MET  20  14.612 -12.697 -14.810
  133    HG3  MET  20           HG3      MET  20  16.262 -13.217 -14.480
  134    HE1  MET  20           HE1      MET  20  12.953 -12.567 -11.295
  135    HE2  MET  20           HE2      MET  20  13.661 -11.182 -12.148
  136    HE3  MET  20           HE3      MET  20  12.738 -12.401 -13.054
  137    H    ASP  21           H        ASP  21  18.383  -9.188 -15.874
  138    HA   ASP  21           HA       ASP  21  18.916  -7.047 -16.234
  139    HB2  ASP  21           HB2      ASP  21  17.736  -7.631 -18.362
  140    HB3  ASP  21           HB3      ASP  21  16.274  -6.868 -17.723
  141    H    THR  22           H        THR  22  17.633  -7.521 -13.716
  142    HA   THR  22           HA       THR  22  16.506  -4.804 -13.130
  143    HB   THR  22           HB       THR  22  14.756  -6.584 -13.232
  144    HG1  THR  22           HG1      THR  22  13.783  -5.761 -11.398
  145   HG21  THR  22          1HG2      THR  22  14.489  -8.117 -11.350
  146   HG22  THR  22          2HG2      THR  22  16.029  -7.592 -10.643
  147   HG23  THR  22          3HG2      THR  22  15.998  -8.464 -12.187
  148    H    LEU  23           H        LEU  23  16.583  -4.259 -10.823
  149    HA   LEU  23           HA       LEU  23  19.325  -4.392  -9.862
  150    HB2  LEU  23           HB2      LEU  23  17.509  -2.473  -9.753
  151    HB3  LEU  23           HB3      LEU  23  16.982  -3.279  -8.282
  152    HG   LEU  23           HG       LEU  23  19.732  -2.093  -8.881
  153   HD11  LEU  23          1HD1      LEU  23  17.983  -0.436  -8.523
  154   HD12  LEU  23          2HD1      LEU  23  19.127  -0.434  -7.177
  155   HD13  LEU  23          3HD1      LEU  23  17.532  -1.206  -6.991
  156   HD21  LEU  23          3HD2      LEU  23  19.973  -4.027  -7.305
  157   HD22  LEU  23          1HD2      LEU  23  18.739  -3.306  -6.259
  158   HD23  LEU  23          2HD2      LEU  23  20.301  -2.488  -6.536
  159    H    MET  24           H        MET  24  20.093  -6.116  -8.741
  160    HA   MET  24           HA       MET  24  18.320  -8.270  -8.177
  161    HB2  MET  24           HB2      MET  24  20.317  -9.514  -7.473
  162    HB3  MET  24           HB3      MET  24  20.490  -8.704  -9.028
  163    HG2  MET  24           HG2      MET  24  21.822  -6.914  -7.899
  164    HG3  MET  24           HG3      MET  24  21.693  -7.789  -6.384
  165    HE1  MET  24           HE1      MET  24  25.413  -7.961  -8.072
  166    HE2  MET  24           HE2      MET  24  24.202  -6.865  -8.756
  167    HE3  MET  24           HE3      MET  24  24.387  -6.985  -6.991
  168    H    THR  25           H        THR  25  19.650  -5.932  -5.989
  169    HA   THR  25           HA       THR  25  19.619  -5.502  -3.796
  170    HB   THR  25           HB       THR  25  17.573  -5.777  -2.535
  171    HG1  THR  25           HG1      THR  25  16.872  -7.799  -3.346
  172   HG21  THR  25          1HG2      THR  25  17.050  -4.906  -5.408
  173   HG22  THR  25          2HG2      THR  25  17.803  -3.910  -4.140
  174   HG23  THR  25          3HG2      THR  25  16.127  -4.443  -3.970
  175    H    ASP  26           H        ASP  26  19.452  -8.876  -4.417
  176    HA   ASP  26           HA       ASP  26  20.868  -9.404  -1.824
  177    HB2  ASP  26           HB2      ASP  26  18.716 -11.001  -3.244
  178    HB3  ASP  26           HB3      ASP  26  19.816 -11.728  -2.086
  179    HA   PRO  27           HA       PRO  27  23.673 -10.579  -5.319
  180    HB2  PRO  27           HB2      PRO  27  25.938  -9.384  -4.315
  181    HB3  PRO  27           HB3      PRO  27  24.743  -8.532  -5.331
  182    HG2  PRO  27           HG2      PRO  27  24.983  -8.535  -2.322
  183    HG3  PRO  27           HG3      PRO  27  24.738  -7.136  -3.415
  184    HD2  PRO  27           HD2      PRO  27  22.686  -8.285  -2.082
  185    HD3  PRO  27           HD3      PRO  27  22.477  -7.680  -3.754
  186    H    VAL  28           H        VAL  28  24.716 -12.472  -5.262
  187    HA   VAL  28           HA       VAL  28  25.908 -13.543  -2.730
  188    HB   VAL  28           HB       VAL  28  24.111 -15.006  -4.720
  189   HG11  VAL  28          1HG1      VAL  28  25.603 -16.122  -2.304
  190   HG12  VAL  28          2HG1      VAL  28  24.423 -17.002  -3.286
  191   HG13  VAL  28          3HG1      VAL  28  25.959 -16.512  -4.001
  192   HG21  VAL  28          3HG2      VAL  28  22.708 -15.437  -2.726
  193   HG22  VAL  28          1HG2      VAL  28  23.781 -14.416  -1.748
  194   HG23  VAL  28          2HG2      VAL  28  22.831 -13.700  -3.071
  195    H    ARG  29           H        ARG  29  27.860 -14.428  -2.957
  196    HA   ARG  29           HA       ARG  29  29.217 -13.992  -5.498
  197    HB2  ARG  29           HB2      ARG  29  29.911 -13.359  -3.017
  198    HB3  ARG  29           HB3      ARG  29  30.607 -14.976  -3.001
  199    HG2  ARG  29           HG2      ARG  29  31.962 -14.396  -4.997
  200    HG3  ARG  29           HG3      ARG  29  31.164 -12.826  -5.098
  201    HD2  ARG  29           HD2      ARG  29  32.060 -12.286  -2.808
  202    HD3  ARG  29           HD3      ARG  29  32.966 -13.818  -2.864
  203    HE   ARG  29           HE       ARG  29  33.399 -12.134  -5.205
  204   HH11  ARG  29          1HH1      ARG  29  34.555 -12.593  -1.890
  205   HH12  ARG  29          2HH1      ARG  29  36.099 -11.858  -2.248
  206   HH21  ARG  29          1HH2      ARG  29  35.367 -11.221  -5.588
  207   HH22  ARG  29          2HH2      ARG  29  36.540 -11.082  -4.312
  208    H    LEU  30           H        LEU  30  30.305 -15.406  -6.688
  209    HA   LEU  30           HA       LEU  30  29.913 -18.337  -6.419
  210    HB2  LEU  30           HB2      LEU  30  30.810 -16.422  -8.616
  211    HB3  LEU  30           HB3      LEU  30  31.078 -18.131  -8.780
  212    HG   LEU  30           HG       LEU  30  29.144 -17.405 -10.024
  213   HD11  LEU  30          1HD1      LEU  30  27.558 -19.117  -9.310
  214   HD12  LEU  30          2HD1      LEU  30  28.321 -19.212  -7.711
  215   HD13  LEU  30          3HD1      LEU  30  29.219 -19.711  -9.163
  216   HD21  LEU  30          3HD2      LEU  30  27.073 -16.671  -9.070
  217   HD22  LEU  30          1HD2      LEU  30  28.350 -15.557  -8.538
  218   HD23  LEU  30          2HD2      LEU  30  27.703 -16.780  -7.422
  219    HA   PRO  31           HA       PRO  31  34.038 -19.028  -4.996
  220    HB2  PRO  31           HB2      PRO  31  34.933 -21.263  -6.311
  221    HB3  PRO  31           HB3      PRO  31  33.645 -21.286  -5.071
  222    HG2  PRO  31           HG2      PRO  31  33.321 -21.207  -8.088
  223    HG3  PRO  31           HG3      PRO  31  32.504 -22.289  -6.917
  224    HD2  PRO  31           HD2      PRO  31  31.324 -20.039  -7.854
  225    HD3  PRO  31           HD3      PRO  31  31.098 -20.524  -6.156
  226    H    SER  32           H        SER  32  33.714 -18.607  -8.534
  227    HA   SER  32           HA       SER  32  36.478 -17.974  -9.046
  228    HB2  SER  32           HB2      SER  32  33.961 -17.052 -10.484
  229    HB3  SER  32           HB3      SER  32  35.613 -16.993 -11.118
  230    HG   SER  32           HG       SER  32  34.737 -18.812 -11.964
  231    H    GLY  33           H        GLY  33  34.292 -16.298  -7.103
  232    HA2  GLY  33           HA2      GLY  33  34.658 -14.304  -5.961
  233    HA3  GLY  33           HA3      GLY  33  35.865 -13.798  -7.173
  234    H    THR  34           H        THR  34  33.427 -14.711  -9.057
  235    HA   THR  34           HA       THR  34  32.345 -12.084  -9.623
  236    HB   THR  34           HB       THR  34  30.848 -13.519 -11.187
  237    HG1  THR  34           HG1      THR  34  31.678 -15.579 -11.583
  238   HG21  THR  34          1HG2      THR  34  33.882 -13.525 -11.513
  239   HG22  THR  34          2HG2      THR  34  32.770 -12.202 -11.936
  240   HG23  THR  34          3HG2      THR  34  32.688 -13.749 -12.807
  241    H    VAL  35           H        VAL  35  30.156 -11.495  -9.608
  242    HA   VAL  35           HA       VAL  35  28.617 -12.642  -7.288
  243    HB   VAL  35           HB       VAL  35  28.658  -9.767  -8.298
  244   HG11  VAL  35          1HG1      VAL  35  27.337  -9.294  -6.239
  245   HG12  VAL  35          2HG1      VAL  35  26.448 -10.293  -7.379
  246   HG13  VAL  35          3HG1      VAL  35  27.189 -11.035  -5.938
  247   HG21  VAL  35          3HG2      VAL  35  30.740 -10.304  -7.102
  248   HG22  VAL  35          1HG2      VAL  35  29.720  -9.300  -6.076
  249   HG23  VAL  35          2HG2      VAL  35  29.814 -11.046  -5.786
  250    H    MET  36           H        MET  36  26.499 -13.080  -7.490
  251    HA   MET  36           HA       MET  36  24.996 -12.385  -9.936
  252    HB2  MET  36           HB2      MET  36  26.071 -14.683 -10.144
  253    HB3  MET  36           HB3      MET  36  25.120 -15.190  -8.747
  254    HG2  MET  36           HG2      MET  36  24.197 -15.880 -10.964
  255    HG3  MET  36           HG3      MET  36  23.069 -15.030  -9.947
  256    HE1  MET  36           HE1      MET  36  25.962 -13.195 -12.028
  257    HE2  MET  36           HE2      MET  36  25.609 -14.715 -12.885
  258    HE3  MET  36           HE3      MET  36  25.197 -13.152 -13.622
  259    H    ASP  37           H        ASP  37  22.676 -12.832  -9.668
  260    HA   ASP  37           HA       ASP  37  21.553 -11.974  -7.102
  261    HB2  ASP  37           HB2      ASP  37  20.459 -11.262  -9.090
  262    HB3  ASP  37           HB3      ASP  37  20.428 -12.904  -9.749
  263    H    ARG  38           H        ARG  38  20.687 -13.176  -5.519
  264    HA   ARG  38           HA       ARG  38  21.293 -15.845  -5.023
  265    HB2  ARG  38           HB2      ARG  38  20.537 -14.122  -3.383
  266    HB3  ARG  38           HB3      ARG  38  18.893 -14.276  -4.004
  267    HG2  ARG  38           HG2      ARG  38  18.877 -16.684  -3.341
  268    HG3  ARG  38           HG3      ARG  38  20.515 -16.531  -2.705
  269    HD2  ARG  38           HD2      ARG  38  18.048 -15.018  -1.759
  270    HD3  ARG  38           HD3      ARG  38  18.741 -16.435  -0.961
  271    HE   ARG  38           HE       ARG  38  20.886 -14.932  -0.841
  272   HH11  ARG  38          1HH1      ARG  38  17.575 -13.818  -0.206
  273   HH12  ARG  38          2HH1      ARG  38  18.135 -12.412   0.659
  274   HH21  ARG  38          1HH2      ARG  38  21.499 -13.097   0.339
  275   HH22  ARG  38          2HH2      ARG  38  20.275 -12.024   0.942
  276    H    SER  39           H        SER  39  18.194 -14.614  -6.402
  277    HA   SER  39           HA       SER  39  16.926 -17.203  -6.370
  278    HB2  SER  39           HB2      SER  39  16.157 -14.707  -7.938
  279    HB3  SER  39           HB3      SER  39  15.155 -16.135  -7.646
  280    HG   SER  39           HG       SER  39  14.709 -14.451  -6.136
  281    H    ILE  40           H        ILE  40  18.594 -15.405  -9.014
  282    HA   ILE  40           HA       ILE  40  18.002 -17.378 -11.043
  283    HB   ILE  40           HB       ILE  40  20.229 -15.315 -10.880
  284   HG12  ILE  40          2HG1      ILE  40  17.648 -15.304 -12.526
  285   HG13  ILE  40          3HG1      ILE  40  17.782 -14.526 -10.952
  286   HG21  ILE  40          1HG2      ILE  40  20.906 -17.088 -12.449
  287   HG22  ILE  40          2HG2      ILE  40  19.322 -17.010 -13.261
  288   HG23  ILE  40          3HG2      ILE  40  20.455 -15.651 -13.354
  289   HD11  ILE  40          3HD1      ILE  40  19.300 -13.756 -13.464
  290   HD12  ILE  40          1HD1      ILE  40  18.087 -12.823 -12.589
  291   HD13  ILE  40          2HD1      ILE  40  19.672 -13.117 -11.859
  292    H    ILE  41           H        ILE  41  20.861 -17.119  -8.829
  293    HA   ILE  41           HA       ILE  41  22.097 -19.423 -10.043
  294    HB   ILE  41           HB       ILE  41  23.392 -17.725  -8.804
  295   HG12  ILE  41          2HG1      ILE  41  24.962 -19.210  -7.683
  296   HG13  ILE  41          3HG1      ILE  41  23.784 -20.518  -7.647
  297   HG21  ILE  41          1HG2      ILE  41  23.577 -17.768  -6.367
  298   HG22  ILE  41          2HG2      ILE  41  21.929 -17.373  -6.850
  299   HG23  ILE  41          3HG2      ILE  41  22.324 -19.004  -6.252
  300   HD11  ILE  41          3HD1      ILE  41  23.887 -20.700 -10.104
  301   HD12  ILE  41          1HD1      ILE  41  24.916 -19.244 -10.192
  302   HD13  ILE  41          2HD1      ILE  41  25.521 -20.732  -9.448
  303    H    LEU  42           H        LEU  42  19.942 -19.235  -7.153
  304    HA   LEU  42           HA       LEU  42  20.124 -22.089  -6.743
  305    HB2  LEU  42           HB2      LEU  42  18.591 -21.873  -5.021
  306    HB3  LEU  42           HB3      LEU  42  19.568 -20.426  -5.000
  307    HG   LEU  42           HG       LEU  42  17.558 -19.333  -6.300
  308   HD11  LEU  42          1HD1      LEU  42  16.149 -21.697  -4.951
  309   HD12  LEU  42          2HD1      LEU  42  16.181 -21.388  -6.688
  310   HD13  LEU  42          3HD1      LEU  42  15.349 -20.259  -5.625
  311   HD21  LEU  42          3HD2      LEU  42  18.292 -18.802  -3.987
  312   HD22  LEU  42          1HD2      LEU  42  17.290 -20.122  -3.367
  313   HD23  LEU  42          2HD2      LEU  42  16.529 -18.720  -4.163
  314    H    ARG  43           H        ARG  43  17.942 -20.104  -8.735
  315    HA   ARG  43           HA       ARG  43  16.138 -22.178  -9.507
  316    HB2  ARG  43           HB2      ARG  43  15.766 -19.788  -9.916
  317    HB3  ARG  43           HB3      ARG  43  17.111 -19.754 -11.071
  318    HG2  ARG  43           HG2      ARG  43  15.792 -21.494 -12.444
  319    HG3  ARG  43           HG3      ARG  43  14.427 -21.176 -11.351
  320    HD2  ARG  43           HD2      ARG  43  15.908 -19.197 -13.117
  321    HD3  ARG  43           HD3      ARG  43  14.293 -19.830 -13.424
  322    HE   ARG  43           HE       ARG  43  13.844 -18.724 -11.041
  323   HH11  ARG  43          1HH1      ARG  43  15.580 -17.261 -13.763
  324   HH12  ARG  43          2HH1      ARG  43  15.208 -15.642 -13.224
  325   HH21  ARG  43          1HH2      ARG  43  13.425 -16.608 -10.417
  326   HH22  ARG  43          2HH2      ARG  43  14.048 -15.291 -11.376
  327    H    HIS  44           H        HIS  44  19.305 -21.151 -10.926
  328    HA   HIS  44           HA       HIS  44  19.241 -23.188 -12.954
  329    HB2  HIS  44           HB2      HIS  44  20.687 -21.077 -12.869
  330    HB3  HIS  44           HB3      HIS  44  21.762 -21.961 -11.784
  331    HD1  HIS  44           HD1      HIS  44  23.284 -23.893 -12.985
  332    HD2  HIS  44           HD2      HIS  44  20.355 -22.082 -15.408
  333    HE1  HIS  44           HE1      HIS  44  23.640 -24.785 -15.325
  334    H    LEU  45           H        LEU  45  20.723 -23.204  -9.655
  335    HA   LEU  45           HA       LEU  45  21.808 -25.830  -9.851
  336    HB2  LEU  45           HB2      LEU  45  21.378 -23.833  -7.701
  337    HB3  LEU  45           HB3      LEU  45  21.340 -25.508  -7.161
  338    HG   LEU  45           HG       LEU  45  23.515 -25.968  -8.139
  339   HD11  LEU  45          1HD1      LEU  45  24.933 -24.247  -9.127
  340   HD12  LEU  45          2HD1      LEU  45  23.643 -23.029  -8.967
  341   HD13  LEU  45          3HD1      LEU  45  23.473 -24.401 -10.089
  342   HD21  LEU  45          3HD2      LEU  45  23.390 -25.088  -5.839
  343   HD22  LEU  45          1HD2      LEU  45  23.570 -23.432  -6.454
  344   HD23  LEU  45          2HD2      LEU  45  24.891 -24.593  -6.636
  345    H    LEU  46           H        LEU  46  18.530 -24.872  -8.928
  346    HA   LEU  46           HA       LEU  46  17.570 -27.443  -8.152
  347    HB2  LEU  46           HB2      LEU  46  16.428 -25.256  -7.850
  348    HB3  LEU  46           HB3      LEU  46  16.177 -25.153  -9.589
  349    HG   LEU  46           HG       LEU  46  14.687 -27.140  -9.503
  350   HD11  LEU  46          1HD1      LEU  46  15.590 -28.337  -7.533
  351   HD12  LEU  46          2HD1      LEU  46  13.886 -27.957  -7.287
  352   HD13  LEU  46          3HD1      LEU  46  15.131 -26.978  -6.481
  353   HD21  LEU  46          3HD2      LEU  46  12.824 -26.023  -8.365
  354   HD22  LEU  46          1HD2      LEU  46  13.776 -24.867  -9.306
  355   HD23  LEU  46          2HD2      LEU  46  13.961 -24.926  -7.542
  356    H    ASN  47           H        ASN  47  18.311 -26.165 -11.374
  357    HA   ASN  47           HA       ASN  47  17.082 -28.489 -12.730
  358    HB2  ASN  47           HB2      ASN  47  16.807 -26.270 -13.714
  359    HB3  ASN  47           HB3      ASN  47  18.553 -26.049 -13.791
  360   HD21  ASN  47          1HD2      ASN  47  19.452 -26.498 -15.782
  361   HD22  ASN  47          2HD2      ASN  47  18.757 -27.609 -16.947
  362    H    SER  48           H        SER  48  20.396 -27.033 -12.407
  363    HA   SER  48           HA       SER  48  21.648 -29.715 -12.625
  364    HB2  SER  48           HB2      SER  48  22.198 -27.419 -14.551
  365    HB3  SER  48           HB3      SER  48  23.232 -28.841 -14.371
  366    HG   SER  48           HG       SER  48  21.767 -29.088 -16.120
  367    HA   PRO  49           HA       PRO  49  24.301 -27.599  -9.714
  368    HB2  PRO  49           HB2      PRO  49  26.124 -29.508  -9.129
  369    HB3  PRO  49           HB3      PRO  49  24.389 -29.736  -8.796
  370    HG2  PRO  49           HG2      PRO  49  25.925 -30.689 -11.247
  371    HG3  PRO  49           HG3      PRO  49  24.887 -31.658 -10.158
  372    HD2  PRO  49           HD2      PRO  49  23.935 -30.569 -12.485
  373    HD3  PRO  49           HD3      PRO  49  22.927 -30.712 -11.002
  374    H    THR  50           H        THR  50  24.645 -26.318 -11.925
  375    HA   THR  50           HA       THR  50  27.553 -25.923 -12.334
  376    HB   THR  50           HB       THR  50  26.979 -25.531 -14.821
  377    HG1  THR  50           HG1      THR  50  25.251 -26.856 -15.542
  378   HG21  THR  50          1HG2      THR  50  27.331 -27.873 -15.421
  379   HG22  THR  50          2HG2      THR  50  26.932 -28.389 -13.765
  380   HG23  THR  50          3HG2      THR  50  28.379 -27.396 -14.091
  381    H    ASP  51           H        ASP  51  28.100 -23.928 -13.274
  382    HA   ASP  51           HA       ASP  51  26.645 -21.665 -12.286
  383    HB2  ASP  51           HB2      ASP  51  29.087 -21.808 -12.510
  384    HB3  ASP  51           HB3      ASP  51  28.938 -21.859 -14.260
  385    HA   PRO  52           HA       PRO  52  23.657 -21.254 -15.535
  386    HB2  PRO  52           HB2      PRO  52  22.865 -18.623 -15.232
  387    HB3  PRO  52           HB3      PRO  52  22.396 -19.961 -14.153
  388    HG2  PRO  52           HG2      PRO  52  24.646 -17.970 -13.774
  389    HG3  PRO  52           HG3      PRO  52  23.411 -18.494 -12.583
  390    HD2  PRO  52           HD2      PRO  52  25.883 -19.569 -12.594
  391    HD3  PRO  52           HD3      PRO  52  24.463 -20.612 -12.318
  392    H    PHE  53           H        PHE  53  26.580 -19.326 -15.727
  393    HA   PHE  53           HA       PHE  53  26.003 -18.792 -18.634
  394    HB2  PHE  53           HB2      PHE  53  27.536 -17.013 -16.698
  395    HB3  PHE  53           HB3      PHE  53  27.197 -16.681 -18.395
  396    HD1  PHE  53           HD1      PHE  53  24.710 -16.449 -19.129
  397    HD2  PHE  53           HD2      PHE  53  26.000 -16.379 -15.015
  398    HE1  PHE  53           HE1      PHE  53  22.545 -15.437 -18.463
  399    HE2  PHE  53           HE2      PHE  53  23.808 -15.426 -14.346
  400    HZ   PHE  53           HZ       PHE  53  22.091 -14.949 -16.061
  401    H    ASN  54           H        ASN  54  28.454 -19.678 -16.213
  402    HA   ASN  54           HA       ASN  54  30.574 -19.867 -18.277
  403    HB2  ASN  54           HB2      ASN  54  30.667 -18.828 -15.843
  404    HB3  ASN  54           HB3      ASN  54  30.939 -20.496 -15.346
  405   HD21  ASN  54          1HD2      ASN  54  32.704 -21.508 -17.308
  406   HD22  ASN  54          2HD2      ASN  54  34.150 -20.518 -17.293
  407    H    ARG  55           H        ARG  55  28.436 -21.974 -16.462
  408    HA   ARG  55           HA       ARG  55  27.963 -24.114 -16.489
  409    HB2  ARG  55           HB2      ARG  55  29.330 -23.892 -19.190
  410    HB3  ARG  55           HB3      ARG  55  28.768 -25.450 -18.607
  411    HG2  ARG  55           HG2      ARG  55  27.071 -24.545 -19.987
  412    HG3  ARG  55           HG3      ARG  55  26.490 -24.616 -18.326
  413    HD2  ARG  55           HD2      ARG  55  26.885 -22.134 -18.129
  414    HD3  ARG  55           HD3      ARG  55  27.492 -22.128 -19.791
  415    HE   ARG  55           HE       ARG  55  25.327 -22.238 -20.582
  416   HH11  ARG  55          1HH1      ARG  55  25.208 -22.936 -17.109
  417   HH12  ARG  55          2HH1      ARG  55  23.466 -23.067 -17.115
  418   HH21  ARG  55          1HH2      ARG  55  23.090 -22.347 -20.484
  419   HH22  ARG  55          2HH2      ARG  55  22.303 -22.686 -18.968
  420    H    GLN  56           H        GLN  56  30.772 -23.279 -15.423
  421    HA   GLN  56           HA       GLN  56  32.108 -25.846 -15.030
  422    HB2  GLN  56           HB2      GLN  56  33.336 -24.716 -13.293
  423    HB3  GLN  56           HB3      GLN  56  33.293 -23.695 -14.724
  424    HG2  GLN  56           HG2      GLN  56  31.509 -22.300 -13.683
  425    HG3  GLN  56           HG3      GLN  56  31.508 -23.334 -12.255
  426   HE21  GLN  56          1HE2      GLN  56  31.859 -20.890 -11.483
  427   HE22  GLN  56          2HE2      GLN  56  33.548 -20.485 -11.214
  428    H    MET  57           H        MET  57  32.010 -27.076 -12.998
  429    HA   MET  57           HA       MET  57  29.360 -27.471 -11.992
  430    HB2  MET  57           HB2      MET  57  30.348 -29.013 -10.399
  431    HB3  MET  57           HB3      MET  57  30.955 -29.280 -12.032
  432    HG2  MET  57           HG2      MET  57  33.065 -28.106 -11.439
  433    HG3  MET  57           HG3      MET  57  32.429 -27.765  -9.837
  434    HE1  MET  57           HE1      MET  57  33.801 -31.913 -11.375
  435    HE2  MET  57           HE2      MET  57  32.344 -31.145 -12.039
  436    HE3  MET  57           HE3      MET  57  33.936 -30.391 -12.267
  437    H    LEU  58           H        LEU  58  28.329 -26.928 -10.111
  438    HA   LEU  58           HA       LEU  58  29.585 -25.073  -8.215
  439    HB2  LEU  58           HB2      LEU  58  28.775 -23.809 -10.302
  440    HB3  LEU  58           HB3      LEU  58  27.140 -24.191  -9.827
  441    HG   LEU  58           HG       LEU  58  27.951 -21.903  -9.308
  442   HD11  LEU  58          1HD1      LEU  58  27.163 -23.392  -6.782
  443   HD12  LEU  58          2HD1      LEU  58  26.063 -22.716  -8.002
  444   HD13  LEU  58          3HD1      LEU  58  27.095 -21.655  -7.054
  445   HD21  LEU  58          3HD2      LEU  58  29.453 -21.463  -7.470
  446   HD22  LEU  58          1HD2      LEU  58  30.277 -22.457  -8.694
  447   HD23  LEU  58          2HD2      LEU  58  29.705 -23.180  -7.168
  448    H    THR  59           H        THR  59  28.896 -25.389  -6.258
  449    HA   THR  59           HA       THR  59  26.377 -26.917  -5.699
  450    HB   THR  59           HB       THR  59  29.035 -27.104  -4.216
  451    HG1  THR  59           HG1      THR  59  29.208 -29.095  -5.316
  452   HG21  THR  59          1HG2      THR  59  26.516 -28.836  -4.130
  453   HG22  THR  59          2HG2      THR  59  27.145 -27.831  -2.801
  454   HG23  THR  59          3HG2      THR  59  28.050 -29.241  -3.346
  455    H    GLU  60           H        GLU  60  25.343 -26.430  -3.700
  456    HA   GLU  60           HA       GLU  60  25.065 -23.702  -3.085
  457    HB2  GLU  60           HB2      GLU  60  24.386 -26.145  -1.386
  458    HB3  GLU  60           HB3      GLU  60  23.792 -24.501  -1.094
  459    HG2  GLU  60           HG2      GLU  60  22.674 -24.494  -3.307
  460    HG3  GLU  60           HG3      GLU  60  23.229 -26.151  -3.599
  461    H    SER  61           H        SER  61  27.385 -25.986  -1.700
  462    HA   SER  61           HA       SER  61  28.080 -24.525   0.684
  463    HB2  SER  61           HB2      SER  61  30.127 -25.980   0.550
  464    HB3  SER  61           HB3      SER  61  28.576 -26.844   0.521
  465    HG   SER  61           HG       SER  61  30.116 -27.609  -1.064
  466    H    MET  62           H        MET  62  28.791 -23.885  -2.655
  467    HA   MET  62           HA       MET  62  31.249 -22.338  -2.108
  468    HB2  MET  62           HB2      MET  62  29.628 -22.645  -4.665
  469    HB3  MET  62           HB3      MET  62  31.247 -21.948  -4.517
  470    HG2  MET  62           HG2      MET  62  30.534 -24.843  -3.932
  471    HG3  MET  62           HG3      MET  62  31.250 -24.243  -5.416
  472    HE1  MET  62           HE1      MET  62  33.063 -26.105  -5.198
  473    HE2  MET  62           HE2      MET  62  34.118 -26.327  -3.785
  474    HE3  MET  62           HE3      MET  62  32.377 -26.647  -3.648
  475    H    LEU  63           H        LEU  63  27.922 -21.676  -1.915
  476    HA   LEU  63           HA       LEU  63  28.015 -18.911  -2.918
  477    HB2  LEU  63           HB2      LEU  63  25.790 -20.472  -1.537
  478    HB3  LEU  63           HB3      LEU  63  25.618 -18.909  -2.315
  479    HG   LEU  63           HG       LEU  63  26.307 -21.537  -3.710
  480   HD11  LEU  63          1HD1      LEU  63  24.056 -21.333  -4.684
  481   HD12  LEU  63          2HD1      LEU  63  23.773 -19.840  -3.763
  482   HD13  LEU  63          3HD1      LEU  63  23.968 -21.391  -2.921
  483   HD21  LEU  63          3HD2      LEU  63  27.358 -19.707  -4.964
  484   HD22  LEU  63          1HD2      LEU  63  25.865 -18.741  -4.855
  485   HD23  LEU  63          2HD2      LEU  63  25.911 -20.232  -5.811
  486    H    GLU  64           H        GLU  64  27.731 -17.060  -1.764
  487    HA   GLU  64           HA       GLU  64  27.292 -17.003   1.116
  488    HB2  GLU  64           HB2      GLU  64  29.702 -17.461   1.056
  489    HB3  GLU  64           HB3      GLU  64  29.969 -16.105  -0.033
  490    HG2  GLU  64           HG2      GLU  64  29.246 -14.521   1.714
  491    HG3  GLU  64           HG3      GLU  64  28.824 -15.861   2.781
  492    HA   PRO  65           HA       PRO  65  25.517 -13.263  -0.669
  493    HB2  PRO  65           HB2      PRO  65  24.458 -12.043   1.552
  494    HB3  PRO  65           HB3      PRO  65  23.771 -13.523   0.809
  495    HG2  PRO  65           HG2      PRO  65  25.656 -13.340   3.170
  496    HG3  PRO  65           HG3      PRO  65  24.130 -14.277   3.041
  497    HD2  PRO  65           HD2      PRO  65  26.560 -15.440   2.614
  498    HD3  PRO  65           HD3      PRO  65  25.124 -15.899   1.648
  499    H    VAL  66           H        VAL  66  26.132 -11.209  -1.090
  500    HA   VAL  66           HA       VAL  66  28.742 -10.364   0.028
  501    HB   VAL  66           HB       VAL  66  27.255  -9.275  -2.367
  502   HG11  VAL  66          1HG1      VAL  66  29.498  -8.296  -2.935
  503   HG12  VAL  66          2HG1      VAL  66  28.833  -7.617  -1.454
  504   HG13  VAL  66          3HG1      VAL  66  30.114  -8.844  -1.362
  505   HG21  VAL  66          3HG2      VAL  66  27.906 -11.617  -2.756
  506   HG22  VAL  66          1HG2      VAL  66  28.895 -10.506  -3.700
  507   HG23  VAL  66          2HG2      VAL  66  29.563 -11.247  -2.231
  508    HA   PRO  67           HA       PRO  67  26.312  -7.223   2.293
  509    HB2  PRO  67           HB2      PRO  67  28.138  -6.506   4.169
  510    HB3  PRO  67           HB3      PRO  67  27.324  -8.087   4.212
  511    HG2  PRO  67           HG2      PRO  67  30.084  -7.460   3.110
  512    HG3  PRO  67           HG3      PRO  67  29.611  -8.773   4.225
  513    HD2  PRO  67           HD2      PRO  67  29.843  -9.146   1.505
  514    HD3  PRO  67           HD3      PRO  67  28.640 -10.025   2.498
  515    H    GLU  68           H        GLU  68  29.678  -6.553   1.096
  516    HA   GLU  68           HA       GLU  68  29.447  -3.750   1.356
  517    HB2  GLU  68           HB2      GLU  68  31.359  -3.605  -0.139
  518    HB3  GLU  68           HB3      GLU  68  31.596  -4.835   1.106
  519    HG2  GLU  68           HG2      GLU  68  31.085  -6.610  -0.550
  520    HG3  GLU  68           HG3      GLU  68  30.860  -5.376  -1.799
  521    H    LEU  69           H        LEU  69  28.371  -5.822  -1.322
  522    HA   LEU  69           HA       LEU  69  27.528  -3.529  -2.966
  523    HB2  LEU  69           HB2      LEU  69  27.095  -6.538  -3.172
  524    HB3  LEU  69           HB3      LEU  69  26.369  -5.388  -4.291
  525    HG   LEU  69           HG       LEU  69  29.370  -5.737  -3.870
  526   HD11  LEU  69          1HD1      LEU  69  28.293  -7.687  -4.905
  527   HD12  LEU  69          2HD1      LEU  69  29.294  -6.823  -6.080
  528   HD13  LEU  69          3HD1      LEU  69  27.525  -6.638  -6.120
  529   HD21  LEU  69          3HD2      LEU  69  27.789  -4.090  -5.905
  530   HD22  LEU  69          1HD2      LEU  69  29.539  -4.406  -5.982
  531   HD23  LEU  69          2HD2      LEU  69  28.881  -3.456  -4.650
  532    H    LYS  70           H        LYS  70  25.873  -5.848  -0.728
  533    HA   LYS  70           HA       LYS  70  23.259  -4.826  -1.293
  534    HB2  LYS  70           HB2      LYS  70  23.823  -7.006  -0.196
  535    HB3  LYS  70           HB3      LYS  70  24.246  -6.129   1.280
  536    HG2  LYS  70           HG2      LYS  70  21.947  -5.260   1.443
  537    HG3  LYS  70           HG3      LYS  70  21.535  -6.026  -0.104
  538    HD2  LYS  70           HD2      LYS  70  21.936  -8.270   0.892
  539    HD3  LYS  70           HD3      LYS  70  22.418  -7.501   2.415
  540    HE2  LYS  70           HE2      LYS  70  20.168  -8.142   2.773
  541    HE3  LYS  70           HE3      LYS  70  20.114  -6.404   2.474
  542    HZ1  LYS  70           HZ1      LYS  70  19.394  -8.590   0.601
  543    HZ2  LYS  70           HZ2      LYS  70  19.566  -7.052   0.082
  544    HZ3  LYS  70           HZ3      LYS  70  18.410  -7.433   1.193
  545    H    GLU  71           H        GLU  71  25.633  -3.832   1.184
  546    HA   GLU  71           HA       GLU  71  24.017  -1.753   2.350
  547    HB2  GLU  71           HB2      GLU  71  27.014  -2.221   2.322
  548    HB3  GLU  71           HB3      GLU  71  26.233  -0.900   3.192
  549    HG2  GLU  71           HG2      GLU  71  24.847  -2.520   4.456
  550    HG3  GLU  71           HG3      GLU  71  25.699  -3.859   3.683
  551    H    GLN  72           H        GLN  72  26.176  -1.770  -0.482
  552    HA   GLN  72           HA       GLN  72  25.987   1.137  -0.887
  553    HB2  GLN  72           HB2      GLN  72  26.973  -1.182  -2.592
  554    HB3  GLN  72           HB3      GLN  72  26.813   0.442  -3.253
  555    HG2  GLN  72           HG2      GLN  72  28.455  -0.159  -0.752
  556    HG3  GLN  72           HG3      GLN  72  29.115  -0.176  -2.388
  557   HE21  GLN  72          1HE2      GLN  72  29.039   1.911  -3.646
  558   HE22  GLN  72          2HE2      GLN  72  29.041   3.415  -2.741
  559    H    ILE  73           H        ILE  73  24.284  -1.701  -2.266
  560    HA   ILE  73           HA       ILE  73  22.575  -0.283  -4.051
  561    HB   ILE  73           HB       ILE  73  22.389  -2.951  -2.615
  562   HG12  ILE  73          2HG1      ILE  73  22.530  -2.292  -5.574
  563   HG13  ILE  73          3HG1      ILE  73  23.970  -2.478  -4.567
  564   HG21  ILE  73          1HG2      ILE  73  20.078  -2.385  -2.749
  565   HG22  ILE  73          2HG2      ILE  73  20.243  -1.706  -4.380
  566   HG23  ILE  73          3HG2      ILE  73  20.379  -3.449  -4.094
  567   HD11  ILE  73          3HD1      ILE  73  23.610  -4.553  -5.711
  568   HD12  ILE  73          1HD1      ILE  73  23.219  -4.815  -4.002
  569   HD13  ILE  73          2HD1      ILE  73  21.916  -4.637  -5.195
  570    H    GLN  74           H        GLN  74  21.921  -1.188  -0.609
  571    HA   GLN  74           HA       GLN  74  19.353   0.088  -0.623
  572    HB2  GLN  74           HB2      GLN  74  19.307  -0.233   1.734
  573    HB3  GLN  74           HB3      GLN  74  20.035  -1.643   0.976
  574    HG2  GLN  74           HG2      GLN  74  21.414  -1.326   2.822
  575    HG3  GLN  74           HG3      GLN  74  22.308  -0.567   1.538
  576   HE21  GLN  74          1HE2      GLN  74  23.443   1.061   2.571
  577   HE22  GLN  74          2HE2      GLN  74  22.700   2.249   3.648
  578    H    ALA  75           H        ALA  75  22.585   1.480  -0.027
  579    HA   ALA  75           HA       ALA  75  21.590   4.027   0.913
  580    HB1  ALA  75           HB1      ALA  75  24.238   3.252  -0.415
  581    HB2  ALA  75           HB2      ALA  75  23.900   4.772   0.453
  582    HB3  ALA  75           HB3      ALA  75  23.896   3.232   1.328
  583    H    TRP  76           H        TRP  76  22.552   2.814  -2.334
  584    HA   TRP  76           HA       TRP  76  22.038   5.266  -3.720
  585    HB2  TRP  76           HB2      TRP  76  23.427   3.435  -4.592
  586    HB3  TRP  76           HB3      TRP  76  22.013   2.399  -4.712
  587    HD1  TRP  76           HD1      TRP  76  23.663   5.412  -6.401
  588    HE1  TRP  76           HE1      TRP  76  22.558   5.861  -8.671
  589    HE3  TRP  76           HE3      TRP  76  19.819   2.041  -6.123
  590    HZ2  TRP  76           HZ2      TRP  76  20.245   4.961 -10.140
  591    HZ3  TRP  76           HZ3      TRP  76  18.182   1.858  -7.957
  592    HH2  TRP  76           HH2      TRP  76  18.363   3.313  -9.969
  593    H    MET  77           H        MET  77  19.891   2.400  -3.156
  594    HA   MET  77           HA       MET  77  17.576   3.529  -4.453
  595    HB2  MET  77           HB2      MET  77  17.774   1.504  -2.181
  596    HB3  MET  77           HB3      MET  77  16.284   1.946  -3.030
  597    HG2  MET  77           HG2      MET  77  17.415   1.274  -5.197
  598    HG3  MET  77           HG3      MET  77  18.722   0.595  -4.247
  599    HE1  MET  77           HE1      MET  77  16.824  -2.257  -2.245
  600    HE2  MET  77           HE2      MET  77  18.254  -1.200  -2.286
  601    HE3  MET  77           HE3      MET  77  16.697  -0.581  -1.694
  602    H    ARG  78           H        ARG  78  18.734   3.832  -1.046
  603    HA   ARG  78           HA       ARG  78  16.537   5.324  -0.068
  604    HB2  ARG  78           HB2      ARG  78  18.288   4.224   1.264
  605    HB3  ARG  78           HB3      ARG  78  19.452   5.472   0.788
  606    HG2  ARG  78           HG2      ARG  78  17.978   7.170   1.905
  607    HG3  ARG  78           HG3      ARG  78  16.906   5.851   2.421
  608    HD2  ARG  78           HD2      ARG  78  19.836   6.234   3.174
  609    HD3  ARG  78           HD3      ARG  78  18.454   6.509   4.227
  610    HE   ARG  78           HE       ARG  78  19.676   3.946   3.481
  611   HH11  ARG  78          1HH1      ARG  78  16.762   5.356   4.922
  612   HH12  ARG  78          2HH1      ARG  78  16.310   3.850   5.669
  613   HH21  ARG  78          1HH2      ARG  78  19.051   2.079   4.414
  614   HH22  ARG  78          2HH2      ARG  78  17.594   2.007   5.384
  615    H    GLU  79           H        GLU  79  19.553   6.516  -1.652
  616    HA   GLU  79           HA       GLU  79  18.852   9.302  -1.502
  617    HB2  GLU  79           HB2      GLU  79  20.699   7.760  -3.372
  618    HB3  GLU  79           HB3      GLU  79  20.481   9.517  -3.451
  619    HG2  GLU  79           HG2      GLU  79  21.146   9.706  -1.059
  620    HG3  GLU  79           HG3      GLU  79  21.513   7.983  -1.032
  621    H    LYS  80           H        LYS  80  18.103   6.842  -4.004
  622    HA   LYS  80           HA       LYS  80  16.718   8.650  -5.787
  623    HB2  LYS  80           HB2      LYS  80  16.614   5.645  -5.309
  624    HB3  LYS  80           HB3      LYS  80  15.713   6.420  -6.597
  625    HG2  LYS  80           HG2      LYS  80  18.743   6.610  -6.345
  626    HG3  LYS  80           HG3      LYS  80  17.930   5.318  -7.214
  627    HD2  LYS  80           HD2      LYS  80  17.566   8.273  -7.880
  628    HD3  LYS  80           HD3      LYS  80  18.774   7.219  -8.625
  629    HE2  LYS  80           HE2      LYS  80  17.041   5.716  -9.459
  630    HE3  LYS  80           HE3      LYS  80  15.780   6.679  -8.674
  631    HZ1  LYS  80           HZ1      LYS  80  17.580   7.696 -10.794
  632    HZ2  LYS  80           HZ2      LYS  80  16.353   8.528 -10.103
  633    HZ3  LYS  80           HZ3      LYS  80  16.048   7.220 -11.056
  634    H    GLN  81           H        GLN  81  15.631   6.718  -3.024
  635    HA   GLN  81           HA       GLN  81  12.811   7.193  -3.452
  636    HB2  GLN  81           HB2      GLN  81  13.775   5.126  -2.506
  637    HB3  GLN  81           HB3      GLN  81  14.364   6.028  -1.099
  638    HG2  GLN  81           HG2      GLN  81  12.046   6.531  -0.423
  639    HG3  GLN  81           HG3      GLN  81  11.427   5.698  -1.862
  640   HE21  GLN  81          1HE2      GLN  81  13.366   5.159   1.158
  641   HE22  GLN  81          2HE2      GLN  81  12.913   3.468   1.293
  642    H    SER  82           H        SER  82  15.220   8.722  -1.285
  643    HA   SER  82           HA       SER  82  13.390   9.874   0.535
  644    HB2  SER  82           HB2      SER  82  16.160  10.832  -0.255
  645    HB3  SER  82           HB3      SER  82  15.225  11.426   1.130
  646    HG   SER  82           HG       SER  82  16.226   8.796   0.685
  647    H    SER  83           H        SER  83  11.760  11.250   0.156
  648    HA   SER  83           HA       SER  83  11.874  13.318  -1.944
  649    HB2  SER  83           HB2      SER  83   9.847  11.927  -1.399
  650    HB3  SER  83           HB3      SER  83   9.747  12.780   0.159
  651    HG   SER  83           HG       SER  83   8.392  13.719  -1.476
  652    H    ASP  84           H        ASP  84  12.203  13.137   1.582
  653    HA   ASP  84           HA       ASP  84  12.224  16.035   2.019
  654    HB2  ASP  84           HB2      ASP  84  12.637  15.469   4.310
  655    HB3  ASP  84           HB3      ASP  84  11.303  14.492   3.695
  656    H    HIS  85           H        HIS  85  14.027  17.164   2.892
  657    HA   HIS  85           HA       HIS  85  16.763  16.214   2.657
  658    HB2  HIS  85           HB2      HIS  85  16.003  16.670   0.259
  659    HB3  HIS  85           HB3      HIS  85  15.843  18.367   0.724
  660    HD1  HIS  85           HD1      HIS  85  18.686  18.176   2.512
  661    HD2  HIS  85           HD2      HIS  85  17.953  17.235  -1.521
  662    HE1  HIS  85           HE1      HIS  85  20.958  18.324   1.318
  Start of MODEL   11
    1    H2   PRO   1           H2       PRO   1  -0.985   6.966  -3.286
    2    H3   PRO   1           H3       PRO   1  -2.628   7.017  -3.240
    3    HA   PRO   1           HA       PRO   1  -2.816   4.686  -3.430
    4    HB2  PRO   1           HB2      PRO   1   0.170   4.627  -4.008
    5    HB3  PRO   1           HB3      PRO   1  -1.059   3.381  -4.403
    6    HG2  PRO   1           HG2      PRO   1  -0.287   5.412  -6.166
    7    HG3  PRO   1           HG3      PRO   1  -1.910   4.660  -6.194
    8    HD2  PRO   1           HD2      PRO   1  -1.312   7.391  -5.506
    9    HD3  PRO   1           HD3      PRO   1  -2.877   6.552  -5.469
   10    H    GLY   2           H        GLY   2  -1.975   2.883  -1.981
   11    HA2  GLY   2           HA2      GLY   2  -1.335   3.956   0.716
   12    HA3  GLY   2           HA3      GLY   2  -1.899   2.313   0.308
   13    H    SER   3           H        SER   3   0.391   2.615  -1.880
   14    HA   SER   3           HA       SER   3   2.869   2.520  -0.400
   15    HB2  SER   3           HB2      SER   3   3.453   0.185  -0.971
   16    HB3  SER   3           HB3      SER   3   2.083   0.261   0.134
   17    HG   SER   3           HG       SER   3   1.736  -1.258  -1.560
   18    H    ALA   4           H        ALA   4   4.731   1.961  -1.951
   19    HA   ALA   4           HA       ALA   4   4.283   2.534  -4.794
   20    HB1  ALA   4           HB1      ALA   4   3.963   4.766  -3.732
   21    HB2  ALA   4           HB2      ALA   4   5.546   4.624  -2.951
   22    HB3  ALA   4           HB3      ALA   4   5.421   4.730  -4.724
   23    H    GLU   5           H        GLU   5   6.425   3.047  -5.882
   24    HA   GLU   5           HA       GLU   5   8.884   2.046  -4.729
   25    HB2  GLU   5           HB2      GLU   5   9.250   0.231  -6.327
   26    HB3  GLU   5           HB3      GLU   5   7.870  -0.106  -5.289
   27    HG2  GLU   5           HG2      GLU   5   6.332   0.624  -7.145
   28    HG3  GLU   5           HG3      GLU   5   7.739   0.857  -8.177
   29    H    ILE   6           H        ILE   6  10.682   2.192  -6.328
   30    HA   ILE   6           HA       ILE   6  10.283   4.534  -8.170
   31    HB   ILE   6           HB       ILE   6  12.755   3.639  -6.649
   32   HG12  ILE   6          2HG1      ILE   6  11.175   4.526  -5.035
   33   HG13  ILE   6          3HG1      ILE   6  12.526   5.617  -5.253
   34   HG21  ILE   6          1HG2      ILE   6  13.612   5.935  -7.333
   35   HG22  ILE   6          2HG2      ILE   6  13.485   4.757  -8.632
   36   HG23  ILE   6          3HG2      ILE   6  12.253   6.034  -8.471
   37   HD11  ILE   6          3HD1      ILE   6  10.421   6.854  -5.051
   38   HD12  ILE   6          1HD1      ILE   6  11.136   7.120  -6.650
   39   HD13  ILE   6          2HD1      ILE   6   9.748   6.018  -6.448
   40    H    ASP   7           H        ASP   7  11.278   4.538 -10.191
   41    HA   ASP   7           HA       ASP   7  11.847   1.973 -11.461
   42    HB2  ASP   7           HB2      ASP   7  12.136   3.332 -13.477
   43    HB3  ASP   7           HB3      ASP   7  10.596   3.627 -12.675
   44    H    TYR   8           H        TYR   8  13.703   1.013 -10.984
   45    HA   TYR   8           HA       TYR   8  16.167   2.543 -10.481
   46    HB2  TYR   8           HB2      TYR   8  15.636  -0.435 -10.262
   47    HB3  TYR   8           HB3      TYR   8  17.074   0.404  -9.742
   48    HD1  TYR   8           HD2      TYR   8  16.355   2.691  -8.211
   49    HD2  TYR   8           HD1      TYR   8  14.308  -1.108  -8.432
   50    HE1  TYR   8           HE2      TYR   8  15.345   3.102  -5.984
   51    HE2  TYR   8           HE1      TYR   8  13.266  -0.673  -6.220
   52    HH   TYR   8           HH       TYR   8  13.067   0.794  -4.461
   53    H    SER   9           H        SER   9  15.066   2.319 -13.280
   54    HA   SER   9           HA       SER   9  16.740   0.757 -14.949
   55    HB2  SER   9           HB2      SER   9  15.582   3.514 -15.514
   56    HB3  SER   9           HB3      SER   9  16.047   2.297 -16.711
   57    HG   SER   9           HG       SER   9  14.348   0.977 -16.014
   58    H    ASP  10           H        ASP  10  17.564   3.684 -13.189
   59    HA   ASP  10           HA       ASP  10  19.929   4.377 -14.737
   60    HB2  ASP  10           HB2      ASP  10  18.999   5.165 -11.952
   61    HB3  ASP  10           HB3      ASP  10  20.339   5.910 -12.822
   62    H    ALA  11           H        ALA  11  19.369   1.768 -12.617
   63    HA   ALA  11           HA       ALA  11  21.601   1.863 -10.924
   64    HB1  ALA  11           HB1      ALA  11  19.703   0.409 -10.495
   65    HB2  ALA  11           HB2      ALA  11  20.043  -0.549 -11.947
   66    HB3  ALA  11           HB3      ALA  11  21.176  -0.557 -10.581
   67    HA   PRO  12           HA       PRO  12  24.986   0.837 -13.624
   68    HB2  PRO  12           HB2      PRO  12  26.931   0.151 -11.870
   69    HB3  PRO  12           HB3      PRO  12  26.278   1.814 -11.949
   70    HG2  PRO  12           HG2      PRO  12  25.440  -0.388 -10.034
   71    HG3  PRO  12           HG3      PRO  12  25.930   1.287  -9.632
   72    HD2  PRO  12           HD2      PRO  12  23.302   0.594  -9.920
   73    HD3  PRO  12           HD3      PRO  12  23.905   2.175 -10.496
   74    H    ASP  13           H        ASP  13  26.238  -0.951 -14.419
   75    HA   ASP  13           HA       ASP  13  24.846  -3.424 -14.539
   76    HB2  ASP  13           HB2      ASP  13  27.712  -2.719 -15.303
   77    HB3  ASP  13           HB3      ASP  13  26.884  -4.197 -15.773
   78    H    GLU  14           H        GLU  14  27.113  -2.376 -12.157
   79    HA   GLU  14           HA       GLU  14  27.852  -5.063 -11.233
   80    HB2  GLU  14           HB2      GLU  14  29.075  -3.973  -9.490
   81    HB3  GLU  14           HB3      GLU  14  29.418  -3.203 -11.031
   82    HG2  GLU  14           HG2      GLU  14  27.757  -1.386 -10.396
   83    HG3  GLU  14           HG3      GLU  14  27.643  -2.116  -8.798
   84    H    PHE  15           H        PHE  15  25.146  -2.947 -10.716
   85    HA   PHE  15           HA       PHE  15  24.221  -4.468  -8.299
   86    HB2  PHE  15           HB2      PHE  15  23.248  -1.926  -9.657
   87    HB3  PHE  15           HB3      PHE  15  22.416  -2.732  -8.354
   88    HD1  PHE  15           HD1      PHE  15  25.767  -3.116  -7.349
   89    HD2  PHE  15           HD2      PHE  15  22.691  -0.119  -7.810
   90    HE1  PHE  15           HE1      PHE  15  26.860  -1.720  -5.641
   91    HE2  PHE  15           HE2      PHE  15  23.824   1.285  -6.114
   92    HZ   PHE  15           HZ       PHE  15  25.903   0.487  -5.024
   93    H    ARG  16           H        ARG  16  23.707  -4.181 -11.749
   94    HA   ARG  16           HA       ARG  16  21.052  -5.479 -11.619
   95    HB2  ARG  16           HB2      ARG  16  22.711  -4.371 -13.904
   96    HB3  ARG  16           HB3      ARG  16  21.173  -5.223 -14.139
   97    HG2  ARG  16           HG2      ARG  16  19.939  -3.550 -12.901
   98    HG3  ARG  16           HG3      ARG  16  21.415  -2.782 -12.315
   99    HD2  ARG  16           HD2      ARG  16  20.523  -1.416 -14.030
  100    HD3  ARG  16           HD3      ARG  16  22.027  -2.132 -14.621
  101    HE   ARG  16           HE       ARG  16  20.058  -3.839 -15.580
  102   HH11  ARG  16          1HH1      ARG  16  20.583  -0.347 -15.838
  103   HH12  ARG  16          2HH1      ARG  16  19.816  -0.250 -17.394
  104   HH21  ARG  16          1HH2      ARG  16  19.144  -3.660 -17.670
  105   HH22  ARG  16          2HH2      ARG  16  19.035  -2.084 -18.399
  106    H    ASP  17           H        ASP  17  20.672  -7.595 -12.007
  107    HA   ASP  17           HA       ASP  17  22.904  -9.442 -12.532
  108    HB2  ASP  17           HB2      ASP  17  21.239 -10.066 -10.908
  109    HB3  ASP  17           HB3      ASP  17  19.949  -9.925 -12.102
  110    HA   PRO  18           HA       PRO  18  22.480  -9.033 -16.905
  111    HB2  PRO  18           HB2      PRO  18  23.340 -11.880 -17.255
  112    HB3  PRO  18           HB3      PRO  18  24.084 -10.393 -17.899
  113    HG2  PRO  18           HG2      PRO  18  25.149 -11.803 -15.807
  114    HG3  PRO  18           HG3      PRO  18  25.256 -10.019 -15.901
  115    HD2  PRO  18           HD2      PRO  18  23.412 -11.726 -14.263
  116    HD3  PRO  18           HD3      PRO  18  24.230 -10.189 -13.849
  117    H    LEU  19           H        LEU  19  21.063 -12.034 -15.561
  118    HA   LEU  19           HA       LEU  19  19.342 -12.468 -17.925
  119    HB2  LEU  19           HB2      LEU  19  20.376 -14.392 -16.833
  120    HB3  LEU  19           HB3      LEU  19  19.680 -13.935 -15.281
  121    HG   LEU  19           HG       LEU  19  17.407 -14.424 -16.145
  122   HD11  LEU  19          1HD1      LEU  19  17.745 -14.009 -18.565
  123   HD12  LEU  19          2HD1      LEU  19  17.167 -15.655 -18.305
  124   HD13  LEU  19          3HD1      LEU  19  18.884 -15.370 -18.653
  125   HD21  LEU  19          3HD2      LEU  19  17.664 -16.867 -16.209
  126   HD22  LEU  19          1HD2      LEU  19  18.695 -16.138 -14.962
  127   HD23  LEU  19          2HD2      LEU  19  19.408 -16.686 -16.499
  128    H    MET  20           H        MET  20  19.032 -11.382 -14.554
  129    HA   MET  20           HA       MET  20  16.145 -11.098 -14.631
  130    HB2  MET  20           HB2      MET  20  17.999 -11.120 -12.630
  131    HB3  MET  20           HB3      MET  20  17.783  -9.378 -12.798
  132    HG2  MET  20           HG2      MET  20  15.293  -9.747 -12.572
  133    HG3  MET  20           HG3      MET  20  15.620 -11.464 -12.289
  134    HE1  MET  20           HE1      MET  20  14.240 -11.367 -10.031
  135    HE2  MET  20           HE2      MET  20  14.500 -10.136  -8.776
  136    HE3  MET  20           HE3      MET  20  13.893  -9.662 -10.382
  137    H    ASP  21           H        ASP  21  18.797  -9.000 -15.542
  138    HA   ASP  21           HA       ASP  21  19.015  -6.982 -16.434
  139    HB2  ASP  21           HB2      ASP  21  17.792  -8.121 -18.252
  140    HB3  ASP  21           HB3      ASP  21  16.278  -7.429 -17.660
  141    H    THR  22           H        THR  22  18.226  -6.973 -13.830
  142    HA   THR  22           HA       THR  22  17.377  -4.257 -13.390
  143    HB   THR  22           HB       THR  22  15.188  -5.452 -13.793
  144    HG1  THR  22           HG1      THR  22  14.264  -4.334 -12.075
  145   HG21  THR  22          1HG2      THR  22  15.698  -6.650 -11.028
  146   HG22  THR  22          2HG2      THR  22  15.722  -7.563 -12.547
  147   HG23  THR  22          3HG2      THR  22  14.227  -6.793 -12.013
  148    H    LEU  23           H        LEU  23  17.139  -3.882 -10.988
  149    HA   LEU  23           HA       LEU  23  19.659  -4.473  -9.785
  150    HB2  LEU  23           HB2      LEU  23  17.789  -2.514  -9.554
  151    HB3  LEU  23           HB3      LEU  23  17.346  -3.451  -8.141
  152    HG   LEU  23           HG       LEU  23  20.032  -2.189  -8.778
  153   HD11  LEU  23          1HD1      LEU  23  19.536  -0.769  -6.823
  154   HD12  LEU  23          2HD1      LEU  23  17.997  -1.624  -6.589
  155   HD13  LEU  23          3HD1      LEU  23  18.252  -0.649  -8.044
  156   HD21  LEU  23          3HD2      LEU  23  20.765  -2.881  -6.526
  157   HD22  LEU  23          1HD2      LEU  23  20.485  -4.288  -7.530
  158   HD23  LEU  23          2HD2      LEU  23  19.268  -3.825  -6.321
  159    H    MET  24           H        MET  24  20.296  -6.284  -8.749
  160    HA   MET  24           HA       MET  24  18.448  -8.421  -8.285
  161    HB2  MET  24           HB2      MET  24  20.379  -9.671  -7.444
  162    HB3  MET  24           HB3      MET  24  20.680  -8.880  -8.989
  163    HG2  MET  24           HG2      MET  24  21.906  -7.057  -7.708
  164    HG3  MET  24           HG3      MET  24  21.749  -8.058  -6.263
  165    HE1  MET  24           HE1      MET  24  24.251  -6.958  -8.703
  166    HE2  MET  24           HE2      MET  24  24.427  -7.052  -6.940
  167    HE3  MET  24           HE3      MET  24  25.491  -7.999  -8.000
  168    H    THR  25           H        THR  25  19.846  -6.135  -6.033
  169    HA   THR  25           HA       THR  25  19.558  -5.596  -3.870
  170    HB   THR  25           HB       THR  25  17.522  -5.841  -2.724
  171    HG1  THR  25           HG1      THR  25  17.018  -7.881  -4.593
  172   HG21  THR  25          1HG2      THR  25  16.862  -5.471  -5.673
  173   HG22  THR  25          2HG2      THR  25  17.568  -4.230  -4.614
  174   HG23  THR  25          3HG2      THR  25  15.954  -4.871  -4.272
  175    H    ASP  26           H        ASP  26  19.414  -9.024  -4.468
  176    HA   ASP  26           HA       ASP  26  20.926  -9.495  -1.924
  177    HB2  ASP  26           HB2      ASP  26  18.728 -11.123  -3.213
  178    HB3  ASP  26           HB3      ASP  26  19.971 -11.868  -2.226
  179    HA   PRO  27           HA       PRO  27  23.723 -10.630  -5.436
  180    HB2  PRO  27           HB2      PRO  27  26.011  -9.518  -4.356
  181    HB3  PRO  27           HB3      PRO  27  24.840  -8.605  -5.341
  182    HG2  PRO  27           HG2      PRO  27  25.035  -8.716  -2.334
  183    HG3  PRO  27           HG3      PRO  27  24.815  -7.281  -3.387
  184    HD2  PRO  27           HD2      PRO  27  22.750  -8.453  -2.111
  185    HD3  PRO  27           HD3      PRO  27  22.557  -7.791  -3.754
  186    H    VAL  28           H        VAL  28  24.674 -12.606  -5.439
  187    HA   VAL  28           HA       VAL  28  25.953 -13.642  -2.936
  188    HB   VAL  28           HB       VAL  28  24.414 -15.318  -4.954
  189   HG11  VAL  28          1HG1      VAL  28  25.628 -16.092  -2.274
  190   HG12  VAL  28          2HG1      VAL  28  24.665 -17.138  -3.324
  191   HG13  VAL  28          3HG1      VAL  28  26.241 -16.569  -3.876
  192   HG21  VAL  28          3HG2      VAL  28  22.776 -15.684  -3.087
  193   HG22  VAL  28          1HG2      VAL  28  23.647 -14.474  -2.119
  194   HG23  VAL  28          2HG2      VAL  28  22.821 -13.990  -3.613
  195    H    ARG  29           H        ARG  29  27.915 -14.350  -3.111
  196    HA   ARG  29           HA       ARG  29  29.384 -13.952  -5.611
  197    HB2  ARG  29           HB2      ARG  29  29.942 -13.115  -3.250
  198    HB3  ARG  29           HB3      ARG  29  30.443 -14.752  -2.871
  199    HG2  ARG  29           HG2      ARG  29  32.163 -14.601  -4.685
  200    HG3  ARG  29           HG3      ARG  29  31.567 -12.998  -5.111
  201    HD2  ARG  29           HD2      ARG  29  33.502 -12.668  -3.768
  202    HD3  ARG  29           HD3      ARG  29  32.133 -12.214  -2.760
  203    HE   ARG  29           HE       ARG  29  33.817 -14.682  -2.564
  204   HH11  ARG  29          1HH1      ARG  29  31.300 -12.719  -0.968
  205   HH12  ARG  29          2HH1      ARG  29  31.523 -13.629   0.527
  206   HH21  ARG  29          1HH2      ARG  29  33.954 -15.715  -0.567
  207   HH22  ARG  29          2HH2      ARG  29  32.901 -15.167   0.733
  208    H    LEU  30           H        LEU  30  30.393 -15.492  -6.768
  209    HA   LEU  30           HA       LEU  30  30.195 -18.385  -6.018
  210    HB2  LEU  30           HB2      LEU  30  30.402 -16.851  -8.637
  211    HB3  LEU  30           HB3      LEU  30  30.964 -18.494  -8.553
  212    HG   LEU  30           HG       LEU  30  28.658 -19.132  -7.601
  213   HD11  LEU  30          1HD1      LEU  30  26.775 -17.626  -8.357
  214   HD12  LEU  30          2HD1      LEU  30  27.983 -16.359  -8.673
  215   HD13  LEU  30          3HD1      LEU  30  27.720 -16.959  -7.026
  216   HD21  LEU  30          3HD2      LEU  30  27.693 -19.222  -9.899
  217   HD22  LEU  30          1HD2      LEU  30  29.383 -19.757  -9.812
  218   HD23  LEU  30          2HD2      LEU  30  28.994 -18.140 -10.440
  219    HA   PRO  31           HA       PRO  31  34.459 -18.708  -5.172
  220    HB2  PRO  31           HB2      PRO  31  35.339 -21.023  -6.367
  221    HB3  PRO  31           HB3      PRO  31  34.242 -20.963  -4.958
  222    HG2  PRO  31           HG2      PRO  31  33.490 -21.236  -7.895
  223    HG3  PRO  31           HG3      PRO  31  32.934 -22.248  -6.522
  224    HD2  PRO  31           HD2      PRO  31  31.405 -20.241  -7.416
  225    HD3  PRO  31           HD3      PRO  31  31.576 -20.486  -5.658
  226    H    SER  32           H        SER  32  33.714 -18.652  -8.648
  227    HA   SER  32           HA       SER  32  36.402 -17.983  -9.528
  228    HB2  SER  32           HB2      SER  32  35.082 -17.430 -11.651
  229    HB3  SER  32           HB3      SER  32  35.029 -19.089 -11.063
  230    HG   SER  32           HG       SER  32  32.968 -17.117 -10.877
  231    H    GLY  33           H        GLY  33  34.320 -16.182  -7.662
  232    HA2  GLY  33           HA2      GLY  33  34.632 -13.976  -6.938
  233    HA3  GLY  33           HA3      GLY  33  35.659 -13.639  -8.350
  234    H    THR  34           H        THR  34  32.972 -15.002  -9.634
  235    HA   THR  34           HA       THR  34  31.703 -12.539 -10.503
  236    HB   THR  34           HB       THR  34  30.011 -14.317 -11.448
  237    HG1  THR  34           HG1      THR  34  30.965 -16.351 -11.643
  238   HG21  THR  34          1HG2      THR  34  31.508 -14.739 -13.350
  239   HG22  THR  34          2HG2      THR  34  32.908 -14.218 -12.387
  240   HG23  THR  34          3HG2      THR  34  31.627 -13.060 -12.814
  241    H    VAL  35           H        VAL  35  29.553 -11.940 -10.142
  242    HA   VAL  35           HA       VAL  35  28.293 -12.944  -7.622
  243    HB   VAL  35           HB       VAL  35  28.621 -10.010  -8.375
  244   HG11  VAL  35          1HG1      VAL  35  27.524  -9.548  -6.209
  245   HG12  VAL  35          2HG1      VAL  35  26.425 -10.398  -7.288
  246   HG13  VAL  35          3HG1      VAL  35  27.218 -11.276  -5.971
  247   HG21  VAL  35          3HG2      VAL  35  30.702 -10.944  -7.394
  248   HG22  VAL  35          1HG2      VAL  35  29.907  -9.856  -6.257
  249   HG23  VAL  35          2HG2      VAL  35  29.771 -11.617  -6.036
  250    H    MET  36           H        MET  36  26.265 -13.466  -7.869
  251    HA   MET  36           HA       MET  36  24.563 -12.312 -10.047
  252    HB2  MET  36           HB2      MET  36  25.130 -15.232  -9.416
  253    HB3  MET  36           HB3      MET  36  23.580 -14.739 -10.088
  254    HG2  MET  36           HG2      MET  36  24.771 -15.302 -11.962
  255    HG3  MET  36           HG3      MET  36  24.786 -13.551 -11.944
  256    HE1  MET  36           HE1      MET  36  28.316 -16.456 -11.743
  257    HE2  MET  36           HE2      MET  36  26.869 -16.696 -10.736
  258    HE3  MET  36           HE3      MET  36  26.739 -16.703 -12.508
  259    H    ASP  37           H        ASP  37  22.257 -12.737  -9.714
  260    HA   ASP  37           HA       ASP  37  21.289 -11.954  -7.126
  261    HB2  ASP  37           HB2      ASP  37  20.062 -11.374  -9.124
  262    HB3  ASP  37           HB3      ASP  37  19.997 -13.052  -9.649
  263    H    ARG  38           H        ARG  38  20.552 -13.050  -5.424
  264    HA   ARG  38           HA       ARG  38  21.139 -15.662  -4.766
  265    HB2  ARG  38           HB2      ARG  38  20.479 -13.830  -3.223
  266    HB3  ARG  38           HB3      ARG  38  18.793 -14.016  -3.723
  267    HG2  ARG  38           HG2      ARG  38  19.000 -16.463  -2.920
  268    HG3  ARG  38           HG3      ARG  38  20.553 -16.015  -2.222
  269    HD2  ARG  38           HD2      ARG  38  17.822 -14.828  -1.560
  270    HD3  ARG  38           HD3      ARG  38  18.702 -15.996  -0.572
  271    HE   ARG  38           HE       ARG  38  19.098 -13.121  -0.688
  272   HH11  ARG  38          1HH1      ARG  38  20.792 -16.110   0.176
  273   HH12  ARG  38          2HH1      ARG  38  21.816 -15.278   1.313
  274   HH21  ARG  38          1HH2      ARG  38  20.415 -12.133   0.684
  275   HH22  ARG  38          2HH2      ARG  38  21.617 -13.019   1.595
  276    H    SER  39           H        SER  39  17.944 -14.539  -6.032
  277    HA   SER  39           HA       SER  39  16.734 -17.144  -5.794
  278    HB2  SER  39           HB2      SER  39  15.853 -14.779  -7.480
  279    HB3  SER  39           HB3      SER  39  14.880 -16.191  -7.059
  280    HG   SER  39           HG       SER  39  14.467 -14.407  -5.639
  281    H    ILE  40           H        ILE  40  18.272 -15.443  -8.563
  282    HA   ILE  40           HA       ILE  40  17.752 -17.568 -10.456
  283    HB   ILE  40           HB       ILE  40  19.735 -15.267 -10.413
  284   HG12  ILE  40          2HG1      ILE  40  17.245 -15.866 -12.115
  285   HG13  ILE  40          3HG1      ILE  40  17.211 -14.883 -10.655
  286   HG21  ILE  40          1HG2      ILE  40  20.212 -15.743 -12.809
  287   HG22  ILE  40          2HG2      ILE  40  20.806 -17.020 -11.763
  288   HG23  ILE  40          3HG2      ILE  40  19.305 -17.264 -12.687
  289   HD11  ILE  40          3HD1      ILE  40  17.226 -13.436 -12.550
  290   HD12  ILE  40          1HD1      ILE  40  18.775 -13.260 -11.705
  291   HD13  ILE  40          2HD1      ILE  40  18.674 -14.184 -13.225
  292    H    ILE  41           H        ILE  41  20.644 -17.012  -8.355
  293    HA   ILE  41           HA       ILE  41  21.965 -19.311  -9.474
  294    HB   ILE  41           HB       ILE  41  23.171 -17.488  -8.329
  295   HG12  ILE  41          2HG1      ILE  41  24.846 -18.890  -7.164
  296   HG13  ILE  41          3HG1      ILE  41  23.734 -20.262  -7.198
  297   HG21  ILE  41          1HG2      ILE  41  21.774 -17.175  -6.338
  298   HG22  ILE  41          2HG2      ILE  41  22.264 -18.766  -5.711
  299   HG23  ILE  41          3HG2      ILE  41  23.456 -17.463  -5.908
  300   HD11  ILE  41          3HD1      ILE  41  25.510 -20.311  -8.966
  301   HD12  ILE  41          1HD1      ILE  41  23.874 -20.378  -9.626
  302   HD13  ILE  41          2HD1      ILE  41  24.808 -18.848  -9.669
  303    H    LEU  42           H        LEU  42  19.847 -19.086  -6.583
  304    HA   LEU  42           HA       LEU  42  20.160 -21.916  -6.017
  305    HB2  LEU  42           HB2      LEU  42  18.652 -21.665  -4.272
  306    HB3  LEU  42           HB3      LEU  42  19.566 -20.175  -4.351
  307    HG   LEU  42           HG       LEU  42  17.516 -19.226  -5.670
  308   HD11  LEU  42          1HD1      LEU  42  15.342 -20.198  -4.924
  309   HD12  LEU  42          2HD1      LEU  42  16.210 -21.587  -4.232
  310   HD13  LEU  42          3HD1      LEU  42  16.185 -21.311  -5.973
  311   HD21  LEU  42          3HD2      LEU  42  16.458 -18.574  -3.539
  312   HD22  LEU  42          1HD2      LEU  42  18.218 -18.556  -3.363
  313   HD23  LEU  42          2HD2      LEU  42  17.286 -19.906  -2.698
  314    H    ARG  43           H        ARG  43  17.891 -20.124  -8.102
  315    HA   ARG  43           HA       ARG  43  16.209 -22.381  -8.691
  316    HB2  ARG  43           HB2      ARG  43  15.566 -20.051  -9.186
  317    HB3  ARG  43           HB3      ARG  43  16.866 -19.936 -10.384
  318    HG2  ARG  43           HG2      ARG  43  15.737 -21.828 -11.654
  319    HG3  ARG  43           HG3      ARG  43  14.412 -21.750 -10.469
  320    HD2  ARG  43           HD2      ARG  43  14.087 -19.329 -11.094
  321    HD3  ARG  43           HD3      ARG  43  15.379 -19.507 -12.298
  322    HE   ARG  43           HE       ARG  43  13.458 -21.539 -12.775
  323   HH11  ARG  43          1HH1      ARG  43  13.645 -18.027 -13.042
  324   HH12  ARG  43          2HH1      ARG  43  12.467 -17.967 -14.323
  325   HH21  ARG  43          1HH2      ARG  43  11.953 -21.401 -14.431
  326   HH22  ARG  43          2HH2      ARG  43  11.516 -19.853 -15.088
  327    H    HIS  44           H        HIS  44  19.144 -21.066 -10.362
  328    HA   HIS  44           HA       HIS  44  19.086 -22.999 -12.427
  329    HB2  HIS  44           HB2      HIS  44  20.411 -20.832 -12.325
  330    HB3  HIS  44           HB3      HIS  44  21.620 -21.694 -11.362
  331    HD1  HIS  44           HD1      HIS  44  23.261 -23.287 -12.793
  332    HD2  HIS  44           HD2      HIS  44  19.926 -21.775 -14.874
  333    HE1  HIS  44           HE1      HIS  44  23.578 -23.942 -15.224
  334    H    LEU  45           H        LEU  45  20.584 -23.238  -9.195
  335    HA   LEU  45           HA       LEU  45  21.936 -25.700  -9.505
  336    HB2  LEU  45           HB2      LEU  45  20.607 -24.328  -7.150
  337    HB3  LEU  45           HB3      LEU  45  21.350 -25.906  -6.963
  338    HG   LEU  45           HG       LEU  45  22.846 -23.454  -7.976
  339   HD11  LEU  45          1HD1      LEU  45  22.808 -24.754  -5.214
  340   HD12  LEU  45          2HD1      LEU  45  22.141 -23.154  -5.630
  341   HD13  LEU  45          3HD1      LEU  45  23.886 -23.442  -5.714
  342   HD21  LEU  45          3HD2      LEU  45  24.852 -24.874  -7.358
  343   HD22  LEU  45          1HD2      LEU  45  23.952 -25.451  -8.755
  344   HD23  LEU  45          2HD2      LEU  45  23.763 -26.248  -7.168
  345    H    LEU  46           H        LEU  46  18.452 -25.175  -9.091
  346    HA   LEU  46           HA       LEU  46  17.831 -27.999  -8.693
  347    HB2  LEU  46           HB2      LEU  46  16.055 -25.699  -9.607
  348    HB3  LEU  46           HB3      LEU  46  15.503 -27.281  -9.093
  349    HG   LEU  46           HG       LEU  46  16.963 -25.305  -7.291
  350   HD11  LEU  46          1HD1      LEU  46  14.011 -26.029  -7.437
  351   HD12  LEU  46          2HD1      LEU  46  14.734 -24.492  -7.946
  352   HD13  LEU  46          3HD1      LEU  46  14.768 -24.944  -6.241
  353   HD21  LEU  46          3HD2      LEU  46  15.590 -27.952  -6.667
  354   HD22  LEU  46          1HD2      LEU  46  16.183 -26.798  -5.452
  355   HD23  LEU  46          2HD2      LEU  46  17.326 -27.597  -6.522
  356    H    ASN  47           H        ASN  47  18.381 -25.967 -11.524
  357    HA   ASN  47           HA       ASN  47  17.258 -27.907 -13.426
  358    HB2  ASN  47           HB2      ASN  47  19.045 -25.490 -13.907
  359    HB3  ASN  47           HB3      ASN  47  18.204 -26.442 -15.121
  360   HD21  ASN  47          1HD2      ASN  47  15.664 -26.659 -14.612
  361   HD22  ASN  47          2HD2      ASN  47  14.917 -25.119 -14.214
  362    H    SER  48           H        SER  48  20.521 -26.923 -12.304
  363    HA   SER  48           HA       SER  48  21.657 -29.576 -12.632
  364    HB2  SER  48           HB2      SER  48  22.275 -27.436 -14.679
  365    HB3  SER  48           HB3      SER  48  23.527 -28.580 -14.192
  366    HG   SER  48           HG       SER  48  20.964 -29.383 -15.158
  367    HA   PRO  49           HA       PRO  49  24.379 -27.656  -9.626
  368    HB2  PRO  49           HB2      PRO  49  26.358 -29.478  -9.359
  369    HB3  PRO  49           HB3      PRO  49  24.665 -29.875  -8.959
  370    HG2  PRO  49           HG2      PRO  49  26.126 -30.482 -11.557
  371    HG3  PRO  49           HG3      PRO  49  25.182 -31.603 -10.526
  372    HD2  PRO  49           HD2      PRO  49  24.107 -30.332 -12.708
  373    HD3  PRO  49           HD3      PRO  49  23.148 -30.710 -11.243
  374    H    THR  50           H        THR  50  24.527 -26.085 -11.626
  375    HA   THR  50           HA       THR  50  27.367 -25.577 -12.286
  376    HB   THR  50           HB       THR  50  26.591 -25.027 -14.668
  377    HG1  THR  50           HG1      THR  50  24.771 -26.223 -15.346
  378   HG21  THR  50          1HG2      THR  50  26.493 -27.968 -13.910
  379   HG22  THR  50          2HG2      THR  50  27.979 -27.009 -14.169
  380   HG23  THR  50          3HG2      THR  50  26.858 -27.267 -15.504
  381    H    ASP  51           H        ASP  51  27.816 -23.577 -13.094
  382    HA   ASP  51           HA       ASP  51  26.546 -21.286 -11.933
  383    HB2  ASP  51           HB2      ASP  51  28.928 -21.557 -12.361
  384    HB3  ASP  51           HB3      ASP  51  28.638 -21.715 -14.094
  385    HA   PRO  52           HA       PRO  52  23.346 -20.755 -14.977
  386    HB2  PRO  52           HB2      PRO  52  22.628 -18.111 -14.576
  387    HB3  PRO  52           HB3      PRO  52  22.200 -19.460 -13.484
  388    HG2  PRO  52           HG2      PRO  52  24.500 -17.521 -13.243
  389    HG3  PRO  52           HG3      PRO  52  23.342 -18.039 -11.970
  390    HD2  PRO  52           HD2      PRO  52  25.792 -19.164 -12.162
  391    HD3  PRO  52           HD3      PRO  52  24.356 -20.179 -11.808
  392    H    PHE  53           H        PHE  53  26.228 -18.762 -15.252
  393    HA   PHE  53           HA       PHE  53  25.467 -18.038 -18.072
  394    HB2  PHE  53           HB2      PHE  53  27.244 -16.585 -16.079
  395    HB3  PHE  53           HB3      PHE  53  26.986 -16.112 -17.748
  396    HD1  PHE  53           HD2      PHE  53  24.567 -15.615 -18.530
  397    HD2  PHE  53           HD1      PHE  53  25.752 -15.800 -14.385
  398    HE1  PHE  53           HE2      PHE  53  22.550 -14.315 -17.894
  399    HE2  PHE  53           HE1      PHE  53  23.696 -14.523 -13.760
  400    HZ   PHE  53           HZ       PHE  53  22.142 -13.768 -15.482
  401    H    ASN  54           H        ASN  54  28.126 -19.169 -15.961
  402    HA   ASN  54           HA       ASN  54  29.964 -19.369 -18.292
  403    HB2  ASN  54           HB2      ASN  54  30.441 -19.894 -15.340
  404    HB3  ASN  54           HB3      ASN  54  31.676 -19.827 -16.601
  405   HD21  ASN  54          1HD2      ASN  54  29.972 -17.955 -14.264
  406   HD22  ASN  54          2HD2      ASN  54  30.482 -16.384 -14.863
  407    H    ARG  55           H        ARG  55  27.959 -21.441 -16.345
  408    HA   ARG  55           HA       ARG  55  27.487 -23.585 -16.266
  409    HB2  ARG  55           HB2      ARG  55  28.646 -23.722 -19.084
  410    HB3  ARG  55           HB3      ARG  55  27.544 -24.893 -18.382
  411    HG2  ARG  55           HG2      ARG  55  26.860 -21.959 -18.841
  412    HG3  ARG  55           HG3      ARG  55  26.438 -23.274 -19.924
  413    HD2  ARG  55           HD2      ARG  55  24.889 -24.230 -18.416
  414    HD3  ARG  55           HD3      ARG  55  25.545 -23.375 -17.035
  415    HE   ARG  55           HE       ARG  55  24.364 -21.487 -17.509
  416   HH11  ARG  55          1HH1      ARG  55  23.948 -23.652 -20.281
  417   HH12  ARG  55          2HH1      ARG  55  22.684 -22.676 -20.961
  418   HH21  ARG  55          1HH2      ARG  55  22.813 -20.259 -18.453
  419   HH22  ARG  55          2HH2      ARG  55  22.020 -20.774 -19.925
  420    H    GLN  56           H        GLN  56  30.357 -22.773 -15.581
  421    HA   GLN  56           HA       GLN  56  31.832 -25.252 -15.305
  422    HB2  GLN  56           HB2      GLN  56  32.978 -24.085 -13.490
  423    HB3  GLN  56           HB3      GLN  56  32.891 -23.058 -14.925
  424    HG2  GLN  56           HG2      GLN  56  30.989 -21.817 -13.926
  425    HG3  GLN  56           HG3      GLN  56  31.062 -22.837 -12.473
  426   HE21  GLN  56          1HE2      GLN  56  31.200 -19.974 -12.460
  427   HE22  GLN  56          2HE2      GLN  56  32.775 -19.581 -11.799
  428    H    MET  57           H        MET  57  31.860 -26.640 -13.410
  429    HA   MET  57           HA       MET  57  29.287 -27.156 -12.235
  430    HB2  MET  57           HB2      MET  57  30.486 -28.810 -10.856
  431    HB3  MET  57           HB3      MET  57  30.701 -29.004 -12.590
  432    HG2  MET  57           HG2      MET  57  32.774 -27.595 -10.852
  433    HG3  MET  57           HG3      MET  57  32.730 -29.342 -11.071
  434    HE1  MET  57           HE1      MET  57  35.241 -29.306 -11.797
  435    HE2  MET  57           HE2      MET  57  35.880 -28.278 -13.091
  436    HE3  MET  57           HE3      MET  57  35.251 -27.536 -11.608
  437    H    LEU  58           H        LEU  58  28.473 -26.767 -10.254
  438    HA   LEU  58           HA       LEU  58  29.840 -24.973  -8.335
  439    HB2  LEU  58           HB2      LEU  58  29.090 -23.592 -10.265
  440    HB3  LEU  58           HB3      LEU  58  27.446 -24.147 -10.038
  441    HG   LEU  58           HG       LEU  58  28.005 -21.820  -9.287
  442   HD11  LEU  58          1HD1      LEU  58  26.553 -21.808  -7.391
  443   HD12  LEU  58          2HD1      LEU  58  26.836 -23.505  -7.057
  444   HD13  LEU  58          3HD1      LEU  58  25.970 -23.019  -8.539
  445   HD21  LEU  58          3HD2      LEU  58  29.080 -21.424  -7.140
  446   HD22  LEU  58          1HD2      LEU  58  30.197 -22.278  -8.222
  447   HD23  LEU  58          2HD2      LEU  58  29.372 -23.153  -6.918
  448    H    THR  59           H        THR  59  29.061 -25.216  -6.323
  449    HA   THR  59           HA       THR  59  26.435 -26.539  -5.852
  450    HB   THR  59           HB       THR  59  27.622 -27.515  -3.748
  451    HG1  THR  59           HG1      THR  59  29.800 -27.838  -4.000
  452   HG21  THR  59          1HG2      THR  59  28.197 -28.605  -6.528
  453   HG22  THR  59          2HG2      THR  59  26.740 -28.880  -5.551
  454   HG23  THR  59          3HG2      THR  59  28.296 -29.521  -4.997
  455    H    GLU  60           H        GLU  60  25.481 -26.146  -3.857
  456    HA   GLU  60           HA       GLU  60  25.273 -23.447  -3.138
  457    HB2  GLU  60           HB2      GLU  60  23.820 -24.283  -1.312
  458    HB3  GLU  60           HB3      GLU  60  23.453 -25.031  -2.868
  459    HG2  GLU  60           HG2      GLU  60  24.681 -27.085  -2.225
  460    HG3  GLU  60           HG3      GLU  60  25.121 -26.342  -0.677
  461    H    SER  61           H        SER  61  27.524 -25.818  -1.850
  462    HA   SER  61           HA       SER  61  28.105 -24.434   0.646
  463    HB2  SER  61           HB2      SER  61  30.015 -26.058   0.703
  464    HB3  SER  61           HB3      SER  61  28.415 -26.792   0.556
  465    HG   SER  61           HG       SER  61  29.991 -27.716  -0.890
  466    H    MET  62           H        MET  62  29.076 -23.921  -2.643
  467    HA   MET  62           HA       MET  62  31.562 -22.492  -1.915
  468    HB2  MET  62           HB2      MET  62  30.252 -22.883  -4.639
  469    HB3  MET  62           HB3      MET  62  31.875 -22.286  -4.310
  470    HG2  MET  62           HG2      MET  62  30.843 -25.093  -3.780
  471    HG3  MET  62           HG3      MET  62  31.954 -24.599  -5.042
  472    HE1  MET  62           HE1      MET  62  34.434 -23.835  -4.652
  473    HE2  MET  62           HE2      MET  62  34.029 -22.634  -3.396
  474    HE3  MET  62           HE3      MET  62  35.269 -23.866  -3.087
  475    H    LEU  63           H        LEU  63  28.332 -21.679  -1.931
  476    HA   LEU  63           HA       LEU  63  28.592 -18.932  -3.034
  477    HB2  LEU  63           HB2      LEU  63  26.218 -20.506  -1.963
  478    HB3  LEU  63           HB3      LEU  63  26.136 -18.893  -2.653
  479    HG   LEU  63           HG       LEU  63  26.947 -21.443  -4.128
  480   HD11  LEU  63          1HD1      LEU  63  24.542 -21.260  -3.584
  481   HD12  LEU  63          2HD1      LEU  63  24.853 -21.153  -5.325
  482   HD13  LEU  63          3HD1      LEU  63  24.481 -19.682  -4.388
  483   HD21  LEU  63          3HD2      LEU  63  26.716 -18.554  -5.115
  484   HD22  LEU  63          1HD2      LEU  63  26.830 -19.963  -6.170
  485   HD23  LEU  63          2HD2      LEU  63  28.178 -19.572  -5.114
  486    H    GLU  64           H        GLU  64  28.101 -17.078  -1.927
  487    HA   GLU  64           HA       GLU  64  27.389 -17.068   0.888
  488    HB2  GLU  64           HB2      GLU  64  29.844 -17.407   1.042
  489    HB3  GLU  64           HB3      GLU  64  30.102 -15.976   0.032
  490    HG2  GLU  64           HG2      GLU  64  29.099 -14.543   1.765
  491    HG3  GLU  64           HG3      GLU  64  28.726 -15.965   2.756
  492    HA   PRO  65           HA       PRO  65  25.610 -13.358  -0.929
  493    HB2  PRO  65           HB2      PRO  65  24.430 -12.193   1.236
  494    HB3  PRO  65           HB3      PRO  65  23.808 -13.672   0.448
  495    HG2  PRO  65           HG2      PRO  65  25.584 -13.490   2.909
  496    HG3  PRO  65           HG3      PRO  65  24.079 -14.442   2.704
  497    HD2  PRO  65           HD2      PRO  65  26.522 -15.573   2.357
  498    HD3  PRO  65           HD3      PRO  65  25.148 -16.021   1.305
  499    H    VAL  66           H        VAL  66  26.204 -11.240  -1.248
  500    HA   VAL  66           HA       VAL  66  28.756 -10.423   0.006
  501    HB   VAL  66           HB       VAL  66  27.370  -9.154  -2.374
  502   HG11  VAL  66          1HG1      VAL  66  29.657  -8.214  -2.777
  503   HG12  VAL  66          2HG1      VAL  66  28.958  -7.615  -1.272
  504   HG13  VAL  66          3HG1      VAL  66  30.193  -8.888  -1.238
  505   HG21  VAL  66          3HG2      VAL  66  29.623 -11.180  -2.241
  506   HG22  VAL  66          1HG2      VAL  66  27.994 -11.471  -2.922
  507   HG23  VAL  66          2HG2      VAL  66  29.093 -10.335  -3.712
  508    HA   PRO  67           HA       PRO  67  26.165  -7.508   2.388
  509    HB2  PRO  67           HB2      PRO  67  27.904  -6.881   4.388
  510    HB3  PRO  67           HB3      PRO  67  27.112  -8.487   4.298
  511    HG2  PRO  67           HG2      PRO  67  29.899  -7.727   3.360
  512    HG3  PRO  67           HG3      PRO  67  29.395  -9.134   4.364
  513    HD2  PRO  67           HD2      PRO  67  29.769  -9.318   1.635
  514    HD3  PRO  67           HD3      PRO  67  28.533 -10.263   2.509
  515    H    GLU  68           H        GLU  68  29.539  -6.719   1.388
  516    HA   GLU  68           HA       GLU  68  29.229  -3.907   1.764
  517    HB2  GLU  68           HB2      GLU  68  31.263  -3.658   0.468
  518    HB3  GLU  68           HB3      GLU  68  31.407  -4.955   1.654
  519    HG2  GLU  68           HG2      GLU  68  31.071  -6.645  -0.133
  520    HG3  GLU  68           HG3      GLU  68  30.908  -5.354  -1.333
  521    H    LEU  69           H        LEU  69  28.317  -5.945  -0.987
  522    HA   LEU  69           HA       LEU  69  27.545  -3.615  -2.636
  523    HB2  LEU  69           HB2      LEU  69  27.076  -6.621  -2.899
  524    HB3  LEU  69           HB3      LEU  69  26.395  -5.434  -4.015
  525    HG   LEU  69           HG       LEU  69  29.378  -5.859  -3.541
  526   HD11  LEU  69          1HD1      LEU  69  27.579  -6.649  -5.889
  527   HD12  LEU  69          2HD1      LEU  69  28.228  -7.763  -4.675
  528   HD13  LEU  69          3HD1      LEU  69  29.333  -6.913  -5.773
  529   HD21  LEU  69          3HD2      LEU  69  27.887  -4.123  -5.565
  530   HD22  LEU  69          1HD2      LEU  69  29.636  -4.460  -5.588
  531   HD23  LEU  69          2HD2      LEU  69  28.944  -3.545  -4.250
  532    H    LYS  70           H        LYS  70  25.863  -6.004  -0.547
  533    HA   LYS  70           HA       LYS  70  23.239  -5.050  -1.203
  534    HB2  LYS  70           HB2      LYS  70  23.815  -7.247  -0.200
  535    HB3  LYS  70           HB3      LYS  70  24.173  -6.455   1.343
  536    HG2  LYS  70           HG2      LYS  70  21.859  -5.738   1.562
  537    HG3  LYS  70           HG3      LYS  70  21.496  -6.225  -0.101
  538    HD2  LYS  70           HD2      LYS  70  21.995  -8.599   0.519
  539    HD3  LYS  70           HD3      LYS  70  22.208  -8.099   2.201
  540    HE2  LYS  70           HE2      LYS  70  19.658  -7.702   0.549
  541    HE3  LYS  70           HE3      LYS  70  19.951  -9.055   1.639
  542    HZ1  LYS  70           HZ1      LYS  70  18.672  -7.343   2.733
  543    HZ2  LYS  70           HZ2      LYS  70  19.806  -6.216   2.443
  544    HZ3  LYS  70           HZ3      LYS  70  20.127  -7.457   3.466
  545    H    GLU  71           H        GLU  71  25.440  -4.060   1.420
  546    HA   GLU  71           HA       GLU  71  23.681  -2.130   2.620
  547    HB2  GLU  71           HB2      GLU  71  25.651  -3.185   3.703
  548    HB3  GLU  71           HB3      GLU  71  26.727  -2.276   2.637
  549    HG2  GLU  71           HG2      GLU  71  25.928  -0.153   3.596
  550    HG3  GLU  71           HG3      GLU  71  24.731  -1.024   4.571
  551    H    GLN  72           H        GLN  72  25.954  -1.924  -0.106
  552    HA   GLN  72           HA       GLN  72  25.663   0.991  -0.422
  553    HB2  GLN  72           HB2      GLN  72  26.871  -1.187  -2.169
  554    HB3  GLN  72           HB3      GLN  72  26.692   0.495  -2.700
  555    HG2  GLN  72           HG2      GLN  72  28.014   1.302  -0.803
  556    HG3  GLN  72           HG3      GLN  72  28.211  -0.350  -0.209
  557   HE21  GLN  72          1HE2      GLN  72  29.462  -1.871  -1.574
  558   HE22  GLN  72          2HE2      GLN  72  30.677  -1.232  -2.691
  559    H    ILE  73           H        ILE  73  24.199  -1.860  -2.008
  560    HA   ILE  73           HA       ILE  73  22.616  -0.504  -3.926
  561    HB   ILE  73           HB       ILE  73  22.376  -3.160  -2.479
  562   HG12  ILE  73          2HG1      ILE  73  22.779  -2.520  -5.432
  563   HG13  ILE  73          3HG1      ILE  73  24.116  -2.662  -4.303
  564   HG21  ILE  73          1HG2      ILE  73  20.397  -1.997  -4.465
  565   HG22  ILE  73          2HG2      ILE  73  20.547  -3.736  -4.152
  566   HG23  ILE  73          3HG2      ILE  73  20.073  -2.662  -2.850
  567   HD11  ILE  73          3HD1      ILE  73  23.395  -5.023  -3.791
  568   HD12  ILE  73          1HD1      ILE  73  22.192  -4.880  -5.095
  569   HD13  ILE  73          2HD1      ILE  73  23.915  -4.742  -5.458
  570    H    GLN  74           H        GLN  74  21.649  -1.426  -0.580
  571    HA   GLN  74           HA       GLN  74  19.045  -0.272  -0.824
  572    HB2  GLN  74           HB2      GLN  74  18.829  -0.630   1.544
  573    HB3  GLN  74           HB3      GLN  74  19.653  -1.992   0.806
  574    HG2  GLN  74           HG2      GLN  74  20.875  -1.688   2.753
  575    HG3  GLN  74           HG3      GLN  74  21.852  -0.897   1.553
  576   HE21  GLN  74          1HE2      GLN  74  22.886   0.725   2.738
  577   HE22  GLN  74          2HE2      GLN  74  22.040   1.867   3.775
  578    H    ALA  75           H        ALA  75  22.132   1.244   0.088
  579    HA   ALA  75           HA       ALA  75  20.964   3.756   0.954
  580    HB1  ALA  75           HB1      ALA  75  23.276   4.582   0.732
  581    HB2  ALA  75           HB2      ALA  75  23.248   3.033   1.593
  582    HB3  ALA  75           HB3      ALA  75  23.754   3.094  -0.109
  583    H    TRP  76           H        TRP  76  22.178   2.542  -2.206
  584    HA   TRP  76           HA       TRP  76  21.709   4.985  -3.650
  585    HB2  TRP  76           HB2      TRP  76  23.229   3.167  -4.373
  586    HB3  TRP  76           HB3      TRP  76  21.848   2.121  -4.642
  587    HD1  TRP  76           HD1      TRP  76  23.644   5.176  -6.062
  588    HE1  TRP  76           HE1      TRP  76  22.841   5.651  -8.456
  589    HE3  TRP  76           HE3      TRP  76  19.833   1.755  -6.330
  590    HZ2  TRP  76           HZ2      TRP  76  20.757   4.727 -10.224
  591    HZ3  TRP  76           HZ3      TRP  76  18.448   1.591  -8.364
  592    HH2  TRP  76           HH2      TRP  76  18.881   3.063 -10.314
  593    H    MET  77           H        MET  77  19.658   2.058  -3.173
  594    HA   MET  77           HA       MET  77  17.374   2.950  -4.652
  595    HB2  MET  77           HB2      MET  77  17.611   1.144  -2.209
  596    HB3  MET  77           HB3      MET  77  16.120   1.397  -3.117
  597    HG2  MET  77           HG2      MET  77  17.032   0.409  -5.107
  598    HG3  MET  77           HG3      MET  77  18.655   0.383  -4.436
  599    HE1  MET  77           HE1      MET  77  15.146  -0.723  -2.822
  600    HE2  MET  77           HE2      MET  77  15.141  -1.276  -4.515
  601    HE3  MET  77           HE3      MET  77  15.217  -2.457  -3.196
  602    H    ARG  78           H        ARG  78  18.310   3.546  -1.261
  603    HA   ARG  78           HA       ARG  78  15.973   5.020  -0.522
  604    HB2  ARG  78           HB2      ARG  78  17.637   3.894   0.959
  605    HB3  ARG  78           HB3      ARG  78  18.779   5.211   0.664
  606    HG2  ARG  78           HG2      ARG  78  17.085   6.795   1.651
  607    HG3  ARG  78           HG3      ARG  78  16.031   5.405   1.977
  608    HD2  ARG  78           HD2      ARG  78  18.811   5.933   3.120
  609    HD3  ARG  78           HD3      ARG  78  17.288   6.021   3.993
  610    HE   ARG  78           HE       ARG  78  18.850   3.641   3.348
  611   HH11  ARG  78          1HH1      ARG  78  15.576   4.651   4.248
  612   HH12  ARG  78          2HH1      ARG  78  15.143   3.047   4.770
  613   HH21  ARG  78          1HH2      ARG  78  18.219   1.620   3.981
  614   HH22  ARG  78          2HH2      ARG  78  16.611   1.355   4.605
  615    H    GLU  79           H        GLU  79  19.190   6.136  -1.718
  616    HA   GLU  79           HA       GLU  79  18.608   8.923  -1.757
  617    HB2  GLU  79           HB2      GLU  79  20.852   7.872  -1.969
  618    HB3  GLU  79           HB3      GLU  79  20.449   7.363  -3.616
  619    HG2  GLU  79           HG2      GLU  79  20.247   9.681  -4.344
  620    HG3  GLU  79           HG3      GLU  79  20.444  10.265  -2.676
  621    H    LYS  80           H        LYS  80  18.046   6.413  -4.276
  622    HA   LYS  80           HA       LYS  80  17.071   8.067  -6.338
  623    HB2  LYS  80           HB2      LYS  80  16.802   5.176  -5.535
  624    HB3  LYS  80           HB3      LYS  80  15.804   5.752  -6.841
  625    HG2  LYS  80           HG2      LYS  80  18.816   6.198  -6.842
  626    HG3  LYS  80           HG3      LYS  80  18.103   4.695  -7.410
  627    HD2  LYS  80           HD2      LYS  80  17.309   7.419  -8.539
  628    HD3  LYS  80           HD3      LYS  80  18.591   6.415  -9.227
  629    HE2  LYS  80           HE2      LYS  80  17.117   4.652  -9.801
  630    HE3  LYS  80           HE3      LYS  80  15.820   5.259  -8.771
  631    HZ1  LYS  80           HZ1      LYS  80  15.587   7.149 -10.289
  632    HZ2  LYS  80           HZ2      LYS  80  15.330   5.725 -11.046
  633    HZ3  LYS  80           HZ3      LYS  80  16.720   6.528 -11.298
  634    H    GLN  81           H        GLN  81  15.427   7.366  -3.370
  635    HA   GLN  81           HA       GLN  81  12.747   8.013  -4.383
  636    HB2  GLN  81           HB2      GLN  81  13.258   6.483  -2.446
  637    HB3  GLN  81           HB3      GLN  81  13.782   7.895  -1.519
  638    HG2  GLN  81           HG2      GLN  81  11.504   8.862  -1.687
  639    HG3  GLN  81           HG3      GLN  81  10.991   7.505  -2.690
  640   HE21  GLN  81          1HE2      GLN  81  11.117   5.250  -1.617
  641   HE22  GLN  81          2HE2      GLN  81  10.820   5.206   0.111
  642    H    SER  82           H        SER  82  15.550   9.839  -3.238
  643    HA   SER  82           HA       SER  82  13.938  12.334  -2.870
  644    HB2  SER  82           HB2      SER  82  16.715  11.562  -1.914
  645    HB3  SER  82           HB3      SER  82  15.908  13.105  -1.600
  646    HG   SER  82           HG       SER  82  15.675  11.635   0.159
  647    H    SER  83           H        SER  83  15.798  10.907  -5.274
  648    HA   SER  83           HA       SER  83  17.523  13.087  -5.996
  649    HB2  SER  83           HB2      SER  83  18.101  11.628  -7.910
  650    HB3  SER  83           HB3      SER  83  18.153  10.789  -6.361
  651    HG   SER  83           HG       SER  83  16.106  10.629  -8.359
  652    H    ASP  84           H        ASP  84  14.379  13.405  -6.202
  653    HA   ASP  84           HA       ASP  84  13.815  14.168  -8.938
  654    HB2  ASP  84           HB2      ASP  84  12.098  13.611  -7.230
  655    HB3  ASP  84           HB3      ASP  84  12.561  15.036  -6.296
  656    H    HIS  85           H        HIS  85  15.427  15.821  -6.277
  657    HA   HIS  85           HA       HIS  85  15.453  18.443  -7.668
  658    HB2  HIS  85           HB2      HIS  85  14.980  18.377  -5.246
  659    HB3  HIS  85           HB3      HIS  85  16.539  17.597  -4.952
  660    HD1  HIS  85           HD1      HIS  85  15.202  20.979  -6.384
  661    HD2  HIS  85           HD2      HIS  85  18.589  19.195  -4.625
  662    HE1  HIS  85           HE1      HIS  85  16.851  22.870  -5.952
  Start of MODEL   12
    1    H2   PRO   1           H2       PRO   1   6.676   4.673  -1.733
    2    H3   PRO   1           H3       PRO   1   7.930   3.981  -0.938
    3    HA   PRO   1           HA       PRO   1   6.901   4.368   1.172
    4    HB2  PRO   1           HB2      PRO   1   4.731   5.915  -0.290
    5    HB3  PRO   1           HB3      PRO   1   5.241   6.040   1.430
    6    HG2  PRO   1           HG2      PRO   1   6.213   7.598  -0.741
    7    HG3  PRO   1           HG3      PRO   1   7.022   7.437   0.845
    8    HD2  PRO   1           HD2      PRO   1   8.090   6.507  -1.600
    9    HD3  PRO   1           HD3      PRO   1   8.600   6.013   0.031
   10    H    GLY   2           H        GLY   2   3.872   4.127   1.185
   11    HA2  GLY   2           HA2      GLY   2   3.807   1.211   0.655
   12    HA3  GLY   2           HA3      GLY   2   2.623   2.184   1.566
   13    H    SER   3           H        SER   3   2.197   4.167  -0.526
   14    HA   SER   3           HA       SER   3   0.269   2.673  -2.143
   15    HB2  SER   3           HB2      SER   3   0.932   5.635  -2.134
   16    HB3  SER   3           HB3      SER   3  -0.461   4.877  -2.910
   17    HG   SER   3           HG       SER   3  -0.990   5.746  -0.839
   18    H    ALA   4           H        ALA   4   3.453   3.932  -2.668
   19    HA   ALA   4           HA       ALA   4   3.744   2.853  -5.317
   20    HB1  ALA   4           HB1      ALA   4   4.211   5.018  -6.467
   21    HB2  ALA   4           HB2      ALA   4   2.527   4.926  -5.936
   22    HB3  ALA   4           HB3      ALA   4   3.682   5.891  -5.008
   23    H    GLU   5           H        GLU   5   5.958   3.027  -6.057
   24    HA   GLU   5           HA       GLU   5   8.006   3.790  -4.010
   25    HB2  GLU   5           HB2      GLU   5   7.674   1.173  -5.533
   26    HB3  GLU   5           HB3      GLU   5   9.229   1.661  -4.877
   27    HG2  GLU   5           HG2      GLU   5   6.791   1.511  -3.073
   28    HG3  GLU   5           HG3      GLU   5   7.712   0.081  -3.501
   29    H    ILE   6           H        ILE   6  10.173   3.927  -4.919
   30    HA   ILE   6           HA       ILE   6  10.249   5.601  -7.296
   31    HB   ILE   6           HB       ILE   6  12.448   4.463  -5.513
   32   HG12  ILE   6          2HG1      ILE   6  12.727   6.882  -4.810
   33   HG13  ILE   6          3HG1      ILE   6  11.208   7.250  -5.620
   34   HG21  ILE   6          1HG2      ILE   6  13.426   4.928  -7.692
   35   HG22  ILE   6          2HG2      ILE   6  12.662   6.542  -7.740
   36   HG23  ILE   6          3HG2      ILE   6  13.933   6.163  -6.561
   37   HD11  ILE   6          3HD1      ILE   6  11.497   5.255  -3.322
   38   HD12  ILE   6          1HD1      ILE   6  11.112   6.973  -3.112
   39   HD13  ILE   6          2HD1      ILE   6   9.978   5.945  -3.970
   40    H    ASP   7           H        ASP   7  10.970   5.146  -9.319
   41    HA   ASP   7           HA       ASP   7  11.280   2.325 -10.148
   42    HB2  ASP   7           HB2      ASP   7   9.876   3.882 -11.462
   43    HB3  ASP   7           HB3      ASP   7  11.270   4.925 -11.743
   44    H    TYR   8           H        TYR   8  13.183   1.343 -10.462
   45    HA   TYR   8           HA       TYR   8  15.688   2.939 -10.241
   46    HB2  TYR   8           HB2      TYR   8  15.279   0.030  -9.497
   47    HB3  TYR   8           HB3      TYR   8  16.677   1.032  -9.232
   48    HD1  TYR   8           HD1      TYR   8  16.227   3.320  -7.878
   49    HD2  TYR   8           HD2      TYR   8  13.850  -0.269  -7.632
   50    HE1  TYR   8           HE1      TYR   8  15.457   3.983  -5.614
   51    HE2  TYR   8           HE2      TYR   8  13.061   0.404  -5.371
   52    HH   TYR   8           HH       TYR   8  13.225   1.938  -3.681
   53    H    SER   9           H        SER   9  14.278   2.180 -12.903
   54    HA   SER   9           HA       SER   9  16.078   0.396 -14.280
   55    HB2  SER   9           HB2      SER   9  14.375   2.680 -15.325
   56    HB3  SER   9           HB3      SER   9  15.227   1.497 -16.330
   57    HG   SER   9           HG       SER   9  12.995   0.942 -15.924
   58    H    ASP  10           H        ASP  10  16.636   3.565 -13.099
   59    HA   ASP  10           HA       ASP  10  18.860   4.307 -14.823
   60    HB2  ASP  10           HB2      ASP  10  17.332   5.876 -13.585
   61    HB3  ASP  10           HB3      ASP  10  17.984   5.264 -12.063
   62    H    ALA  11           H        ALA  11  18.642   1.886 -12.434
   63    HA   ALA  11           HA       ALA  11  20.955   2.275 -10.899
   64    HB1  ALA  11           HB1      ALA  11  20.744  -0.180 -10.407
   65    HB2  ALA  11           HB2      ALA  11  19.215   0.700 -10.262
   66    HB3  ALA  11           HB3      ALA  11  19.529  -0.290 -11.701
   67    HA   PRO  12           HA       PRO  12  24.338   1.204 -13.625
   68    HB2  PRO  12           HB2      PRO  12  26.337   0.686 -11.866
   69    HB3  PRO  12           HB3      PRO  12  25.649   2.330 -12.049
   70    HG2  PRO  12           HG2      PRO  12  24.922   0.231  -9.985
   71    HG3  PRO  12           HG3      PRO  12  25.352   1.947  -9.691
   72    HD2  PRO  12           HD2      PRO  12  22.757   1.122  -9.863
   73    HD3  PRO  12           HD3      PRO  12  23.271   2.693 -10.520
   74    H    ASP  13           H        ASP  13  25.539  -0.622 -14.377
   75    HA   ASP  13           HA       ASP  13  24.165  -3.066 -14.295
   76    HB2  ASP  13           HB2      ASP  13  27.002  -2.457 -15.181
   77    HB3  ASP  13           HB3      ASP  13  26.137  -3.945 -15.548
   78    H    GLU  14           H        GLU  14  26.764  -2.000 -12.209
   79    HA   GLU  14           HA       GLU  14  27.555  -4.604 -11.241
   80    HB2  GLU  14           HB2      GLU  14  28.846  -3.400  -9.602
   81    HB3  GLU  14           HB3      GLU  14  29.017  -2.633 -11.188
   82    HG2  GLU  14           HG2      GLU  14  27.304  -0.914 -10.468
   83    HG3  GLU  14           HG3      GLU  14  27.329  -1.627  -8.856
   84    H    PHE  15           H        PHE  15  24.797  -2.638 -10.505
   85    HA   PHE  15           HA       PHE  15  24.172  -4.181  -8.020
   86    HB2  PHE  15           HB2      PHE  15  22.907  -1.700  -9.269
   87    HB3  PHE  15           HB3      PHE  15  22.318  -2.504  -7.826
   88    HD1  PHE  15           HD2      PHE  15  25.621  -2.846  -7.028
   89    HD2  PHE  15           HD1      PHE  15  22.720   0.283  -7.709
   90    HE1  PHE  15           HE2      PHE  15  26.916  -1.333  -5.583
   91    HE2  PHE  15           HE1      PHE  15  24.045   1.803  -6.273
   92    HZ   PHE  15           HZ       PHE  15  26.129   1.009  -5.199
   93    H    ARG  16           H        ARG  16  23.834  -4.792 -11.220
   94    HA   ARG  16           HA       ARG  16  20.982  -5.674 -11.002
   95    HB2  ARG  16           HB2      ARG  16  22.533  -4.578 -13.370
   96    HB3  ARG  16           HB3      ARG  16  20.914  -5.285 -13.492
   97    HG2  ARG  16           HG2      ARG  16  19.949  -3.573 -12.072
   98    HG3  ARG  16           HG3      ARG  16  21.537  -2.944 -11.659
   99    HD2  ARG  16           HD2      ARG  16  20.850  -1.433 -13.175
  100    HD3  ARG  16           HD3      ARG  16  21.856  -2.459 -14.174
  101    HE   ARG  16           HE       ARG  16  19.464  -3.596 -14.645
  102   HH11  ARG  16          1HH1      ARG  16  20.264  -0.129 -14.564
  103   HH12  ARG  16          2HH1      ARG  16  18.879   0.299 -15.518
  104   HH21  ARG  16          1HH2      ARG  16  17.782  -2.996 -15.961
  105   HH22  ARG  16          2HH2      ARG  16  17.554  -1.319 -16.405
  106    H    ASP  17           H        ASP  17  20.304  -7.508 -12.033
  107    HA   ASP  17           HA       ASP  17  22.329  -9.619 -12.461
  108    HB2  ASP  17           HB2      ASP  17  20.261 -11.069 -12.845
  109    HB3  ASP  17           HB3      ASP  17  20.624 -10.476 -11.231
  110    HA   PRO  18           HA       PRO  18  22.188  -9.124 -16.875
  111    HB2  PRO  18           HB2      PRO  18  23.461 -11.388 -17.719
  112    HB3  PRO  18           HB3      PRO  18  24.286 -10.102 -16.778
  113    HG2  PRO  18           HG2      PRO  18  23.102 -12.689 -15.746
  114    HG3  PRO  18           HG3      PRO  18  24.722 -12.009 -15.434
  115    HD2  PRO  18           HD2      PRO  18  22.603 -11.681 -13.711
  116    HD3  PRO  18           HD3      PRO  18  23.856 -10.427 -13.926
  117    H    LEU  19           H        LEU  19  20.747 -12.083 -15.469
  118    HA   LEU  19           HA       LEU  19  19.544 -12.976 -17.946
  119    HB2  LEU  19           HB2      LEU  19  20.211 -14.194 -15.618
  120    HB3  LEU  19           HB3      LEU  19  18.538 -13.876 -15.241
  121    HG   LEU  19           HG       LEU  19  19.538 -15.427 -17.677
  122   HD11  LEU  19          1HD1      LEU  19  18.759 -17.417 -16.447
  123   HD12  LEU  19          2HD1      LEU  19  18.321 -16.410 -15.050
  124   HD13  LEU  19          3HD1      LEU  19  20.023 -16.570 -15.550
  125   HD21  LEU  19          3HD2      LEU  19  17.343 -14.512 -18.184
  126   HD22  LEU  19          1HD2      LEU  19  16.708 -15.032 -16.604
  127   HD23  LEU  19          2HD2      LEU  19  17.169 -16.228 -17.847
  128    H    MET  20           H        MET  20  18.295 -11.343 -15.036
  129    HA   MET  20           HA       MET  20  15.626 -10.945 -16.296
  130    HB2  MET  20           HB2      MET  20  16.679 -10.959 -13.460
  131    HB3  MET  20           HB3      MET  20  15.084 -10.316 -13.845
  132    HG2  MET  20           HG2      MET  20  14.441 -12.492 -14.834
  133    HG3  MET  20           HG3      MET  20  16.065 -13.123 -14.544
  134    HE1  MET  20           HE1      MET  20  14.094 -15.262 -12.051
  135    HE2  MET  20           HE2      MET  20  13.622 -14.759 -13.688
  136    HE3  MET  20           HE3      MET  20  15.305 -15.218 -13.352
  137    H    ASP  21           H        ASP  21  18.447  -9.176 -15.958
  138    HA   ASP  21           HA       ASP  21  19.056  -7.145 -16.631
  139    HB2  ASP  21           HB2      ASP  21  17.398  -7.750 -18.456
  140    HB3  ASP  21           HB3      ASP  21  16.223  -6.727 -17.634
  141    H    THR  22           H        THR  22  17.583  -7.448 -13.895
  142    HA   THR  22           HA       THR  22  16.876  -4.567 -13.434
  143    HB   THR  22           HB       THR  22  14.944  -6.140 -13.689
  144    HG1  THR  22           HG1      THR  22  13.912  -5.200 -11.932
  145   HG21  THR  22          1HG2      THR  22  15.865  -8.134 -12.540
  146   HG22  THR  22          2HG2      THR  22  14.342  -7.604 -11.819
  147   HG23  THR  22          3HG2      THR  22  15.875  -7.251 -11.003
  148    H    LEU  23           H        LEU  23  16.684  -4.125 -11.020
  149    HA   LEU  23           HA       LEU  23  19.329  -4.388  -9.886
  150    HB2  LEU  23           HB2      LEU  23  17.527  -2.447  -9.781
  151    HB3  LEU  23           HB3      LEU  23  16.906  -3.334  -8.399
  152    HG   LEU  23           HG       LEU  23  19.693  -2.137  -8.771
  153   HD11  LEU  23          1HD1      LEU  23  18.999  -0.606  -6.957
  154   HD12  LEU  23          2HD1      LEU  23  17.400  -1.357  -6.940
  155   HD13  LEU  23          3HD1      LEU  23  17.972  -0.491  -8.382
  156   HD21  LEU  23          3HD2      LEU  23  18.570  -3.493  -6.275
  157   HD22  LEU  23          1HD2      LEU  23  20.138  -2.669  -6.412
  158   HD23  LEU  23          2HD2      LEU  23  19.855  -4.159  -7.292
  159    H    MET  24           H        MET  24  20.054  -6.103  -8.779
  160    HA   MET  24           HA       MET  24  18.268  -8.315  -8.375
  161    HB2  MET  24           HB2      MET  24  20.276  -9.551  -7.684
  162    HB3  MET  24           HB3      MET  24  20.457  -8.690  -9.218
  163    HG2  MET  24           HG2      MET  24  21.755  -6.923  -8.041
  164    HG3  MET  24           HG3      MET  24  21.609  -7.833  -6.530
  165    HE1  MET  24           HE1      MET  24  24.200  -6.827  -8.831
  166    HE2  MET  24           HE2      MET  24  24.232  -6.944  -7.056
  167    HE3  MET  24           HE3      MET  24  25.361  -7.903  -8.035
  168    H    THR  25           H        THR  25  19.582  -6.070  -6.086
  169    HA   THR  25           HA       THR  25  19.553  -5.722  -3.883
  170    HB   THR  25           HB       THR  25  17.528  -6.035  -2.615
  171    HG1  THR  25           HG1      THR  25  15.753  -7.066  -3.509
  172   HG21  THR  25          1HG2      THR  25  16.902  -5.169  -5.470
  173   HG22  THR  25          2HG2      THR  25  17.651  -4.155  -4.205
  174   HG23  THR  25          3HG2      THR  25  16.002  -4.732  -4.005
  175    H    ASP  26           H        ASP  26  19.307  -9.103  -4.587
  176    HA   ASP  26           HA       ASP  26  20.787  -9.688  -2.039
  177    HB2  ASP  26           HB2      ASP  26  18.786 -11.393  -3.557
  178    HB3  ASP  26           HB3      ASP  26  19.879 -12.010  -2.320
  179    HA   PRO  27           HA       PRO  27  23.690 -10.635  -5.551
  180    HB2  PRO  27           HB2      PRO  27  25.895  -9.395  -4.485
  181    HB3  PRO  27           HB3      PRO  27  24.678  -8.557  -5.476
  182    HG2  PRO  27           HG2      PRO  27  24.870  -8.639  -2.457
  183    HG3  PRO  27           HG3      PRO  27  24.607  -7.213  -3.523
  184    HD2  PRO  27           HD2      PRO  27  22.576  -8.491  -2.258
  185    HD3  PRO  27           HD3      PRO  27  22.375  -7.805  -3.900
  186    H    VAL  28           H        VAL  28  24.780 -12.521  -5.501
  187    HA   VAL  28           HA       VAL  28  25.916 -13.577  -2.940
  188    HB   VAL  28           HB       VAL  28  24.297 -15.121  -5.026
  189   HG11  VAL  28          1HG1      VAL  28  24.556 -17.068  -3.522
  190   HG12  VAL  28          2HG1      VAL  28  26.108 -16.560  -4.180
  191   HG13  VAL  28          3HG1      VAL  28  25.686 -16.139  -2.510
  192   HG21  VAL  28          3HG2      VAL  28  23.719 -14.492  -2.095
  193   HG22  VAL  28          1HG2      VAL  28  22.855 -13.840  -3.493
  194   HG23  VAL  28          2HG2      VAL  28  22.749 -15.563  -3.130
  195    H    ARG  29           H        ARG  29  27.876 -14.335  -3.072
  196    HA   ARG  29           HA       ARG  29  29.413 -13.966  -5.523
  197    HB2  ARG  29           HB2      ARG  29  29.972 -13.203  -3.121
  198    HB3  ARG  29           HB3      ARG  29  30.382 -14.884  -2.795
  199    HG2  ARG  29           HG2      ARG  29  32.093 -14.766  -4.619
  200    HG3  ARG  29           HG3      ARG  29  31.644 -13.086  -4.909
  201    HD2  ARG  29           HD2      ARG  29  33.641 -13.108  -3.546
  202    HD3  ARG  29           HD3      ARG  29  32.289 -12.513  -2.577
  203    HE   ARG  29           HE       ARG  29  32.575 -14.266  -1.126
  204   HH11  ARG  29          1HH1      ARG  29  34.126 -15.382  -4.134
  205   HH12  ARG  29          2HH1      ARG  29  34.877 -16.714  -3.310
  206   HH21  ARG  29          1HH2      ARG  29  33.438 -15.953  -0.222
  207   HH22  ARG  29          2HH2      ARG  29  34.461 -17.086  -1.098
  208    H    LEU  30           H        LEU  30  30.424 -15.467  -6.676
  209    HA   LEU  30           HA       LEU  30  30.100 -18.384  -6.150
  210    HB2  LEU  30           HB2      LEU  30  31.030 -16.777  -8.597
  211    HB3  LEU  30           HB3      LEU  30  30.986 -18.507  -8.526
  212    HG   LEU  30           HG       LEU  30  29.119 -18.005  -9.738
  213   HD11  LEU  30          1HD1      LEU  30  27.888 -18.179  -6.960
  214   HD12  LEU  30          2HD1      LEU  30  28.591 -19.555  -7.826
  215   HD13  LEU  30          3HD1      LEU  30  27.186 -18.715  -8.505
  216   HD21  LEU  30          3HD2      LEU  30  28.217 -15.820  -7.819
  217   HD22  LEU  30          1HD2      LEU  30  27.406 -16.363  -9.294
  218   HD23  LEU  30          2HD2      LEU  30  28.995 -15.587  -9.402
  219    HA   PRO  31           HA       PRO  31  34.182 -18.837  -4.688
  220    HB2  PRO  31           HB2      PRO  31  35.158 -21.147  -5.818
  221    HB3  PRO  31           HB3      PRO  31  33.877 -21.089  -4.570
  222    HG2  PRO  31           HG2      PRO  31  33.532 -21.257  -7.587
  223    HG3  PRO  31           HG3      PRO  31  32.770 -22.292  -6.330
  224    HD2  PRO  31           HD2      PRO  31  31.454 -20.206  -7.399
  225    HD3  PRO  31           HD3      PRO  31  31.321 -20.507  -5.652
  226    H    SER  32           H        SER  32  33.952 -18.814  -8.260
  227    HA   SER  32           HA       SER  32  36.747 -18.158  -8.700
  228    HB2  SER  32           HB2      SER  32  34.306 -17.828 -10.496
  229    HB3  SER  32           HB3      SER  32  36.006 -17.772 -11.011
  230    HG   SER  32           HG       SER  32  36.231 -19.961 -10.368
  231    H    GLY  33           H        GLY  33  34.439 -16.274  -7.216
  232    HA2  GLY  33           HA2      GLY  33  34.814 -14.084  -6.459
  233    HA3  GLY  33           HA3      GLY  33  35.920 -13.774  -7.819
  234    H    THR  34           H        THR  34  33.425 -15.065  -9.374
  235    HA   THR  34           HA       THR  34  32.167 -12.673 -10.330
  236    HB   THR  34           HB       THR  34  31.234 -15.579 -10.523
  237    HG1  THR  34           HG1      THR  34  32.422 -15.515 -12.467
  238   HG21  THR  34          1HG2      THR  34  29.469 -14.020 -11.288
  239   HG22  THR  34          2HG2      THR  34  30.224 -14.818 -12.676
  240   HG23  THR  34          3HG2      THR  34  30.654 -13.140 -12.275
  241    H    VAL  35           H        VAL  35  30.051 -11.904  -9.969
  242    HA   VAL  35           HA       VAL  35  28.595 -12.937  -7.567
  243    HB   VAL  35           HB       VAL  35  28.793 -10.039  -8.468
  244   HG11  VAL  35          1HG1      VAL  35  26.532 -10.466  -7.583
  245   HG12  VAL  35          2HG1      VAL  35  27.220 -11.261  -6.154
  246   HG13  VAL  35          3HG1      VAL  35  27.472  -9.526  -6.423
  247   HG21  VAL  35          3HG2      VAL  35  29.849  -9.688  -6.247
  248   HG22  VAL  35          1HG2      VAL  35  29.811 -11.438  -5.947
  249   HG23  VAL  35          2HG2      VAL  35  30.809 -10.769  -7.251
  250    H    MET  36           H        MET  36  26.518 -13.343  -7.762
  251    HA   MET  36           HA       MET  36  24.980 -12.599 -10.199
  252    HB2  MET  36           HB2      MET  36  25.935 -14.927 -10.397
  253    HB3  MET  36           HB3      MET  36  25.072 -15.364  -8.928
  254    HG2  MET  36           HG2      MET  36  23.982 -16.147 -11.004
  255    HG3  MET  36           HG3      MET  36  22.948 -15.157 -10.009
  256    HE1  MET  36           HE1      MET  36  25.799 -13.773 -12.469
  257    HE2  MET  36           HE2      MET  36  25.229 -15.337 -13.087
  258    HE3  MET  36           HE3      MET  36  24.898 -13.851 -13.990
  259    H    ASP  37           H        ASP  37  22.644 -12.974  -9.847
  260    HA   ASP  37           HA       ASP  37  21.626 -12.006  -7.266
  261    HB2  ASP  37           HB2      ASP  37  20.443 -11.275  -9.160
  262    HB3  ASP  37           HB3      ASP  37  20.425 -12.875  -9.889
  263    H    ARG  38           H        ARG  38  20.823 -13.185  -5.644
  264    HA   ARG  38           HA       ARG  38  21.343 -15.831  -5.080
  265    HB2  ARG  38           HB2      ARG  38  20.578 -14.129  -3.441
  266    HB3  ARG  38           HB3      ARG  38  18.965 -14.149  -4.144
  267    HG2  ARG  38           HG2      ARG  38  18.709 -16.533  -3.511
  268    HG3  ARG  38           HG3      ARG  38  20.356 -16.533  -2.831
  269    HD2  ARG  38           HD2      ARG  38  19.604 -14.757  -1.247
  270    HD3  ARG  38           HD3      ARG  38  17.963 -14.894  -1.938
  271    HE   ARG  38           HE       ARG  38  18.785 -17.480  -1.142
  272   HH11  ARG  38          1HH1      ARG  38  17.991 -14.432   0.476
  273   HH12  ARG  38          2HH1      ARG  38  17.508 -15.229   1.945
  274   HH21  ARG  38          1HH2      ARG  38  18.148 -18.444   0.787
  275   HH22  ARG  38          2HH2      ARG  38  17.583 -17.469   2.114
  276    H    SER  39           H        SER  39  18.201 -14.633  -6.417
  277    HA   SER  39           HA       SER  39  17.000 -17.231  -6.332
  278    HB2  SER  39           HB2      SER  39  16.165 -14.807  -7.962
  279    HB3  SER  39           HB3      SER  39  15.179 -16.236  -7.644
  280    HG   SER  39           HG       SER  39  14.714 -14.527  -6.157
  281    H    ILE  40           H        ILE  40  18.592 -15.425  -8.997
  282    HA   ILE  40           HA       ILE  40  18.131 -17.408 -11.035
  283    HB   ILE  40           HB       ILE  40  20.151 -15.163 -10.735
  284   HG12  ILE  40          2HG1      ILE  40  17.868 -15.497 -12.729
  285   HG13  ILE  40          3HG1      ILE  40  17.583 -14.805 -11.145
  286   HG21  ILE  40          1HG2      ILE  40  21.273 -16.811 -12.157
  287   HG22  ILE  40          2HG2      ILE  40  19.789 -17.060 -13.103
  288   HG23  ILE  40          3HG2      ILE  40  20.667 -15.523 -13.189
  289   HD11  ILE  40          3HD1      ILE  40  19.006 -12.924 -11.572
  290   HD12  ILE  40          1HD1      ILE  40  19.582 -13.608 -13.100
  291   HD13  ILE  40          2HD1      ILE  40  17.895 -13.103 -12.921
  292    H    ILE  41           H        ILE  41  20.967 -17.075  -8.800
  293    HA   ILE  41           HA       ILE  41  22.259 -19.371  -9.991
  294    HB   ILE  41           HB       ILE  41  23.571 -17.750  -8.773
  295   HG12  ILE  41          2HG1      ILE  41  24.996 -19.229  -7.456
  296   HG13  ILE  41          3HG1      ILE  41  23.758 -20.477  -7.415
  297   HG21  ILE  41          1HG2      ILE  41  22.351 -18.811  -6.180
  298   HG22  ILE  41          2HG2      ILE  41  23.674 -17.637  -6.336
  299   HG23  ILE  41          3HG2      ILE  41  22.063 -17.210  -6.882
  300   HD11  ILE  41          3HD1      ILE  41  25.125 -19.441  -9.930
  301   HD12  ILE  41          1HD1      ILE  41  25.567 -20.928  -9.060
  302   HD13  ILE  41          2HD1      ILE  41  23.985 -20.820  -9.843
  303    H    LEU  42           H        LEU  42  20.148 -19.175  -7.053
  304    HA   LEU  42           HA       LEU  42  20.349 -22.005  -6.617
  305    HB2  LEU  42           HB2      LEU  42  18.851 -21.778  -4.861
  306    HB3  LEU  42           HB3      LEU  42  19.808 -20.313  -4.908
  307    HG   LEU  42           HG       LEU  42  17.779 -19.266  -6.159
  308   HD11  LEU  42          1HD1      LEU  42  16.387 -21.606  -4.768
  309   HD12  LEU  42          2HD1      LEU  42  16.394 -21.297  -6.519
  310   HD13  LEU  42          3HD1      LEU  42  15.575 -20.172  -5.450
  311   HD21  LEU  42          3HD2      LEU  42  16.812 -18.600  -3.999
  312   HD22  LEU  42          1HD2      LEU  42  18.567 -18.710  -3.837
  313   HD23  LEU  42          2HD2      LEU  42  17.551 -20.011  -3.206
  314    H    ARG  43           H        ARG  43  18.088 -20.155  -8.640
  315    HA   ARG  43           HA       ARG  43  16.399 -22.396  -9.234
  316    HB2  ARG  43           HB2      ARG  43  15.663 -20.101  -9.573
  317    HB3  ARG  43           HB3      ARG  43  16.931 -19.833 -10.777
  318    HG2  ARG  43           HG2      ARG  43  14.734 -20.164 -11.814
  319    HG3  ARG  43           HG3      ARG  43  15.877 -21.398 -12.318
  320    HD2  ARG  43           HD2      ARG  43  14.828 -22.954 -10.572
  321    HD3  ARG  43           HD3      ARG  43  13.649 -21.685 -10.254
  322    HE   ARG  43           HE       ARG  43  12.555 -22.191 -12.223
  323   HH11  ARG  43          1HH1      ARG  43  15.699 -23.850 -12.330
  324   HH12  ARG  43          2HH1      ARG  43  15.217 -24.813 -13.699
  325   HH21  ARG  43          1HH2      ARG  43  12.027 -23.491 -13.955
  326   HH22  ARG  43          2HH2      ARG  43  13.190 -24.623 -14.607
  327    H    HIS  44           H        HIS  44  19.474 -21.264 -10.717
  328    HA   HIS  44           HA       HIS  44  19.343 -23.277 -12.830
  329    HB2  HIS  44           HB2      HIS  44  20.702 -21.091 -12.817
  330    HB3  HIS  44           HB3      HIS  44  21.850 -21.928 -11.776
  331    HD1  HIS  44           HD1      HIS  44  23.450 -23.722 -13.041
  332    HD2  HIS  44           HD2      HIS  44  20.332 -22.076 -15.354
  333    HE1  HIS  44           HE1      HIS  44  23.873 -24.447 -15.429
  334    H    LEU  45           H        LEU  45  20.935 -23.169  -9.590
  335    HA   LEU  45           HA       LEU  45  22.132 -25.736  -9.679
  336    HB2  LEU  45           HB2      LEU  45  21.090 -24.034  -7.398
  337    HB3  LEU  45           HB3      LEU  45  21.912 -25.568  -7.130
  338    HG   LEU  45           HG       LEU  45  23.167 -23.216  -8.634
  339   HD11  LEU  45          1HD1      LEU  45  22.737 -22.703  -6.241
  340   HD12  LEU  45          2HD1      LEU  45  24.472 -22.851  -6.581
  341   HD13  LEU  45          3HD1      LEU  45  23.612 -24.173  -5.762
  342   HD21  LEU  45          3HD2      LEU  45  24.214 -25.309  -9.301
  343   HD22  LEU  45          1HD2      LEU  45  24.343 -25.843  -7.605
  344   HD23  LEU  45          2HD2      LEU  45  25.289 -24.467  -8.195
  345    H    LEU  46           H        LEU  46  18.798 -24.878  -8.818
  346    HA   LEU  46           HA       LEU  46  17.882 -27.437  -8.043
  347    HB2  LEU  46           HB2      LEU  46  16.673 -25.263  -7.809
  348    HB3  LEU  46           HB3      LEU  46  16.472 -25.192  -9.555
  349    HG   LEU  46           HG       LEU  46  15.028 -27.222  -9.477
  350   HD11  LEU  46          1HD1      LEU  46  15.892 -28.325  -7.438
  351   HD12  LEU  46          2HD1      LEU  46  14.170 -27.994  -7.268
  352   HD13  LEU  46          3HD1      LEU  46  15.355 -26.954  -6.445
  353   HD21  LEU  46          3HD2      LEU  46  14.033 -24.976  -9.389
  354   HD22  LEU  46          1HD2      LEU  46  14.175 -24.961  -7.623
  355   HD23  LEU  46          2HD2      LEU  46  13.098 -26.121  -8.425
  356    H    ASN  47           H        ASN  47  18.506 -26.182 -11.297
  357    HA   ASN  47           HA       ASN  47  17.264 -28.513 -12.616
  358    HB2  ASN  47           HB2      ASN  47  16.975 -26.245 -13.539
  359    HB3  ASN  47           HB3      ASN  47  18.719 -26.082 -13.735
  360   HD21  ASN  47          1HD2      ASN  47  19.297 -26.363 -15.876
  361   HD22  ASN  47          2HD2      ASN  47  18.536 -27.514 -16.957
  362    H    SER  48           H        SER  48  20.587 -27.118 -12.277
  363    HA   SER  48           HA       SER  48  21.803 -29.787 -12.655
  364    HB2  SER  48           HB2      SER  48  22.337 -27.414 -14.483
  365    HB3  SER  48           HB3      SER  48  23.432 -28.790 -14.331
  366    HG   SER  48           HG       SER  48  20.718 -28.893 -15.225
  367    HA   PRO  49           HA       PRO  49  24.549 -27.924  -9.665
  368    HB2  PRO  49           HB2      PRO  49  26.474 -29.802  -9.393
  369    HB3  PRO  49           HB3      PRO  49  24.766 -30.159  -9.009
  370    HG2  PRO  49           HG2      PRO  49  26.206 -30.743 -11.626
  371    HG3  PRO  49           HG3      PRO  49  25.267 -31.878 -10.605
  372    HD2  PRO  49           HD2      PRO  49  24.144 -30.583 -12.735
  373    HD3  PRO  49           HD3      PRO  49  23.215 -30.917 -11.239
  374    H    THR  50           H        THR  50  24.741 -26.371 -11.696
  375    HA   THR  50           HA       THR  50  27.590 -25.836 -12.244
  376    HB   THR  50           HB       THR  50  26.926 -25.393 -14.680
  377    HG1  THR  50           HG1      THR  50  25.171 -26.686 -15.399
  378   HG21  THR  50          1HG2      THR  50  26.871 -28.317 -13.857
  379   HG22  THR  50          2HG2      THR  50  28.334 -27.323 -14.059
  380   HG23  THR  50          3HG2      THR  50  27.292 -27.647 -15.446
  381    H    ASP  51           H        ASP  51  27.992 -23.786 -13.090
  382    HA   ASP  51           HA       ASP  51  26.460 -21.608 -12.024
  383    HB2  ASP  51           HB2      ASP  51  28.899 -21.615 -12.278
  384    HB3  ASP  51           HB3      ASP  51  28.732 -21.704 -14.037
  385    HA   PRO  52           HA       PRO  52  23.495 -21.104 -15.260
  386    HB2  PRO  52           HB2      PRO  52  22.779 -18.416 -15.013
  387    HB3  PRO  52           HB3      PRO  52  22.254 -19.729 -13.927
  388    HG2  PRO  52           HG2      PRO  52  24.578 -17.829 -13.551
  389    HG3  PRO  52           HG3      PRO  52  23.318 -18.293 -12.360
  390    HD2  PRO  52           HD2      PRO  52  25.729 -19.455 -12.327
  391    HD3  PRO  52           HD3      PRO  52  24.259 -20.454 -12.101
  392    H    PHE  53           H        PHE  53  26.397 -19.165 -15.557
  393    HA   PHE  53           HA       PHE  53  25.762 -18.739 -18.480
  394    HB2  PHE  53           HB2      PHE  53  27.114 -16.884 -16.491
  395    HB3  PHE  53           HB3      PHE  53  27.158 -16.654 -18.231
  396    HD1  PHE  53           HD2      PHE  53  25.103 -16.143 -19.528
  397    HD2  PHE  53           HD1      PHE  53  25.072 -16.382 -15.218
  398    HE1  PHE  53           HE2      PHE  53  22.906 -14.982 -19.468
  399    HE2  PHE  53           HE1      PHE  53  22.865 -15.258 -15.161
  400    HZ   PHE  53           HZ       PHE  53  21.787 -14.544 -17.296
  401    H    ASN  54           H        ASN  54  28.275 -19.522 -16.094
  402    HA   ASN  54           HA       ASN  54  30.354 -19.751 -18.192
  403    HB2  ASN  54           HB2      ASN  54  30.410 -20.209 -15.181
  404    HB3  ASN  54           HB3      ASN  54  31.804 -20.282 -16.249
  405   HD21  ASN  54          1HD2      ASN  54  29.397 -18.094 -14.764
  406   HD22  ASN  54          2HD2      ASN  54  30.305 -16.628 -15.114
  407    H    ARG  55           H        ARG  55  28.213 -21.796 -16.328
  408    HA   ARG  55           HA       ARG  55  27.776 -23.948 -16.184
  409    HB2  ARG  55           HB2      ARG  55  28.591 -23.693 -19.059
  410    HB3  ARG  55           HB3      ARG  55  28.349 -25.309 -18.423
  411    HG2  ARG  55           HG2      ARG  55  26.270 -24.643 -19.343
  412    HG3  ARG  55           HG3      ARG  55  26.097 -24.678 -17.590
  413    HD2  ARG  55           HD2      ARG  55  26.453 -22.123 -17.639
  414    HD3  ARG  55           HD3      ARG  55  26.302 -22.224 -19.389
  415    HE   ARG  55           HE       ARG  55  24.233 -22.701 -17.306
  416   HH11  ARG  55          1HH1      ARG  55  24.846 -22.648 -20.804
  417   HH12  ARG  55          2HH1      ARG  55  23.150 -22.675 -21.172
  418   HH21  ARG  55          1HH2      ARG  55  22.135 -22.850 -17.837
  419   HH22  ARG  55          2HH2      ARG  55  21.611 -22.805 -19.505
  420    H    GLN  56           H        GLN  56  30.603 -23.065 -15.462
  421    HA   GLN  56           HA       GLN  56  32.079 -25.542 -15.084
  422    HB2  GLN  56           HB2      GLN  56  33.238 -24.285 -13.343
  423    HB3  GLN  56           HB3      GLN  56  33.109 -23.301 -14.805
  424    HG2  GLN  56           HG2      GLN  56  31.124 -22.108 -13.728
  425    HG3  GLN  56           HG3      GLN  56  31.415 -23.043 -12.260
  426   HE21  GLN  56          1HE2      GLN  56  33.225 -22.458 -10.900
  427   HE22  GLN  56          2HE2      GLN  56  34.105 -20.962 -11.196
  428    H    MET  57           H        MET  57  32.061 -26.863 -13.151
  429    HA   MET  57           HA       MET  57  29.454 -27.366 -12.081
  430    HB2  MET  57           HB2      MET  57  32.212 -28.417 -11.382
  431    HB3  MET  57           HB3      MET  57  30.765 -28.877 -10.475
  432    HG2  MET  57           HG2      MET  57  31.108 -30.566 -12.094
  433    HG3  MET  57           HG3      MET  57  29.686 -29.652 -12.580
  434    HE1  MET  57           HE1      MET  57  29.606 -30.669 -14.939
  435    HE2  MET  57           HE2      MET  57  31.014 -30.809 -16.020
  436    HE3  MET  57           HE3      MET  57  30.970 -31.719 -14.487
  437    H    LEU  58           H        LEU  58  28.537 -26.989 -10.142
  438    HA   LEU  58           HA       LEU  58  29.744 -25.063  -8.245
  439    HB2  LEU  58           HB2      LEU  58  28.573 -24.078 -10.465
  440    HB3  LEU  58           HB3      LEU  58  27.108 -24.367  -9.564
  441    HG   LEU  58           HG       LEU  58  27.725 -22.089  -9.354
  442   HD11  LEU  58          1HD1      LEU  58  28.606 -23.273  -6.701
  443   HD12  LEU  58          2HD1      LEU  58  26.906 -23.130  -7.219
  444   HD13  LEU  58          3HD1      LEU  58  27.909 -21.683  -7.006
  445   HD21  LEU  58          3HD2      LEU  58  30.459 -22.922  -8.316
  446   HD22  LEU  58          1HD2      LEU  58  29.853 -21.268  -8.502
  447   HD23  LEU  58          2HD2      LEU  58  30.119 -22.276  -9.932
  448    H    THR  59           H        THR  59  28.863 -25.218  -6.227
  449    HA   THR  59           HA       THR  59  26.511 -26.991  -5.728
  450    HB   THR  59           HB       THR  59  29.121 -26.965  -4.148
  451    HG1  THR  59           HG1      THR  59  29.464 -28.984  -5.107
  452   HG21  THR  59          1HG2      THR  59  28.220 -29.082  -3.164
  453   HG22  THR  59          2HG2      THR  59  26.676 -28.787  -3.985
  454   HG23  THR  59          3HG2      THR  59  27.268 -27.678  -2.713
  455    H    GLU  60           H        GLU  60  25.317 -26.462  -3.851
  456    HA   GLU  60           HA       GLU  60  24.940 -23.738  -3.282
  457    HB2  GLU  60           HB2      GLU  60  24.248 -26.187  -1.611
  458    HB3  GLU  60           HB3      GLU  60  23.614 -24.566  -1.308
  459    HG2  GLU  60           HG2      GLU  60  22.516 -24.528  -3.505
  460    HG3  GLU  60           HG3      GLU  60  23.161 -26.131  -3.886
  461    H    SER  61           H        SER  61  27.068 -26.035  -1.583
  462    HA   SER  61           HA       SER  61  27.712 -24.459   0.692
  463    HB2  SER  61           HB2      SER  61  29.470 -26.474  -0.758
  464    HB3  SER  61           HB3      SER  61  29.580 -25.988   0.945
  465    HG   SER  61           HG       SER  61  28.469 -27.991   0.717
  466    H    MET  62           H        MET  62  28.683 -23.956  -2.610
  467    HA   MET  62           HA       MET  62  31.191 -22.518  -1.940
  468    HB2  MET  62           HB2      MET  62  29.784 -22.902  -4.607
  469    HB3  MET  62           HB3      MET  62  31.410 -22.280  -4.348
  470    HG2  MET  62           HG2      MET  62  30.522 -25.100  -3.674
  471    HG3  MET  62           HG3      MET  62  31.406 -24.622  -5.120
  472    HE1  MET  62           HE1      MET  62  34.062 -26.671  -3.144
  473    HE2  MET  62           HE2      MET  62  32.320 -26.964  -3.268
  474    HE3  MET  62           HE3      MET  62  33.238 -26.440  -4.699
  475    H    LEU  63           H        LEU  63  27.910 -21.700  -1.999
  476    HA   LEU  63           HA       LEU  63  28.176 -19.010  -3.144
  477    HB2  LEU  63           HB2      LEU  63  25.853 -20.333  -1.691
  478    HB3  LEU  63           HB3      LEU  63  25.785 -18.839  -2.595
  479    HG   LEU  63           HG       LEU  63  26.244 -21.635  -3.715
  480   HD11  LEU  63          1HD1      LEU  63  23.999 -19.596  -4.107
  481   HD12  LEU  63          2HD1      LEU  63  23.906 -21.062  -3.099
  482   HD13  LEU  63          3HD1      LEU  63  24.085 -21.190  -4.852
  483   HD21  LEU  63          3HD2      LEU  63  26.289 -18.972  -5.206
  484   HD22  LEU  63          1HD2      LEU  63  26.175 -20.579  -5.968
  485   HD23  LEU  63          2HD2      LEU  63  27.622 -20.149  -5.068
  486    H    GLU  64           H        GLU  64  27.857 -17.064  -2.066
  487    HA   GLU  64           HA       GLU  64  27.699 -16.935   0.869
  488    HB2  GLU  64           HB2      GLU  64  30.064 -17.313   0.515
  489    HB3  GLU  64           HB3      GLU  64  30.155 -16.009  -0.665
  490    HG2  GLU  64           HG2      GLU  64  29.636 -14.354   1.109
  491    HG3  GLU  64           HG3      GLU  64  29.417 -15.658   2.282
  492    HA   PRO  65           HA       PRO  65  25.373 -13.410  -0.909
  493    HB2  PRO  65           HB2      PRO  65  24.913 -12.952   2.048
  494    HB3  PRO  65           HB3      PRO  65  23.752 -12.810   0.686
  495    HG2  PRO  65           HG2      PRO  65  23.731 -15.024   2.257
  496    HG3  PRO  65           HG3      PRO  65  23.608 -15.194   0.473
  497    HD2  PRO  65           HD2      PRO  65  26.054 -15.510   2.234
  498    HD3  PRO  65           HD3      PRO  65  25.477 -16.565   0.900
  499    H    VAL  66           H        VAL  66  25.997 -11.312  -1.287
  500    HA   VAL  66           HA       VAL  66  28.577 -10.481  -0.103
  501    HB   VAL  66           HB       VAL  66  27.115  -9.256  -2.463
  502   HG11  VAL  66          1HG1      VAL  66  28.710  -7.684  -1.416
  503   HG12  VAL  66          2HG1      VAL  66  29.965  -8.942  -1.424
  504   HG13  VAL  66          3HG1      VAL  66  29.358  -8.274  -2.950
  505   HG21  VAL  66          3HG2      VAL  66  27.769 -11.590  -2.961
  506   HG22  VAL  66          1HG2      VAL  66  28.758 -10.426  -3.849
  507   HG23  VAL  66          2HG2      VAL  66  29.420 -11.220  -2.405
  508    HA   PRO  67           HA       PRO  67  26.099  -7.460   2.287
  509    HB2  PRO  67           HB2      PRO  67  27.919  -6.802   4.193
  510    HB3  PRO  67           HB3      PRO  67  27.101  -8.402   4.177
  511    HG2  PRO  67           HG2      PRO  67  29.866  -7.720   3.120
  512    HG3  PRO  67           HG3      PRO  67  29.381  -9.080   4.187
  513    HD2  PRO  67           HD2      PRO  67  29.640  -9.369   1.464
  514    HD3  PRO  67           HD3      PRO  67  28.419 -10.262   2.415
  515    H    GLU  68           H        GLU  68  29.462  -6.780   1.141
  516    HA   GLU  68           HA       GLU  68  29.231  -3.971   1.466
  517    HB2  GLU  68           HB2      GLU  68  31.213  -3.783   0.094
  518    HB3  GLU  68           HB3      GLU  68  31.372  -5.061   1.283
  519    HG2  GLU  68           HG2      GLU  68  30.946  -6.757  -0.482
  520    HG3  GLU  68           HG3      GLU  68  30.769  -5.472  -1.683
  521    H    LEU  69           H        LEU  69  28.091  -5.983  -1.205
  522    HA   LEU  69           HA       LEU  69  27.399  -3.629  -2.874
  523    HB2  LEU  69           HB2      LEU  69  26.893  -6.625  -3.119
  524    HB3  LEU  69           HB3      LEU  69  26.215  -5.439  -4.231
  525    HG   LEU  69           HG       LEU  69  29.195  -5.900  -3.780
  526   HD11  LEU  69          1HD1      LEU  69  27.371  -6.689  -6.092
  527   HD12  LEU  69          2HD1      LEU  69  28.042  -7.796  -4.883
  528   HD13  LEU  69          3HD1      LEU  69  29.128  -6.962  -6.005
  529   HD21  LEU  69          3HD2      LEU  69  27.728  -4.148  -5.805
  530   HD22  LEU  69          1HD2      LEU  69  29.457  -4.517  -5.852
  531   HD23  LEU  69          2HD2      LEU  69  28.808  -3.579  -4.507
  532    H    LYS  70           H        LYS  70  25.675  -5.948  -0.723
  533    HA   LYS  70           HA       LYS  70  23.089  -4.897  -1.358
  534    HB2  LYS  70           HB2      LYS  70  23.539  -7.134  -0.430
  535    HB3  LYS  70           HB3      LYS  70  23.976  -6.416   1.130
  536    HG2  LYS  70           HG2      LYS  70  21.732  -5.540   1.426
  537    HG3  LYS  70           HG3      LYS  70  21.286  -5.948  -0.227
  538    HD2  LYS  70           HD2      LYS  70  21.510  -8.363   0.289
  539    HD3  LYS  70           HD3      LYS  70  21.956  -7.960   1.968
  540    HE2  LYS  70           HE2      LYS  70  19.780  -6.813   2.263
  541    HE3  LYS  70           HE3      LYS  70  19.363  -7.135   0.578
  542    HZ1  LYS  70           HZ1      LYS  70  19.871  -9.275   2.566
  543    HZ2  LYS  70           HZ2      LYS  70  19.319  -9.474   1.030
  544    HZ3  LYS  70           HZ3      LYS  70  18.377  -8.751   2.157
  545    H    GLU  71           H        GLU  71  25.363  -4.043   1.232
  546    HA   GLU  71           HA       GLU  71  23.705  -2.034   2.475
  547    HB2  GLU  71           HB2      GLU  71  26.711  -2.479   2.465
  548    HB3  GLU  71           HB3      GLU  71  25.910  -1.235   3.415
  549    HG2  GLU  71           HG2      GLU  71  25.276  -4.212   3.676
  550    HG3  GLU  71           HG3      GLU  71  26.428  -3.348   4.684
  551    H    GLN  72           H        GLN  72  25.926  -1.923  -0.302
  552    HA   GLN  72           HA       GLN  72  25.742   1.004  -0.586
  553    HB2  GLN  72           HB2      GLN  72  26.815  -1.214  -2.356
  554    HB3  GLN  72           HB3      GLN  72  26.643   0.456  -2.924
  555    HG2  GLN  72           HG2      GLN  72  28.049   1.269  -1.068
  556    HG3  GLN  72           HG3      GLN  72  28.254  -0.383  -0.481
  557   HE21  GLN  72          1HE2      GLN  72  29.407  -1.920  -1.902
  558   HE22  GLN  72          2HE2      GLN  72  30.580  -1.296  -3.079
  559    H    ILE  73           H        ILE  73  24.072  -1.783  -2.097
  560    HA   ILE  73           HA       ILE  73  22.418  -0.333  -3.873
  561    HB   ILE  73           HB       ILE  73  22.155  -3.006  -2.472
  562   HG12  ILE  73          2HG1      ILE  73  22.360  -2.277  -5.424
  563   HG13  ILE  73          3HG1      ILE  73  23.775  -2.540  -4.397
  564   HG21  ILE  73          1HG2      ILE  73  20.158  -3.499  -3.925
  565   HG22  ILE  73          2HG2      ILE  73  19.841  -2.361  -2.640
  566   HG23  ILE  73          3HG2      ILE  73  20.062  -1.765  -4.300
  567   HD11  ILE  73          3HD1      ILE  73  21.672  -4.624  -5.121
  568   HD12  ILE  73          1HD1      ILE  73  23.366  -4.568  -5.629
  569   HD13  ILE  73          2HD1      ILE  73  22.976  -4.878  -3.933
  570    H    GLN  74           H        GLN  74  21.643  -1.259  -0.473
  571    HA   GLN  74           HA       GLN  74  19.107   0.064  -0.537
  572    HB2  GLN  74           HB2      GLN  74  18.992  -0.349   1.839
  573    HB3  GLN  74           HB3      GLN  74  19.643  -1.741   0.999
  574    HG2  GLN  74           HG2      GLN  74  21.044  -1.666   2.836
  575    HG3  GLN  74           HG3      GLN  74  21.990  -0.805   1.647
  576   HE21  GLN  74          1HE2      GLN  74  23.111   0.789   2.726
  577   HE22  GLN  74          2HE2      GLN  74  22.405   1.828   3.965
  578    H    ALA  75           H        ALA  75  22.326   1.342   0.262
  579    HA   ALA  75           HA       ALA  75  21.376   3.911   1.199
  580    HB1  ALA  75           HB1      ALA  75  24.060   3.057   0.016
  581    HB2  ALA  75           HB2      ALA  75  23.734   4.585   0.843
  582    HB3  ALA  75           HB3      ALA  75  23.625   3.053   1.735
  583    H    TRP  76           H        TRP  76  22.424   2.700  -2.028
  584    HA   TRP  76           HA       TRP  76  22.045   5.177  -3.420
  585    HB2  TRP  76           HB2      TRP  76  23.382   3.294  -4.254
  586    HB3  TRP  76           HB3      TRP  76  21.947   2.301  -4.395
  587    HD1  TRP  76           HD1      TRP  76  23.715   5.241  -6.047
  588    HE1  TRP  76           HE1      TRP  76  22.751   5.641  -8.398
  589    HE3  TRP  76           HE3      TRP  76  19.767   1.986  -5.859
  590    HZ2  TRP  76           HZ2      TRP  76  20.499   4.732  -9.958
  591    HZ3  TRP  76           HZ3      TRP  76  18.227   1.784  -7.771
  592    HH2  TRP  76           HH2      TRP  76  18.552   3.163  -9.815
  593    H    MET  77           H        MET  77  19.799   2.416  -2.884
  594    HA   MET  77           HA       MET  77  17.520   3.473  -4.251
  595    HB2  MET  77           HB2      MET  77  17.765   1.623  -1.847
  596    HB3  MET  77           HB3      MET  77  16.226   2.033  -2.604
  597    HG2  MET  77           HG2      MET  77  16.889   1.041  -4.708
  598    HG3  MET  77           HG3      MET  77  18.547   0.848  -4.157
  599    HE1  MET  77           HE1      MET  77  14.978  -1.707  -2.639
  600    HE2  MET  77           HE2      MET  77  15.154   0.001  -2.190
  601    HE3  MET  77           HE3      MET  77  14.851  -0.450  -3.885
  602    H    ARG  78           H        ARG  78  18.621   4.056  -0.891
  603    HA   ARG  78           HA       ARG  78  16.442   5.775  -0.173
  604    HB2  ARG  78           HB2      ARG  78  17.927   4.694   1.473
  605    HB3  ARG  78           HB3      ARG  78  19.282   5.688   0.928
  606    HG2  ARG  78           HG2      ARG  78  18.075   7.736   1.634
  607    HG3  ARG  78           HG3      ARG  78  16.699   6.744   2.154
  608    HD2  ARG  78           HD2      ARG  78  18.158   5.601   3.786
  609    HD3  ARG  78           HD3      ARG  78  19.539   6.563   3.264
  610    HE   ARG  78           HE       ARG  78  17.312   7.380   4.978
  611   HH11  ARG  78          1HH1      ARG  78  19.955   8.651   3.000
  612   HH12  ARG  78          2HH1      ARG  78  19.941  10.190   3.813
  613   HH21  ARG  78          1HH2      ARG  78  17.327   9.381   5.959
  614   HH22  ARG  78          2HH2      ARG  78  18.474  10.590   5.467
  615    H    GLU  79           H        GLU  79  19.700   6.563  -1.518
  616    HA   GLU  79           HA       GLU  79  19.318   9.384  -1.616
  617    HB2  GLU  79           HB2      GLU  79  21.089   7.543  -3.271
  618    HB3  GLU  79           HB3      GLU  79  21.084   9.308  -3.438
  619    HG2  GLU  79           HG2      GLU  79  21.611   9.536  -1.014
  620    HG3  GLU  79           HG3      GLU  79  21.758   7.787  -0.889
  621    H    LYS  80           H        LYS  80  18.391   6.910  -4.049
  622    HA   LYS  80           HA       LYS  80  17.525   8.760  -6.059
  623    HB2  LYS  80           HB2      LYS  80  16.798   5.886  -5.419
  624    HB3  LYS  80           HB3      LYS  80  16.159   6.718  -6.813
  625    HG2  LYS  80           HG2      LYS  80  19.114   6.218  -6.285
  626    HG3  LYS  80           HG3      LYS  80  18.081   5.293  -7.367
  627    HD2  LYS  80           HD2      LYS  80  18.878   8.211  -7.694
  628    HD3  LYS  80           HD3      LYS  80  19.514   6.827  -8.586
  629    HE2  LYS  80           HE2      LYS  80  17.254   6.368  -9.519
  630    HE3  LYS  80           HE3      LYS  80  16.611   7.772  -8.650
  631    HZ1  LYS  80           HZ1      LYS  80  18.176   9.165  -9.943
  632    HZ2  LYS  80           HZ2      LYS  80  17.129   8.366 -10.914
  633    HZ3  LYS  80           HZ3      LYS  80  18.671   7.845 -10.788
  634    H    GLN  81           H        GLN  81  16.037   8.261  -3.016
  635    HA   GLN  81           HA       GLN  81  13.351   9.140  -3.907
  636    HB2  GLN  81           HB2      GLN  81  13.705   7.522  -2.051
  637    HB3  GLN  81           HB3      GLN  81  14.535   8.769  -1.122
  638    HG2  GLN  81           HG2      GLN  81  12.515  10.086  -0.922
  639    HG3  GLN  81           HG3      GLN  81  11.653   9.068  -2.075
  640   HE21  GLN  81          1HE2      GLN  81  13.520   8.657   1.055
  641   HE22  GLN  81          2HE2      GLN  81  12.342   7.538   1.729
  642    H    SER  82           H        SER  82  16.371  10.736  -3.197
  643    HA   SER  82           HA       SER  82  15.359  13.004  -1.810
  644    HB2  SER  82           HB2      SER  82  17.530  13.975  -2.119
  645    HB3  SER  82           HB3      SER  82  17.700  12.263  -1.722
  646    HG   SER  82           HG       SER  82  18.251  11.813  -3.821
  647    H    SER  83           H        SER  83  14.697  12.353  -5.026
  648    HA   SER  83           HA       SER  83  14.692  15.072  -6.096
  649    HB2  SER  83           HB2      SER  83  13.164  14.042  -7.787
  650    HB3  SER  83           HB3      SER  83  14.731  13.237  -7.620
  651    HG   SER  83           HG       SER  83  12.955  11.740  -7.722
  652    H    ASP  84           H        ASP  84  12.528  13.160  -4.112
  653    HA   ASP  84           HA       ASP  84  10.749  13.584  -2.854
  654    HB2  ASP  84           HB2      ASP  84  12.369  15.447  -2.230
  655    HB3  ASP  84           HB3      ASP  84  11.300  16.547  -3.091
  656    H    HIS  85           H        HIS  85  10.252  16.519  -4.839
  657    HA   HIS  85           HA       HIS  85   8.113  15.463  -6.434
  658    HB2  HIS  85           HB2      HIS  85   6.245  16.672  -5.583
  659    HB3  HIS  85           HB3      HIS  85   6.868  15.662  -4.293
  660    HD1  HIS  85           HD1      HIS  85   8.196  17.035  -2.271
  661    HD2  HIS  85           HD2      HIS  85   6.088  19.266  -5.152
  662    HE1  HIS  85           HE1      HIS  85   7.900  19.382  -1.287
  Start of MODEL   13
    1    H2   PRO   1           H2       PRO   1  -0.561   1.143  -4.178
    2    H3   PRO   1           H3       PRO   1  -0.152   2.109  -2.906
    3    HA   PRO   1           HA       PRO   1   0.346   0.280  -1.539
    4    HB2  PRO   1           HB2      PRO   1  -0.636  -1.640  -3.649
    5    HB3  PRO   1           HB3      PRO   1  -0.585  -1.828  -1.878
    6    HG2  PRO   1           HG2      PRO   1  -2.770  -0.804  -3.478
    7    HG3  PRO   1           HG3      PRO   1  -2.681  -0.777  -1.691
    8    HD2  PRO   1           HD2      PRO   1  -2.672   1.526  -3.246
    9    HD3  PRO   1           HD3      PRO   1  -1.963   1.397  -1.619
   10    H    GLY   2           H        GLY   2   2.427  -0.530  -1.471
   11    HA2  GLY   2           HA2      GLY   2   4.608  -0.946  -2.190
   12    HA3  GLY   2           HA3      GLY   2   4.044  -0.991  -3.871
   13    H    SER   3           H        SER   3   3.061   1.799  -2.172
   14    HA   SER   3           HA       SER   3   4.060   3.476  -4.144
   15    HB2  SER   3           HB2      SER   3   3.113   4.339  -1.392
   16    HB3  SER   3           HB3      SER   3   3.005   5.240  -2.908
   17    HG   SER   3           HG       SER   3   1.003   4.308  -2.391
   18    H    ALA   4           H        ALA   4   5.748   2.507  -1.303
   19    HA   ALA   4           HA       ALA   4   7.544   4.806  -1.123
   20    HB1  ALA   4           HB1      ALA   4   6.901   3.447   0.840
   21    HB2  ALA   4           HB2      ALA   4   7.653   2.004   0.118
   22    HB3  ALA   4           HB3      ALA   4   8.652   3.392   0.587
   23    H    GLU   5           H        GLU   5   7.446   2.085  -3.264
   24    HA   GLU   5           HA       GLU   5  10.381   1.979  -3.633
   25    HB2  GLU   5           HB2      GLU   5   8.144   0.429  -5.000
   26    HB3  GLU   5           HB3      GLU   5   9.885   0.215  -5.262
   27    HG2  GLU   5           HG2      GLU   5  10.178  -0.391  -2.865
   28    HG3  GLU   5           HG3      GLU   5   8.441  -0.222  -2.601
   29    H    ILE   6           H        ILE   6  11.299   2.098  -5.759
   30    HA   ILE   6           HA       ILE   6  10.120   4.185  -7.565
   31    HB   ILE   6           HB       ILE   6  12.999   3.803  -6.688
   32   HG12  ILE   6          2HG1      ILE   6  11.739   4.756  -4.846
   33   HG13  ILE   6          3HG1      ILE   6  12.904   5.884  -5.491
   34   HG21  ILE   6          1HG2      ILE   6  13.384   6.041  -7.814
   35   HG22  ILE   6          2HG2      ILE   6  13.092   4.701  -8.899
   36   HG23  ILE   6          3HG2      ILE   6  11.787   5.858  -8.562
   37   HD11  ILE   6          3HD1      ILE   6  11.115   7.141  -6.647
   38   HD12  ILE   6          1HD1      ILE   6   9.903   5.980  -6.058
   39   HD13  ILE   6          2HD1      ILE   6  10.799   7.001  -4.918
   40    H    ASP   7           H        ASP   7  10.914   4.041  -9.812
   41    HA   ASP   7           HA       ASP   7  11.308   1.312 -10.816
   42    HB2  ASP   7           HB2      ASP   7   9.982   2.885 -12.109
   43    HB3  ASP   7           HB3      ASP   7  11.322   4.035 -12.162
   44    H    TYR   8           H        TYR   8  13.204   0.469 -10.090
   45    HA   TYR   8           HA       TYR   8  15.688   1.983 -10.164
   46    HB2  TYR   8           HB2      TYR   8  15.303  -0.941  -9.442
   47    HB3  TYR   8           HB3      TYR   8  16.673   0.081  -9.110
   48    HD1  TYR   8           HD1      TYR   8  16.115   2.352  -7.769
   49    HD2  TYR   8           HD2      TYR   8  13.764  -1.263  -7.679
   50    HE1  TYR   8           HE1      TYR   8  15.186   3.019  -5.569
   51    HE2  TYR   8           HE2      TYR   8  12.764  -0.554  -5.504
   52    HH   TYR   8           HH       TYR   8  13.698   2.506  -3.894
   53    H    SER   9           H        SER   9  14.242   0.954 -12.804
   54    HA   SER   9           HA       SER   9  16.256  -0.546 -14.238
   55    HB2  SER   9           HB2      SER   9  14.353   1.590 -15.300
   56    HB3  SER   9           HB3      SER   9  15.235   0.396 -16.250
   57    HG   SER   9           HG       SER   9  13.040   0.043 -14.516
   58    H    ASP  10           H        ASP  10  16.271   2.713 -13.064
   59    HA   ASP  10           HA       ASP  10  18.357   3.794 -14.765
   60    HB2  ASP  10           HB2      ASP  10  16.568   5.076 -13.553
   61    HB3  ASP  10           HB3      ASP  10  17.331   4.630 -12.029
   62    H    ALA  11           H        ALA  11  18.549   1.389 -12.368
   63    HA   ALA  11           HA       ALA  11  20.846   2.166 -10.900
   64    HB1  ALA  11           HB1      ALA  11  20.962  -0.259 -10.302
   65    HB2  ALA  11           HB2      ALA  11  19.326   0.393 -10.155
   66    HB3  ALA  11           HB3      ALA  11  19.766  -0.610 -11.552
   67    HA   PRO  12           HA       PRO  12  24.236   1.423 -13.704
   68    HB2  PRO  12           HB2      PRO  12  26.295   0.887 -12.016
   69    HB3  PRO  12           HB3      PRO  12  25.539   2.511 -12.118
   70    HG2  PRO  12           HG2      PRO  12  24.918   0.327 -10.105
   71    HG3  PRO  12           HG3      PRO  12  25.310   2.045  -9.781
   72    HD2  PRO  12           HD2      PRO  12  22.740   1.176  -9.907
   73    HD3  PRO  12           HD3      PRO  12  23.195   2.770 -10.592
   74    H    ASP  13           H        ASP  13  25.523  -0.277 -14.558
   75    HA   ASP  13           HA       ASP  13  24.248  -2.786 -14.663
   76    HB2  ASP  13           HB2      ASP  13  25.613  -1.700 -16.434
   77    HB3  ASP  13           HB3      ASP  13  27.075  -1.997 -15.489
   78    H    GLU  14           H        GLU  14  26.776  -1.740 -12.485
   79    HA   GLU  14           HA       GLU  14  27.719  -4.364 -11.698
   80    HB2  GLU  14           HB2      GLU  14  28.936  -3.219  -9.969
   81    HB3  GLU  14           HB3      GLU  14  29.077  -2.345 -11.493
   82    HG2  GLU  14           HG2      GLU  14  27.237  -0.777 -10.659
   83    HG3  GLU  14           HG3      GLU  14  27.348  -1.576  -9.088
   84    H    PHE  15           H        PHE  15  24.879  -2.554 -10.810
   85    HA   PHE  15           HA       PHE  15  24.335  -4.311  -8.445
   86    HB2  PHE  15           HB2      PHE  15  22.950  -1.828  -9.513
   87    HB3  PHE  15           HB3      PHE  15  22.435  -2.742  -8.108
   88    HD1  PHE  15           HD1      PHE  15  25.713  -2.991  -7.326
   89    HD2  PHE  15           HD2      PHE  15  22.741   0.099  -7.901
   90    HE1  PHE  15           HE1      PHE  15  26.963  -1.502  -5.828
   91    HE2  PHE  15           HE2      PHE  15  24.029   1.596  -6.422
   92    HZ   PHE  15           HZ       PHE  15  26.144   0.811  -5.377
   93    H    ARG  16           H        ARG  16  23.685  -4.205 -11.799
   94    HA   ARG  16           HA       ARG  16  21.036  -5.519 -11.536
   95    HB2  ARG  16           HB2      ARG  16  22.521  -4.181 -13.806
   96    HB3  ARG  16           HB3      ARG  16  21.081  -5.173 -14.094
   97    HG2  ARG  16           HG2      ARG  16  19.654  -3.700 -12.974
   98    HG3  ARG  16           HG3      ARG  16  20.943  -2.988 -12.012
   99    HD2  ARG  16           HD2      ARG  16  20.116  -1.411 -13.664
  100    HD3  ARG  16           HD3      ARG  16  21.827  -1.793 -13.913
  101    HE   ARG  16           HE       ARG  16  20.073  -3.420 -15.561
  102   HH11  ARG  16          1HH1      ARG  16  21.351  -0.129 -15.337
  103   HH12  ARG  16          2HH1      ARG  16  21.456   0.057 -17.068
  104   HH21  ARG  16          1HH2      ARG  16  20.287  -3.142 -17.790
  105   HH22  ARG  16          2HH2      ARG  16  20.772  -1.598 -18.440
  106    H    ASP  17           H        ASP  17  20.649  -7.601 -12.155
  107    HA   ASP  17           HA       ASP  17  22.968  -9.368 -12.561
  108    HB2  ASP  17           HB2      ASP  17  21.043 -10.022 -11.140
  109    HB3  ASP  17           HB3      ASP  17  20.022 -10.076 -12.580
  110    HA   PRO  18           HA       PRO  18  22.774  -8.794 -16.922
  111    HB2  PRO  18           HB2      PRO  18  24.481 -10.770 -17.845
  112    HB3  PRO  18           HB3      PRO  18  24.986  -9.261 -17.035
  113    HG2  PRO  18           HG2      PRO  18  24.632 -12.005 -15.844
  114    HG3  PRO  18           HG3      PRO  18  25.975 -10.857 -15.590
  115    HD2  PRO  18           HD2      PRO  18  23.934 -11.119 -13.809
  116    HD3  PRO  18           HD3      PRO  18  24.695  -9.535 -14.134
  117    H    LEU  19           H        LEU  19  21.391 -11.736 -15.623
  118    HA   LEU  19           HA       LEU  19  20.354 -12.602 -18.257
  119    HB2  LEU  19           HB2      LEU  19  20.753 -14.323 -16.604
  120    HB3  LEU  19           HB3      LEU  19  19.765 -13.486 -15.404
  121    HG   LEU  19           HG       LEU  19  17.739 -13.935 -16.783
  122   HD11  LEU  19          1HD1      LEU  19  19.679 -15.461 -18.593
  123   HD12  LEU  19          2HD1      LEU  19  18.730 -14.028 -19.048
  124   HD13  LEU  19          3HD1      LEU  19  17.906 -15.549 -18.686
  125   HD21  LEU  19          3HD2      LEU  19  17.674 -16.373 -16.405
  126   HD22  LEU  19          1HD2      LEU  19  18.389 -15.511 -15.033
  127   HD23  LEU  19          2HD2      LEU  19  19.438 -16.393 -16.173
  128    H    MET  20           H        MET  20  18.840 -11.348 -15.256
  129    HA   MET  20           HA       MET  20  16.367 -10.778 -16.724
  130    HB2  MET  20           HB2      MET  20  17.124 -10.411 -13.809
  131    HB3  MET  20           HB3      MET  20  15.513 -10.136 -14.475
  132    HG2  MET  20           HG2      MET  20  17.012 -12.779 -14.524
  133    HG3  MET  20           HG3      MET  20  15.687 -12.353 -13.453
  134    HE1  MET  20           HE1      MET  20  14.191 -15.162 -15.712
  135    HE2  MET  20           HE2      MET  20  15.849 -15.003 -15.082
  136    HE3  MET  20           HE3      MET  20  14.459 -14.603 -14.046
  137    H    ASP  21           H        ASP  21  19.088  -8.861 -15.905
  138    HA   ASP  21           HA       ASP  21  19.696  -6.772 -16.396
  139    HB2  ASP  21           HB2      ASP  21  18.289  -7.110 -18.465
  140    HB3  ASP  21           HB3      ASP  21  16.979  -6.252 -17.646
  141    H    THR  22           H        THR  22  17.432  -7.497 -14.163
  142    HA   THR  22           HA       THR  22  16.739  -4.792 -13.244
  143    HB   THR  22           HB       THR  22  15.395  -6.108 -11.540
  144    HG1  THR  22           HG1      THR  22  16.519  -8.057 -11.611
  145   HG21  THR  22          1HG2      THR  22  14.366  -5.257 -13.632
  146   HG22  THR  22          2HG2      THR  22  13.673  -6.813 -13.141
  147   HG23  THR  22          3HG2      THR  22  14.829  -6.755 -14.470
  148    H    LEU  23           H        LEU  23  17.021  -4.127 -11.073
  149    HA   LEU  23           HA       LEU  23  19.598  -4.572  -9.918
  150    HB2  LEU  23           HB2      LEU  23  17.924  -2.548  -9.776
  151    HB3  LEU  23           HB3      LEU  23  17.250  -3.409  -8.397
  152    HG   LEU  23           HG       LEU  23  20.051  -2.299  -8.786
  153   HD11  LEU  23          1HD1      LEU  23  19.495  -0.958  -6.778
  154   HD12  LEU  23          2HD1      LEU  23  17.863  -1.669  -6.769
  155   HD13  LEU  23          3HD1      LEU  23  18.412  -0.669  -8.134
  156   HD21  LEU  23          3HD2      LEU  23  19.052  -3.966  -6.426
  157   HD22  LEU  23          1HD2      LEU  23  20.565  -3.038  -6.452
  158   HD23  LEU  23          2HD2      LEU  23  20.381  -4.404  -7.528
  159    H    MET  24           H        MET  24  20.209  -6.380  -8.882
  160    HA   MET  24           HA       MET  24  18.398  -8.460  -8.251
  161    HB2  MET  24           HB2      MET  24  20.374  -9.671  -7.402
  162    HB3  MET  24           HB3      MET  24  20.618  -8.936  -8.996
  163    HG2  MET  24           HG2      MET  24  21.807  -7.029  -7.829
  164    HG3  MET  24           HG3      MET  24  21.750  -7.963  -6.344
  165    HE1  MET  24           HE1      MET  24  25.422  -7.813  -8.074
  166    HE2  MET  24           HE2      MET  24  24.133  -6.822  -8.784
  167    HE3  MET  24           HE3      MET  24  24.303  -6.921  -7.019
  168    H    THR  25           H        THR  25  19.850  -6.137  -6.050
  169    HA   THR  25           HA       THR  25  19.655  -5.620  -3.859
  170    HB   THR  25           HB       THR  25  17.631  -5.832  -2.664
  171    HG1  THR  25           HG1      THR  25  17.034  -7.800  -4.572
  172   HG21  THR  25          1HG2      THR  25  16.972  -5.342  -5.590
  173   HG22  THR  25          2HG2      THR  25  17.687  -4.169  -4.466
  174   HG23  THR  25          3HG2      THR  25  16.045  -4.779  -4.180
  175    H    ASP  26           H        ASP  26  19.368  -9.002  -4.483
  176    HA   ASP  26           HA       ASP  26  20.852  -9.620  -1.944
  177    HB2  ASP  26           HB2      ASP  26  18.739 -11.170  -3.478
  178    HB3  ASP  26           HB3      ASP  26  19.916 -11.964  -2.423
  179    HA   PRO  27           HA       PRO  27  23.684 -10.522  -5.485
  180    HB2  PRO  27           HB2      PRO  27  25.912  -9.281  -4.529
  181    HB3  PRO  27           HB3      PRO  27  24.625  -8.407  -5.391
  182    HG2  PRO  27           HG2      PRO  27  25.001  -8.617  -2.395
  183    HG3  PRO  27           HG3      PRO  27  24.692  -7.152  -3.377
  184    HD2  PRO  27           HD2      PRO  27  22.699  -8.479  -2.079
  185    HD3  PRO  27           HD3      PRO  27  22.434  -7.725  -3.694
  186    H    VAL  28           H        VAL  28  24.661 -12.441  -5.457
  187    HA   VAL  28           HA       VAL  28  25.912 -13.489  -2.938
  188    HB   VAL  28           HB       VAL  28  24.369 -15.124  -5.006
  189   HG11  VAL  28          1HG1      VAL  28  25.640 -15.925  -2.362
  190   HG12  VAL  28          2HG1      VAL  28  24.598 -16.944  -3.368
  191   HG13  VAL  28          3HG1      VAL  28  26.175 -16.433  -3.987
  192   HG21  VAL  28          3HG2      VAL  28  23.608 -14.312  -2.160
  193   HG22  VAL  28          1HG2      VAL  28  22.806 -13.788  -3.653
  194   HG23  VAL  28          2HG2      VAL  28  22.741 -15.487  -3.171
  195    H    ARG  29           H        ARG  29  27.903 -14.093  -3.094
  196    HA   ARG  29           HA       ARG  29  29.366 -13.786  -5.607
  197    HB2  ARG  29           HB2      ARG  29  29.939 -12.722  -3.386
  198    HB3  ARG  29           HB3      ARG  29  30.371 -14.324  -2.785
  199    HG2  ARG  29           HG2      ARG  29  32.080 -14.470  -4.649
  200    HG3  ARG  29           HG3      ARG  29  31.634 -12.821  -5.125
  201    HD2  ARG  29           HD2      ARG  29  33.606 -12.646  -3.748
  202    HD3  ARG  29           HD3      ARG  29  32.253 -12.046  -2.803
  203    HE   ARG  29           HE       ARG  29  32.591 -13.744  -1.260
  204   HH11  ARG  29          1HH1      ARG  29  34.241 -14.847  -4.218
  205   HH12  ARG  29          2HH1      ARG  29  35.024 -16.139  -3.360
  206   HH21  ARG  29          1HH2      ARG  29  33.536 -15.357  -0.301
  207   HH22  ARG  29          2HH2      ARG  29  34.630 -16.453  -1.139
  208    H    LEU  30           H        LEU  30  30.382 -15.299  -6.665
  209    HA   LEU  30           HA       LEU  30  29.988 -18.182  -6.083
  210    HB2  LEU  30           HB2      LEU  30  30.791 -16.478  -8.487
  211    HB3  LEU  30           HB3      LEU  30  31.025 -18.187  -8.539
  212    HG   LEU  30           HG       LEU  30  28.974 -17.358  -9.680
  213   HD11  LEU  30          1HD1      LEU  30  27.507 -19.189  -8.891
  214   HD12  LEU  30          2HD1      LEU  30  28.586 -19.423  -7.488
  215   HD13  LEU  30          3HD1      LEU  30  29.181 -19.673  -9.140
  216   HD21  LEU  30          3HD2      LEU  30  26.931 -16.842  -8.449
  217   HD22  LEU  30          1HD2      LEU  30  28.185 -15.666  -8.022
  218   HD23  LEU  30          2HD2      LEU  30  27.773 -16.988  -6.904
  219    HA   PRO  31           HA       PRO  31  34.210 -18.928  -4.944
  220    HB2  PRO  31           HB2      PRO  31  34.934 -21.229  -6.299
  221    HB3  PRO  31           HB3      PRO  31  33.808 -21.195  -4.913
  222    HG2  PRO  31           HG2      PRO  31  33.122 -21.169  -7.867
  223    HG3  PRO  31           HG3      PRO  31  32.449 -22.230  -6.598
  224    HD2  PRO  31           HD2      PRO  31  31.144 -20.010  -7.382
  225    HD3  PRO  31           HD3      PRO  31  31.193 -20.430  -5.649
  226    H    SER  32           H        SER  32  33.518 -18.585  -8.418
  227    HA   SER  32           HA       SER  32  36.264 -18.037  -9.223
  228    HB2  SER  32           HB2      SER  32  35.041 -17.382 -11.355
  229    HB3  SER  32           HB3      SER  32  34.780 -19.040 -10.804
  230    HG   SER  32           HG       SER  32  32.975 -16.936 -10.995
  231    H    GLY  33           H        GLY  33  34.114 -16.220  -7.391
  232    HA2  GLY  33           HA2      GLY  33  34.424 -14.050  -6.594
  233    HA3  GLY  33           HA3      GLY  33  35.520 -13.664  -7.959
  234    H    THR  34           H        THR  34  32.992 -15.002  -9.468
  235    HA   THR  34           HA       THR  34  31.778 -12.617 -10.467
  236    HB   THR  34           HB       THR  34  30.465 -15.349 -10.593
  237    HG1  THR  34           HG1      THR  34  32.732 -14.505 -12.122
  238   HG21  THR  34          1HG2      THR  34  29.417 -13.442 -11.806
  239   HG22  THR  34          2HG2      THR  34  30.015 -14.677 -12.917
  240   HG23  THR  34          3HG2      THR  34  30.926 -13.163 -12.688
  241    H    VAL  35           H        VAL  35  29.583 -11.853 -10.130
  242    HA   VAL  35           HA       VAL  35  28.251 -12.808  -7.622
  243    HB   VAL  35           HB       VAL  35  28.568  -9.913  -8.500
  244   HG11  VAL  35          1HG1      VAL  35  26.319 -10.270  -7.507
  245   HG12  VAL  35          2HG1      VAL  35  27.063 -11.090  -6.116
  246   HG13  VAL  35          3HG1      VAL  35  27.363  -9.354  -6.418
  247   HG21  VAL  35          3HG2      VAL  35  29.758  -9.669  -6.327
  248   HG22  VAL  35          1HG2      VAL  35  29.610 -11.420  -6.056
  249   HG23  VAL  35          2HG2      VAL  35  30.604 -10.793  -7.391
  250    H    MET  36           H        MET  36  26.232 -13.357  -7.834
  251    HA   MET  36           HA       MET  36  24.501 -12.365 -10.078
  252    HB2  MET  36           HB2      MET  36  25.100 -15.229  -9.225
  253    HB3  MET  36           HB3      MET  36  23.509 -14.808  -9.842
  254    HG2  MET  36           HG2      MET  36  24.613 -15.490 -11.754
  255    HG3  MET  36           HG3      MET  36  24.605 -13.740 -11.826
  256    HE1  MET  36           HE1      MET  36  26.727 -16.835 -12.469
  257    HE2  MET  36           HE2      MET  36  28.254 -16.523 -11.644
  258    HE3  MET  36           HE3      MET  36  26.774 -16.815 -10.699
  259    H    ASP  37           H        ASP  37  22.227 -12.637  -9.709
  260    HA   ASP  37           HA       ASP  37  21.238 -11.893  -7.102
  261    HB2  ASP  37           HB2      ASP  37  20.204 -11.383  -9.347
  262    HB3  ASP  37           HB3      ASP  37  19.784 -13.077  -9.484
  263    H    ARG  38           H        ARG  38  20.719 -13.128  -5.411
  264    HA   ARG  38           HA       ARG  38  21.166 -15.789  -4.901
  265    HB2  ARG  38           HB2      ARG  38  20.473 -13.988  -3.289
  266    HB3  ARG  38           HB3      ARG  38  18.818 -14.133  -3.873
  267    HG2  ARG  38           HG2      ARG  38  18.979 -16.629  -3.178
  268    HG3  ARG  38           HG3      ARG  38  20.463 -16.181  -2.343
  269    HD2  ARG  38           HD2      ARG  38  17.646 -15.086  -1.872
  270    HD3  ARG  38           HD3      ARG  38  18.502 -16.203  -0.815
  271    HE   ARG  38           HE       ARG  38  18.785 -13.314  -0.965
  272   HH11  ARG  38          1HH2      ARG  38  20.456 -16.227   0.149
  273   HH12  ARG  38          2HH2      ARG  38  21.376 -15.342   1.338
  274   HH21  ARG  38          1HH1      ARG  38  19.987 -12.253   0.525
  275   HH22  ARG  38          2HH1      ARG  38  21.124 -13.118   1.541
  276    H    SER  39           H        SER  39  18.097 -14.478  -6.253
  277    HA   SER  39           HA       SER  39  16.704 -17.029  -6.172
  278    HB2  SER  39           HB2      SER  39  16.078 -14.489  -7.716
  279    HB3  SER  39           HB3      SER  39  14.994 -15.868  -7.492
  280    HG   SER  39           HG       SER  39  14.619 -14.154  -5.953
  281    H    ILE  40           H        ILE  40  18.740 -15.462  -8.604
  282    HA   ILE  40           HA       ILE  40  17.853 -17.279 -10.755
  283    HB   ILE  40           HB       ILE  40  20.063 -15.168 -10.689
  284   HG12  ILE  40          2HG1      ILE  40  17.275 -15.165 -11.961
  285   HG13  ILE  40          3HG1      ILE  40  17.697 -14.332 -10.457
  286   HG21  ILE  40          1HG2      ILE  40  20.129 -15.432 -13.146
  287   HG22  ILE  40          2HG2      ILE  40  20.608 -16.914 -12.347
  288   HG23  ILE  40          3HG2      ILE  40  18.967 -16.777 -13.031
  289   HD11  ILE  40          3HD1      ILE  40  19.373 -12.978 -11.723
  290   HD12  ILE  40          1HD1      ILE  40  18.721 -13.681 -13.224
  291   HD13  ILE  40          2HD1      ILE  40  17.687 -12.703 -12.169
  292    H    ILE  41           H        ILE  41  20.765 -16.978  -8.662
  293    HA   ILE  41           HA       ILE  41  22.026 -19.290  -9.840
  294    HB   ILE  41           HB       ILE  41  23.320 -17.638  -8.623
  295   HG12  ILE  41          2HG1      ILE  41  24.754 -19.103  -7.271
  296   HG13  ILE  41          3HG1      ILE  41  23.531 -20.365  -7.264
  297   HG21  ILE  41          1HG2      ILE  41  21.775 -17.103  -6.764
  298   HG22  ILE  41          2HG2      ILE  41  22.078 -18.693  -6.044
  299   HG23  ILE  41          3HG2      ILE  41  23.388 -17.520  -6.179
  300   HD11  ILE  41          3HD1      ILE  41  25.365 -20.796  -8.857
  301   HD12  ILE  41          1HD1      ILE  41  23.816 -20.650  -9.704
  302   HD13  ILE  41          2HD1      ILE  41  24.985 -19.293  -9.720
  303    H    LEU  42           H        LEU  42  19.855 -19.070  -6.937
  304    HA   LEU  42           HA       LEU  42  20.037 -21.898  -6.489
  305    HB2  LEU  42           HB2      LEU  42  18.436 -21.693  -4.834
  306    HB3  LEU  42           HB3      LEU  42  19.385 -20.224  -4.811
  307    HG   LEU  42           HG       LEU  42  17.428 -19.137  -6.138
  308   HD11  LEU  42          1HD1      LEU  42  16.059 -21.151  -6.671
  309   HD12  LEU  42          2HD1      LEU  42  15.179 -20.098  -5.587
  310   HD13  LEU  42          3HD1      LEU  42  15.965 -21.551  -4.944
  311   HD21  LEU  42          3HD2      LEU  42  17.048 -20.013  -3.244
  312   HD22  LEU  42          1HD2      LEU  42  16.288 -18.605  -4.018
  313   HD23  LEU  42          2HD2      LEU  42  18.038 -18.652  -3.792
  314    H    ARG  43           H        ARG  43  17.889 -20.055  -8.653
  315    HA   ARG  43           HA       ARG  43  16.144 -22.234  -9.318
  316    HB2  ARG  43           HB2      ARG  43  15.691 -19.844  -9.864
  317    HB3  ARG  43           HB3      ARG  43  17.003 -19.875 -11.051
  318    HG2  ARG  43           HG2      ARG  43  15.716 -21.793 -12.207
  319    HG3  ARG  43           HG3      ARG  43  14.385 -21.429 -11.094
  320    HD2  ARG  43           HD2      ARG  43  14.420 -19.056 -11.967
  321    HD3  ARG  43           HD3      ARG  43  15.683 -19.570 -13.125
  322    HE   ARG  43           HE       ARG  43  13.520 -21.357 -13.409
  323   HH11  ARG  43          1HH1      ARG  43  14.069 -17.907 -14.006
  324   HH12  ARG  43          2HH1      ARG  43  12.864 -17.847 -15.258
  325   HH21  ARG  43          1HH2      ARG  43  11.986 -21.198 -15.041
  326   HH22  ARG  43          2HH2      ARG  43  11.715 -19.672 -15.836
  327    H    HIS  44           H        HIS  44  19.247 -21.118 -10.759
  328    HA   HIS  44           HA       HIS  44  19.263 -23.188 -12.779
  329    HB2  HIS  44           HB2      HIS  44  21.409 -21.354 -11.675
  330    HB3  HIS  44           HB3      HIS  44  21.744 -22.595 -12.887
  331    HD1  HIS  44           HD1      HIS  44  19.626 -19.385 -12.546
  332    HD2  HIS  44           HD2      HIS  44  20.993 -22.177 -15.380
  333    HE1  HIS  44           HE1      HIS  44  18.972 -18.461 -14.834
  334    H    LEU  45           H        LEU  45  20.770 -23.022  -9.500
  335    HA   LEU  45           HA       LEU  45  21.990 -25.587  -9.569
  336    HB2  LEU  45           HB2      LEU  45  20.926 -23.892  -7.294
  337    HB3  LEU  45           HB3      LEU  45  21.748 -25.415  -7.020
  338    HG   LEU  45           HG       LEU  45  23.015 -23.070  -8.501
  339   HD11  LEU  45          1HD1      LEU  45  22.585 -22.565  -6.110
  340   HD12  LEU  45          2HD1      LEU  45  24.315 -22.740  -6.445
  341   HD13  LEU  45          3HD1      LEU  45  23.431 -24.064  -5.651
  342   HD21  LEU  45          3HD2      LEU  45  24.050 -25.166  -9.186
  343   HD22  LEU  45          1HD2      LEU  45  24.123 -25.727  -7.496
  344   HD23  LEU  45          2HD2      LEU  45  25.119 -24.362  -8.042
  345    H    LEU  46           H        LEU  46  18.621 -24.779  -8.753
  346    HA   LEU  46           HA       LEU  46  17.836 -27.427  -7.991
  347    HB2  LEU  46           HB2      LEU  46  16.564 -25.359  -7.512
  348    HB3  LEU  46           HB3      LEU  46  16.268 -25.121  -9.227
  349    HG   LEU  46           HG       LEU  46  14.888 -27.196  -9.286
  350   HD11  LEU  46          1HD1      LEU  46  15.920 -28.478  -7.428
  351   HD12  LEU  46          2HD1      LEU  46  14.192 -28.241  -7.134
  352   HD13  LEU  46          3HD1      LEU  46  15.378 -27.244  -6.267
  353   HD21  LEU  46          3HD2      LEU  46  13.853 -24.997  -8.889
  354   HD22  LEU  46          1HD2      LEU  46  14.081 -25.184  -7.136
  355   HD23  LEU  46          2HD2      LEU  46  12.991 -26.273  -8.024
  356    H    ASN  47           H        ASN  47  18.160 -25.919 -11.199
  357    HA   ASN  47           HA       ASN  47  16.961 -28.167 -12.614
  358    HB2  ASN  47           HB2      ASN  47  16.787 -25.864 -13.430
  359    HB3  ASN  47           HB3      ASN  47  18.544 -25.773 -13.615
  360   HD21  ASN  47          1HD2      ASN  47  15.636 -27.526 -14.790
  361   HD22  ASN  47          2HD2      ASN  47  16.343 -27.951 -16.342
  362    H    SER  48           H        SER  48  20.338 -27.021 -12.086
  363    HA   SER  48           HA       SER  48  21.432 -29.717 -12.324
  364    HB2  SER  48           HB2      SER  48  21.881 -27.650 -14.507
  365    HB3  SER  48           HB3      SER  48  23.119 -28.860 -14.115
  366    HG   SER  48           HG       SER  48  20.426 -29.516 -14.814
  367    HA   PRO  49           HA       PRO  49  24.302 -27.695  -9.612
  368    HB2  PRO  49           HB2      PRO  49  26.283 -29.531  -9.330
  369    HB3  PRO  49           HB3      PRO  49  24.602 -29.872  -8.831
  370    HG2  PRO  49           HG2      PRO  49  25.924 -30.638 -11.455
  371    HG3  PRO  49           HG3      PRO  49  25.017 -31.695 -10.327
  372    HD2  PRO  49           HD2      PRO  49  23.840 -30.527 -12.512
  373    HD3  PRO  49           HD3      PRO  49  22.953 -30.772 -10.976
  374    H    THR  50           H        THR  50  24.456 -26.150 -11.578
  375    HA   THR  50           HA       THR  50  27.301 -25.695 -12.280
  376    HB   THR  50           HB       THR  50  26.483 -25.089 -14.649
  377    HG1  THR  50           HG1      THR  50  24.246 -25.398 -14.190
  378   HG21  THR  50          1HG2      THR  50  26.881 -27.322 -15.506
  379   HG22  THR  50          2HG2      THR  50  26.596 -28.037 -13.907
  380   HG23  THR  50          3HG2      THR  50  28.001 -26.978 -14.180
  381    H    ASP  51           H        ASP  51  27.836 -23.695 -12.878
  382    HA   ASP  51           HA       ASP  51  26.476 -21.423 -11.828
  383    HB2  ASP  51           HB2      ASP  51  28.897 -21.733 -12.074
  384    HB3  ASP  51           HB3      ASP  51  28.748 -21.774 -13.819
  385    HA   PRO  52           HA       PRO  52  23.568 -20.704 -15.092
  386    HB2  PRO  52           HB2      PRO  52  23.025 -17.999 -14.841
  387    HB3  PRO  52           HB3      PRO  52  22.458 -19.264 -13.703
  388    HG2  PRO  52           HG2      PRO  52  24.891 -17.498 -13.431
  389    HG3  PRO  52           HG3      PRO  52  23.622 -17.831 -12.215
  390    HD2  PRO  52           HD2      PRO  52  25.952 -19.191 -12.164
  391    HD3  PRO  52           HD3      PRO  52  24.408 -20.052 -11.895
  392    H    PHE  53           H        PHE  53  26.550 -18.775 -15.203
  393    HA   PHE  53           HA       PHE  53  26.019 -18.130 -18.097
  394    HB2  PHE  53           HB2      PHE  53  27.647 -16.615 -16.029
  395    HB3  PHE  53           HB3      PHE  53  27.438 -16.160 -17.710
  396    HD1  PHE  53           HD2      PHE  53  24.944 -15.800 -18.549
  397    HD2  PHE  53           HD1      PHE  53  26.214 -15.684 -14.420
  398    HE1  PHE  53           HE2      PHE  53  22.922 -14.481 -17.954
  399    HE2  PHE  53           HE1      PHE  53  24.161 -14.383 -13.845
  400    HZ   PHE  53           HZ       PHE  53  22.556 -13.768 -15.579
  401    H    ASN  54           H        ASN  54  28.495 -19.155 -15.736
  402    HA   ASN  54           HA       ASN  54  30.563 -19.325 -17.846
  403    HB2  ASN  54           HB2      ASN  54  31.016 -18.278 -15.638
  404    HB3  ASN  54           HB3      ASN  54  30.673 -19.810 -14.835
  405   HD21  ASN  54          1HD2      ASN  54  32.908 -18.245 -17.193
  406   HD22  ASN  54          2HD2      ASN  54  34.227 -19.362 -16.880
  407    H    ARG  55           H        ARG  55  28.429 -21.431 -16.065
  408    HA   ARG  55           HA       ARG  55  27.889 -23.558 -16.152
  409    HB2  ARG  55           HB2      ARG  55  29.460 -23.750 -18.747
  410    HB3  ARG  55           HB3      ARG  55  28.174 -24.828 -18.225
  411    HG2  ARG  55           HG2      ARG  55  27.797 -21.859 -18.829
  412    HG3  ARG  55           HG3      ARG  55  27.460 -23.171 -19.940
  413    HD2  ARG  55           HD2      ARG  55  25.613 -23.966 -18.702
  414    HD3  ARG  55           HD3      ARG  55  26.116 -23.161 -17.229
  415    HE   ARG  55           HE       ARG  55  25.062 -21.232 -17.858
  416   HH11  ARG  55          1HH1      ARG  55  25.286 -23.201 -20.791
  417   HH12  ARG  55          2HH1      ARG  55  24.251 -22.128 -21.687
  418   HH21  ARG  55          1HH2      ARG  55  23.784 -19.918 -19.022
  419   HH22  ARG  55          2HH2      ARG  55  23.414 -20.269 -20.695
  420    H    GLN  56           H        GLN  56  30.731 -22.778 -15.147
  421    HA   GLN  56           HA       GLN  56  32.124 -25.260 -14.676
  422    HB2  GLN  56           HB2      GLN  56  32.988 -24.106 -12.681
  423    HB3  GLN  56           HB3      GLN  56  33.137 -23.108 -14.121
  424    HG2  GLN  56           HG2      GLN  56  31.057 -21.867 -13.409
  425    HG3  GLN  56           HG3      GLN  56  31.021 -22.830 -11.935
  426   HE21  GLN  56          1HE2      GLN  56  30.997 -20.037 -11.795
  427   HE22  GLN  56          2HE2      GLN  56  32.549 -19.497 -11.196
  428    H    MET  57           H        MET  57  31.880 -26.774 -12.975
  429    HA   MET  57           HA       MET  57  29.202 -27.308 -12.085
  430    HB2  MET  57           HB2      MET  57  31.880 -28.476 -11.224
  431    HB3  MET  57           HB3      MET  57  30.316 -29.033 -10.619
  432    HG2  MET  57           HG2      MET  57  30.831 -30.523 -12.348
  433    HG3  MET  57           HG3      MET  57  29.612 -29.448 -13.015
  434    HE1  MET  57           HE1      MET  57  31.667 -30.438 -16.154
  435    HE2  MET  57           HE2      MET  57  31.231 -31.454 -14.759
  436    HE3  MET  57           HE3      MET  57  30.059 -30.284 -15.424
  437    H    LEU  58           H        LEU  58  28.209 -27.030 -10.125
  438    HA   LEU  58           HA       LEU  58  29.476 -25.271  -8.110
  439    HB2  LEU  58           HB2      LEU  58  28.365 -24.174 -10.348
  440    HB3  LEU  58           HB3      LEU  58  26.913 -24.355  -9.417
  441    HG   LEU  58           HG       LEU  58  27.771 -22.124  -9.215
  442   HD11  LEU  58          1HD1      LEU  58  28.022 -21.775  -6.846
  443   HD12  LEU  58          2HD1      LEU  58  28.522 -23.430  -6.585
  444   HD13  LEU  58          3HD1      LEU  58  26.841 -23.066  -7.080
  445   HD21  LEU  58          3HD2      LEU  58  30.104 -22.498  -9.820
  446   HD22  LEU  58          1HD2      LEU  58  30.422 -23.323  -8.281
  447   HD23  LEU  58          2HD2      LEU  58  30.003 -21.610  -8.292
  448    H    THR  59           H        THR  59  28.542 -25.335  -6.123
  449    HA   THR  59           HA       THR  59  26.005 -26.836  -5.657
  450    HB   THR  59           HB       THR  59  28.569 -27.138  -4.035
  451    HG1  THR  59           HG1      THR  59  28.587 -29.214  -4.943
  452   HG21  THR  59          1HG2      THR  59  27.361 -29.073  -3.005
  453   HG22  THR  59          2HG2      THR  59  25.875 -28.569  -3.852
  454   HG23  THR  59          3HG2      THR  59  26.618 -27.521  -2.608
  455    H    GLU  60           H        GLU  60  24.853 -26.112  -3.801
  456    HA   GLU  60           HA       GLU  60  24.760 -23.373  -3.283
  457    HB2  GLU  60           HB2      GLU  60  23.928 -25.689  -1.478
  458    HB3  GLU  60           HB3      GLU  60  23.459 -24.001  -1.232
  459    HG2  GLU  60           HG2      GLU  60  22.301 -23.980  -3.415
  460    HG3  GLU  60           HG3      GLU  60  22.760 -25.658  -3.701
  461    H    SER  61           H        SER  61  26.683 -25.802  -1.476
  462    HA   SER  61           HA       SER  61  27.506 -24.199   0.697
  463    HB2  SER  61           HB2      SER  61  29.095 -26.409  -0.667
  464    HB3  SER  61           HB3      SER  61  29.226 -25.885   1.015
  465    HG   SER  61           HG       SER  61  27.951 -27.780   0.851
  466    H    MET  62           H        MET  62  28.506 -23.883  -2.615
  467    HA   MET  62           HA       MET  62  31.142 -22.681  -2.018
  468    HB2  MET  62           HB2      MET  62  29.630 -22.842  -4.651
  469    HB3  MET  62           HB3      MET  62  31.328 -22.454  -4.421
  470    HG2  MET  62           HG2      MET  62  31.764 -24.729  -3.578
  471    HG3  MET  62           HG3      MET  62  30.059 -25.142  -3.798
  472    HE1  MET  62           HE1      MET  62  30.660 -27.263  -5.249
  473    HE2  MET  62           HE2      MET  62  31.777 -27.214  -6.635
  474    HE3  MET  62           HE3      MET  62  32.394 -26.910  -5.008
  475    H    LEU  63           H        LEU  63  27.933 -21.583  -2.068
  476    HA   LEU  63           HA       LEU  63  28.410 -18.922  -3.210
  477    HB2  LEU  63           HB2      LEU  63  25.978 -20.129  -1.829
  478    HB3  LEU  63           HB3      LEU  63  26.012 -18.621  -2.718
  479    HG   LEU  63           HG       LEU  63  26.390 -21.407  -3.895
  480   HD11  LEU  63          1HD1      LEU  63  24.256 -20.897  -5.016
  481   HD12  LEU  63          2HD1      LEU  63  24.197 -19.315  -4.225
  482   HD13  LEU  63          3HD1      LEU  63  24.068 -20.813  -3.266
  483   HD21  LEU  63          3HD2      LEU  63  27.818 -19.862  -5.165
  484   HD22  LEU  63          1HD2      LEU  63  26.482 -18.691  -5.283
  485   HD23  LEU  63          2HD2      LEU  63  26.378 -20.257  -6.108
  486    H    GLU  64           H        GLU  64  28.223 -16.964  -2.176
  487    HA   GLU  64           HA       GLU  64  27.944 -16.844   0.777
  488    HB2  GLU  64           HB2      GLU  64  30.340 -17.119   0.349
  489    HB3  GLU  64           HB3      GLU  64  30.323 -15.769  -0.771
  490    HG2  GLU  64           HG2      GLU  64  29.688 -14.229   1.082
  491    HG3  GLU  64           HG3      GLU  64  29.655 -15.602   2.197
  492    HA   PRO  65           HA       PRO  65  25.480 -13.358  -0.927
  493    HB2  PRO  65           HB2      PRO  65  24.825 -13.190   2.013
  494    HB3  PRO  65           HB3      PRO  65  23.740 -13.014   0.595
  495    HG2  PRO  65           HG2      PRO  65  23.766 -15.339   2.004
  496    HG3  PRO  65           HG3      PRO  65  23.738 -15.378   0.205
  497    HD2  PRO  65           HD2      PRO  65  26.118 -15.709   2.054
  498    HD3  PRO  65           HD3      PRO  65  25.657 -16.687   0.627
  499    H    VAL  66           H        VAL  66  26.450 -11.418  -1.279
  500    HA   VAL  66           HA       VAL  66  28.810 -10.827   0.402
  501    HB   VAL  66           HB       VAL  66  29.478 -11.170  -1.742
  502   HG11  VAL  66          1HG1      VAL  66  27.423 -10.947  -3.019
  503   HG12  VAL  66          2HG1      VAL  66  27.443  -9.178  -2.794
  504   HG13  VAL  66          3HG1      VAL  66  28.706  -9.981  -3.747
  505   HG21  VAL  66          3HG2      VAL  66  30.543  -9.238  -0.616
  506   HG22  VAL  66          1HG2      VAL  66  30.581  -9.128  -2.386
  507   HG23  VAL  66          2HG2      VAL  66  29.429  -8.140  -1.463
  508    HA   PRO  67           HA       PRO  67  26.315  -7.583   2.118
  509    HB2  PRO  67           HB2      PRO  67  27.868  -6.823   4.228
  510    HB3  PRO  67           HB3      PRO  67  27.109  -8.445   4.133
  511    HG2  PRO  67           HG2      PRO  67  29.957  -7.668   3.376
  512    HG3  PRO  67           HG3      PRO  67  29.420  -9.008   4.428
  513    HD2  PRO  67           HD2      PRO  67  29.966  -9.399   1.768
  514    HD3  PRO  67           HD3      PRO  67  28.644 -10.276   2.607
  515    H    GLU  68           H        GLU  68  29.715  -6.738   1.222
  516    HA   GLU  68           HA       GLU  68  29.345  -3.947   1.533
  517    HB2  GLU  68           HB2      GLU  68  31.283  -3.644   0.088
  518    HB3  GLU  68           HB3      GLU  68  31.541  -4.891   1.303
  519    HG2  GLU  68           HG2      GLU  68  31.116  -6.642  -0.446
  520    HG3  GLU  68           HG3      GLU  68  30.970  -5.359  -1.654
  521    H    LEU  69           H        LEU  69  28.601  -6.002  -1.310
  522    HA   LEU  69           HA       LEU  69  27.615  -3.774  -2.903
  523    HB2  LEU  69           HB2      LEU  69  27.208  -6.781  -3.126
  524    HB3  LEU  69           HB3      LEU  69  26.616  -5.621  -4.311
  525    HG   LEU  69           HG       LEU  69  29.547  -6.109  -3.611
  526   HD11  LEU  69          1HD1      LEU  69  27.940  -6.768  -6.117
  527   HD12  LEU  69          2HD1      LEU  69  28.478  -7.926  -4.887
  528   HD13  LEU  69          3HD1      LEU  69  29.678  -7.067  -5.864
  529   HD21  LEU  69          3HD2      LEU  69  28.304  -4.247  -5.688
  530   HD22  LEU  69          1HD2      LEU  69  30.028  -4.665  -5.584
  531   HD23  LEU  69          2HD2      LEU  69  29.276  -3.759  -4.278
  532    H    LYS  70           H        LYS  70  25.984  -6.058  -0.660
  533    HA   LYS  70           HA       LYS  70  23.331  -5.076  -1.223
  534    HB2  LYS  70           HB2      LYS  70  23.733  -7.210  -0.100
  535    HB3  LYS  70           HB3      LYS  70  24.488  -6.381   1.273
  536    HG2  LYS  70           HG2      LYS  70  22.402  -5.237   1.828
  537    HG3  LYS  70           HG3      LYS  70  21.585  -5.965   0.437
  538    HD2  LYS  70           HD2      LYS  70  22.858  -7.575   2.699
  539    HD3  LYS  70           HD3      LYS  70  21.204  -6.994   2.765
  540    HE2  LYS  70           HE2      LYS  70  22.268  -8.835   0.560
  541    HE3  LYS  70           HE3      LYS  70  21.447  -9.379   2.025
  542    HZ1  LYS  70           HZ1      LYS  70  19.832  -9.238   0.332
  543    HZ2  LYS  70           HZ2      LYS  70  20.239  -7.711  -0.107
  544    HZ3  LYS  70           HZ3      LYS  70  19.528  -8.002   1.347
  545    H    GLU  71           H        GLU  71  25.731  -4.035   1.212
  546    HA   GLU  71           HA       GLU  71  24.130  -1.952   2.361
  547    HB2  GLU  71           HB2      GLU  71  27.117  -2.475   2.360
  548    HB3  GLU  71           HB3      GLU  71  26.365  -1.105   3.191
  549    HG2  GLU  71           HG2      GLU  71  24.913  -2.673   4.470
  550    HG3  GLU  71           HG3      GLU  71  25.749  -4.038   3.739
  551    H    GLN  72           H        GLN  72  26.385  -1.986  -0.422
  552    HA   GLN  72           HA       GLN  72  26.163   0.900  -0.894
  553    HB2  GLN  72           HB2      GLN  72  27.090  -1.446  -2.594
  554    HB3  GLN  72           HB3      GLN  72  26.973   0.199  -3.224
  555    HG2  GLN  72           HG2      GLN  72  28.540   1.034  -1.550
  556    HG3  GLN  72           HG3      GLN  72  28.628  -0.538  -0.772
  557   HE21  GLN  72          1HE2      GLN  72  29.111   0.906  -4.087
  558   HE22  GLN  72          2HE2      GLN  72  30.527  -0.067  -4.429
  559    H    ILE  73           H        ILE  73  24.417  -1.935  -2.244
  560    HA   ILE  73           HA       ILE  73  22.724  -0.486  -4.030
  561    HB   ILE  73           HB       ILE  73  22.526  -3.167  -2.613
  562   HG12  ILE  73          2HG1      ILE  73  22.671  -2.448  -5.576
  563   HG13  ILE  73          3HG1      ILE  73  24.099  -2.675  -4.577
  564   HG21  ILE  73          1HG2      ILE  73  20.510  -3.661  -4.051
  565   HG22  ILE  73          2HG2      ILE  73  20.208  -2.530  -2.756
  566   HG23  ILE  73          3HG2      ILE  73  20.396  -1.928  -4.407
  567   HD11  ILE  73          3HD1      ILE  73  23.694  -4.712  -5.803
  568   HD12  ILE  73          1HD1      ILE  73  23.377  -5.014  -4.081
  569   HD13  ILE  73          2HD1      ILE  73  22.024  -4.813  -5.232
  570    H    GLN  74           H        GLN  74  22.031  -1.404  -0.597
  571    HA   GLN  74           HA       GLN  74  19.466  -0.142  -0.640
  572    HB2  GLN  74           HB2      GLN  74  19.419  -0.469   1.743
  573    HB3  GLN  74           HB3      GLN  74  20.084  -1.886   0.940
  574    HG2  GLN  74           HG2      GLN  74  21.516  -1.698   2.743
  575    HG3  GLN  74           HG3      GLN  74  22.410  -0.862   1.499
  576   HE21  GLN  74          1HE2      GLN  74  23.515   0.810   2.499
  577   HE22  GLN  74          2HE2      GLN  74  22.805   1.873   3.715
  578    H    ALA  75           H        ALA  75  22.666   1.247   0.036
  579    HA   ALA  75           HA       ALA  75  21.689   3.818   0.943
  580    HB1  ALA  75           HB1      ALA  75  23.983   3.016   1.374
  581    HB2  ALA  75           HB2      ALA  75  24.322   3.020  -0.371
  582    HB3  ALA  75           HB3      ALA  75  23.999   4.542   0.478
  583    H    TRP  76           H        TRP  76  22.559   2.535  -2.308
  584    HA   TRP  76           HA       TRP  76  21.981   5.006  -3.697
  585    HB2  TRP  76           HB2      TRP  76  23.424   3.238  -4.603
  586    HB3  TRP  76           HB3      TRP  76  22.063   2.139  -4.700
  587    HD1  TRP  76           HD1      TRP  76  23.573   5.204  -6.362
  588    HE1  TRP  76           HE1      TRP  76  22.442   5.664  -8.619
  589    HE3  TRP  76           HE3      TRP  76  19.843   1.710  -6.111
  590    HZ2  TRP  76           HZ2      TRP  76  20.107   4.730 -10.071
  591    HZ3  TRP  76           HZ3      TRP  76  18.183   1.520  -7.928
  592    HH2  TRP  76           HH2      TRP  76  18.276   3.041  -9.894
  593    H    MET  77           H        MET  77  19.959   2.106  -3.012
  594    HA   MET  77           HA       MET  77  17.577   3.047  -4.303
  595    HB2  MET  77           HB2      MET  77  17.977   1.202  -1.919
  596    HB3  MET  77           HB3      MET  77  16.414   1.505  -2.670
  597    HG2  MET  77           HG2      MET  77  17.179   0.585  -4.807
  598    HG3  MET  77           HG3      MET  77  18.818   0.443  -4.194
  599    HE1  MET  77           HE1      MET  77  15.275  -0.521  -2.661
  600    HE2  MET  77           HE2      MET  77  15.271  -1.085  -4.341
  601    HE3  MET  77           HE3      MET  77  15.253  -2.257  -3.002
  602    H    ARG  78           H        ARG  78  18.724   3.549  -0.913
  603    HA   ARG  78           HA       ARG  78  16.574   5.173  -0.036
  604    HB2  ARG  78           HB2      ARG  78  18.290   4.198   1.434
  605    HB3  ARG  78           HB3      ARG  78  19.509   5.276   0.750
  606    HG2  ARG  78           HG2      ARG  78  18.290   7.244   1.618
  607    HG3  ARG  78           HG3      ARG  78  17.012   6.186   2.248
  608    HD2  ARG  78           HD2      ARG  78  18.640   5.101   3.758
  609    HD3  ARG  78           HD3      ARG  78  19.952   6.077   3.088
  610    HE   ARG  78           HE       ARG  78  17.851   6.909   4.975
  611   HH11  ARG  78          1HH1      ARG  78  20.393   8.124   2.830
  612   HH12  ARG  78          2HH1      ARG  78  20.468   9.663   3.647
  613   HH21  ARG  78          1HH2      ARG  78  18.016   8.885   5.991
  614   HH22  ARG  78          2HH2      ARG  78  19.117  10.087   5.389
  615    H    GLU  79           H        GLU  79  19.570   6.159  -1.776
  616    HA   GLU  79           HA       GLU  79  18.986   8.946  -1.828
  617    HB2  GLU  79           HB2      GLU  79  21.184   7.901  -2.297
  618    HB3  GLU  79           HB3      GLU  79  20.587   7.335  -3.860
  619    HG2  GLU  79           HG2      GLU  79  20.206   9.681  -4.578
  620    HG3  GLU  79           HG3      GLU  79  20.689  10.252  -2.978
  621    H    LYS  80           H        LYS  80  18.036   6.336  -4.139
  622    HA   LYS  80           HA       LYS  80  16.627   8.076  -5.968
  623    HB2  LYS  80           HB2      LYS  80  16.372   5.103  -5.341
  624    HB3  LYS  80           HB3      LYS  80  15.492   5.885  -6.634
  625    HG2  LYS  80           HG2      LYS  80  18.527   5.732  -6.409
  626    HG3  LYS  80           HG3      LYS  80  17.513   4.681  -7.385
  627    HD2  LYS  80           HD2      LYS  80  17.839   7.681  -7.787
  628    HD3  LYS  80           HD3      LYS  80  18.643   6.415  -8.716
  629    HE2  LYS  80           HE2      LYS  80  16.441   5.553  -9.499
  630    HE3  LYS  80           HE3      LYS  80  15.619   6.822  -8.578
  631    HZ1  LYS  80           HZ1      LYS  80  17.508   7.252 -10.841
  632    HZ2  LYS  80           HZ2      LYS  80  16.812   8.458  -9.982
  633    HZ3  LYS  80           HZ3      LYS  80  15.886   7.466 -10.890
  634    H    GLN  81           H        GLN  81  15.524   6.319  -3.065
  635    HA   GLN  81           HA       GLN  81  12.731   7.056  -3.289
  636    HB2  GLN  81           HB2      GLN  81  14.433   6.135  -0.938
  637    HB3  GLN  81           HB3      GLN  81  12.700   6.419  -0.838
  638    HG2  GLN  81           HG2      GLN  81  12.240   4.694  -2.505
  639    HG3  GLN  81           HG3      GLN  81  13.944   4.432  -2.799
  640   HE21  GLN  81          1HE2      GLN  81  11.257   3.423  -0.941
  641   HE22  GLN  81          2HE2      GLN  81  12.154   2.472   0.251
  642    H    SER  82           H        SER  82  15.496   8.563  -1.618
  643    HA   SER  82           HA       SER  82  16.009  10.745  -1.327
  644    HB2  SER  82           HB2      SER  82  14.718  11.020  -3.493
  645    HB3  SER  82           HB3      SER  82  13.340  11.555  -2.510
  646    HG   SER  82           HG       SER  82  14.581  13.344  -3.188
  647    H    SER  83           H        SER  83  12.719   9.988  -0.322
  648    HA   SER  83           HA       SER  83  11.597  10.260   1.657
  649    HB2  SER  83           HB2      SER  83  13.994  10.156   2.697
  650    HB3  SER  83           HB3      SER  83  13.771  11.889   2.940
  651    HG   SER  83           HG       SER  83  13.065  10.691   4.759
  652    H    ASP  84           H        ASP  84  12.547  12.674  -0.390
  653    HA   ASP  84           HA       ASP  84  10.313  14.458   0.397
  654    HB2  ASP  84           HB2      ASP  84  12.357  15.357   1.524
  655    HB3  ASP  84           HB3      ASP  84  13.161  15.443  -0.049
  656    H    HIS  85           H        HIS  85   9.544  15.765  -1.289
  657    HA   HIS  85           HA       HIS  85  10.560  15.558  -4.033
  658    HB2  HIS  85           HB2      HIS  85   9.330  13.431  -3.744
  659    HB3  HIS  85           HB3      HIS  85   7.884  14.325  -3.275
  660    HD1  HIS  85           HD1      HIS  85  10.064  13.623  -6.365
  661    HD2  HIS  85           HD2      HIS  85   6.421  15.408  -5.254
  662    HE1  HIS  85           HE1      HIS  85   8.795  14.048  -8.536
  Start of MODEL   14
    1    H2   PRO   1           H2       PRO   1   1.933  -7.161 -10.309
    2    H3   PRO   1           H3       PRO   1   1.426  -8.669  -9.878
    3    HA   PRO   1           HA       PRO   1   2.252  -8.472  -7.706
    4    HB2  PRO   1           HB2      PRO   1   3.563  -5.828  -8.339
    5    HB3  PRO   1           HB3      PRO   1   4.040  -7.111  -7.180
    6    HG2  PRO   1           HG2      PRO   1   4.862  -6.792  -9.955
    7    HG3  PRO   1           HG3      PRO   1   5.301  -8.136  -8.860
    8    HD2  PRO   1           HD2      PRO   1   3.705  -8.495 -11.086
    9    HD3  PRO   1           HD3      PRO   1   3.604  -9.483  -9.608
   10    H    GLY   2           H        GLY   2   1.703  -6.883  -5.922
   11    HA2  GLY   2           HA2      GLY   2  -0.920  -5.561  -6.501
   12    HA3  GLY   2           HA3      GLY   2  -0.359  -6.198  -4.933
   13    H    SER   3           H        SER   3   2.103  -4.443  -6.490
   14    HA   SER   3           HA       SER   3   1.486  -1.818  -5.325
   15    HB2  SER   3           HB2      SER   3   3.383  -1.862  -3.765
   16    HB3  SER   3           HB3      SER   3   2.157  -3.067  -3.352
   17    HG   SER   3           HG       SER   3   4.293  -3.933  -3.240
   18    H    ALA   4           H        ALA   4   3.549  -0.399  -5.430
   19    HA   ALA   4           HA       ALA   4   5.257  -0.961  -7.798
   20    HB1  ALA   4           HB1      ALA   4   3.216   0.245  -8.584
   21    HB2  ALA   4           HB2      ALA   4   3.566   1.565  -7.438
   22    HB3  ALA   4           HB3      ALA   4   4.690   1.220  -8.773
   23    H    GLU   5           H        GLU   5   6.876   0.884  -8.060
   24    HA   GLU   5           HA       GLU   5   7.890   2.113  -5.612
   25    HB2  GLU   5           HB2      GLU   5   8.524  -0.333  -5.452
   26    HB3  GLU   5           HB3      GLU   5   9.411  -0.168  -6.956
   27    HG2  GLU   5           HG2      GLU   5  10.825  -0.185  -4.918
   28    HG3  GLU   5           HG3      GLU   5  11.065   1.233  -5.917
   29    H    ILE   6           H        ILE   6  10.035   3.210  -6.092
   30    HA   ILE   6           HA       ILE   6  10.116   4.820  -8.438
   31    HB   ILE   6           HB       ILE   6  12.390   3.878  -6.643
   32   HG12  ILE   6          2HG1      ILE   6  10.728   5.070  -5.300
   33   HG13  ILE   6          3HG1      ILE   6  12.207   5.975  -5.449
   34   HG21  ILE   6          1HG2      ILE   6  13.418   4.754  -8.609
   35   HG22  ILE   6          2HG2      ILE   6  12.280   6.108  -8.707
   36   HG23  ILE   6          3HG2      ILE   6  13.496   6.055  -7.420
   37   HD11  ILE   6          3HD1      ILE   6  10.230   7.428  -5.593
   38   HD12  ILE   6          1HD1      ILE   6  11.111   7.473  -7.133
   39   HD13  ILE   6          2HD1      ILE   6   9.616   6.516  -6.988
   40    H    ASP   7           H        ASP   7  11.000   4.628 -10.431
   41    HA   ASP   7           HA       ASP   7  11.547   1.977 -11.487
   42    HB2  ASP   7           HB2      ASP   7  10.240   3.654 -12.718
   43    HB3  ASP   7           HB3      ASP   7  11.630   4.730 -12.763
   44    H    TYR   8           H        TYR   8  13.398   1.084 -10.846
   45    HA   TYR   8           HA       TYR   8  15.901   2.561 -10.626
   46    HB2  TYR   8           HB2      TYR   8  15.294  -0.384 -10.214
   47    HB3  TYR   8           HB3      TYR   8  16.786   0.433  -9.763
   48    HD1  TYR   8           HD1      TYR   8  16.023   2.865  -8.386
   49    HD2  TYR   8           HD2      TYR   8  14.185  -1.036  -8.269
   50    HE1  TYR   8           HE1      TYR   8  15.188   3.316  -6.090
   51    HE2  TYR   8           HE2      TYR   8  13.315  -0.556  -5.986
   52    HH   TYR   8           HH       TYR   8  13.254   0.957  -4.235
   53    H    SER   9           H        SER   9  14.748   2.205 -13.404
   54    HA   SER   9           HA       SER   9  16.627   0.718 -15.002
   55    HB2  SER   9           HB2      SER   9  15.929   2.276 -16.782
   56    HB3  SER   9           HB3      SER   9  14.549   1.597 -15.910
   57    HG   SER   9           HG       SER   9  14.281   3.841 -16.185
   58    H    ASP  10           H        ASP  10  16.948   3.679 -13.203
   59    HA   ASP  10           HA       ASP  10  19.343   4.709 -14.446
   60    HB2  ASP  10           HB2      ASP  10  17.583   5.995 -13.213
   61    HB3  ASP  10           HB3      ASP  10  18.102   5.216 -11.718
   62    H    ALA  11           H        ALA  11  18.967   1.926 -12.519
   63    HA   ALA  11           HA       ALA  11  21.160   2.169 -10.713
   64    HB1  ALA  11           HB1      ALA  11  19.843  -0.328 -11.887
   65    HB2  ALA  11           HB2      ALA  11  20.872  -0.279 -10.431
   66    HB3  ALA  11           HB3      ALA  11  19.309   0.549 -10.430
   67    HA   PRO  12           HA       PRO  12  24.637   1.492 -13.420
   68    HB2  PRO  12           HB2      PRO  12  26.564   0.696 -11.673
   69    HB3  PRO  12           HB3      PRO  12  25.890   2.356 -11.671
   70    HG2  PRO  12           HG2      PRO  12  25.043   0.021  -9.918
   71    HG3  PRO  12           HG3      PRO  12  25.500   1.683  -9.402
   72    HD2  PRO  12           HD2      PRO  12  22.900   0.996  -9.765
   73    HD3  PRO  12           HD3      PRO  12  23.509   2.608 -10.245
   74    H    ASP  13           H        ASP  13  25.934  -0.199 -14.341
   75    HA   ASP  13           HA       ASP  13  24.522  -2.624 -14.734
   76    HB2  ASP  13           HB2      ASP  13  26.083  -1.427 -16.314
   77    HB3  ASP  13           HB3      ASP  13  27.434  -2.020 -15.355
   78    H    GLU  14           H        GLU  14  26.881  -1.851 -12.304
   79    HA   GLU  14           HA       GLU  14  27.595  -4.596 -11.641
   80    HB2  GLU  14           HB2      GLU  14  28.844  -3.656  -9.829
   81    HB3  GLU  14           HB3      GLU  14  29.134  -2.725 -11.295
   82    HG2  GLU  14           HG2      GLU  14  27.418  -1.036 -10.446
   83    HG3  GLU  14           HG3      GLU  14  27.420  -1.920  -8.910
   84    H    PHE  15           H        PHE  15  24.829  -2.634 -10.917
   85    HA   PHE  15           HA       PHE  15  24.029  -4.287  -8.559
   86    HB2  PHE  15           HB2      PHE  15  22.812  -1.838  -9.917
   87    HB3  PHE  15           HB3      PHE  15  22.029  -2.733  -8.648
   88    HD1  PHE  15           HD2      PHE  15  25.456  -2.739  -7.659
   89    HD2  PHE  15           HD1      PHE  15  21.954  -0.236  -7.925
   90    HE1  PHE  15           HE2      PHE  15  26.386  -1.252  -5.921
   91    HE2  PHE  15           HE1      PHE  15  22.895   1.259  -6.193
   92    HZ   PHE  15           HZ       PHE  15  25.118   0.758  -5.192
   93    H    ARG  16           H        ARG  16  23.475  -4.088 -12.034
   94    HA   ARG  16           HA       ARG  16  20.994  -5.673 -11.841
   95    HB2  ARG  16           HB2      ARG  16  22.449  -4.336 -14.150
   96    HB3  ARG  16           HB3      ARG  16  20.975  -5.302 -14.324
   97    HG2  ARG  16           HG2      ARG  16  19.778  -3.804 -12.776
   98    HG3  ARG  16           HG3      ARG  16  21.216  -2.794 -12.575
   99    HD2  ARG  16           HD2      ARG  16  20.022  -3.278 -15.308
  100    HD3  ARG  16           HD3      ARG  16  19.359  -2.071 -14.207
  101    HE   ARG  16           HE       ARG  16  21.332  -0.801 -14.267
  102   HH11  ARG  16          1HH1      ARG  16  21.494  -3.378 -16.750
  103   HH12  ARG  16          2HH1      ARG  16  22.884  -2.624 -17.479
  104   HH21  ARG  16          1HH2      ARG  16  22.885   0.151 -15.375
  105   HH22  ARG  16          2HH2      ARG  16  23.582  -0.585 -16.799
  106    H    ASP  17           H        ASP  17  20.817  -7.801 -12.279
  107    HA   ASP  17           HA       ASP  17  23.224  -9.410 -12.685
  108    HB2  ASP  17           HB2      ASP  17  21.413 -10.134 -11.190
  109    HB3  ASP  17           HB3      ASP  17  20.316 -10.267 -12.576
  110    HA   PRO  18           HA       PRO  18  23.066  -9.220 -17.071
  111    HB2  PRO  18           HB2      PRO  18  24.540 -11.462 -17.827
  112    HB3  PRO  18           HB3      PRO  18  25.202  -9.913 -17.234
  113    HG2  PRO  18           HG2      PRO  18  24.672 -12.445 -15.685
  114    HG3  PRO  18           HG3      PRO  18  26.111 -11.385 -15.617
  115    HD2  PRO  18           HD2      PRO  18  24.163 -11.242 -13.753
  116    HD3  PRO  18           HD3      PRO  18  24.959  -9.750 -14.351
  117    H    LEU  19           H        LEU  19  21.452 -11.990 -15.598
  118    HA   LEU  19           HA       LEU  19  20.262 -12.838 -18.161
  119    HB2  LEU  19           HB2      LEU  19  20.562 -14.515 -16.460
  120    HB3  LEU  19           HB3      LEU  19  19.697 -13.551 -15.261
  121    HG   LEU  19           HG       LEU  19  17.593 -13.864 -16.561
  122   HD11  LEU  19          1HD1      LEU  19  19.294 -15.673 -18.337
  123   HD12  LEU  19          2HD1      LEU  19  18.511 -14.150 -18.842
  124   HD13  LEU  19          3HD1      LEU  19  17.529 -15.547 -18.383
  125   HD21  LEU  19          3HD2      LEU  19  18.111 -15.403 -14.749
  126   HD22  LEU  19          1HD2      LEU  19  19.081 -16.423 -15.839
  127   HD23  LEU  19          2HD2      LEU  19  17.319 -16.287 -16.067
  128    H    MET  20           H        MET  20  18.953 -11.326 -15.173
  129    HA   MET  20           HA       MET  20  16.474 -10.661 -16.594
  130    HB2  MET  20           HB2      MET  20  17.339 -10.248 -13.700
  131    HB3  MET  20           HB3      MET  20  15.729  -9.885 -14.329
  132    HG2  MET  20           HG2      MET  20  17.029 -12.628 -14.352
  133    HG3  MET  20           HG3      MET  20  15.814 -12.063 -13.209
  134    HE1  MET  20           HE1      MET  20  13.895 -14.772 -15.242
  135    HE2  MET  20           HE2      MET  20  15.597 -14.772 -14.746
  136    HE3  MET  20           HE3      MET  20  14.349 -14.183 -13.627
  137    H    ASP  21           H        ASP  21  19.325  -8.855 -15.895
  138    HA   ASP  21           HA       ASP  21  19.937  -6.718 -16.084
  139    HB2  ASP  21           HB2      ASP  21  19.394  -7.283 -18.426
  140    HB3  ASP  21           HB3      ASP  21  17.801  -6.548 -18.231
  141    H    THR  22           H        THR  22  18.340  -7.103 -13.947
  142    HA   THR  22           HA       THR  22  17.351  -4.383 -13.417
  143    HB   THR  22           HB       THR  22  15.380  -5.746 -14.182
  144    HG1  THR  22           HG1      THR  22  14.140  -4.933 -12.476
  145   HG21  THR  22          1HG2      THR  22  15.682  -7.154 -11.485
  146   HG22  THR  22          2HG2      THR  22  16.037  -7.915 -13.049
  147   HG23  THR  22          3HG2      THR  22  14.390  -7.381 -12.689
  148    H    LEU  23           H        LEU  23  16.980  -4.082 -11.054
  149    HA   LEU  23           HA       LEU  23  19.453  -4.563  -9.787
  150    HB2  LEU  23           HB2      LEU  23  17.333  -2.836  -9.410
  151    HB3  LEU  23           HB3      LEU  23  17.136  -3.877  -8.018
  152    HG   LEU  23           HG       LEU  23  19.622  -2.299  -8.779
  153   HD11  LEU  23          1HD1      LEU  23  17.714  -0.950  -7.929
  154   HD12  LEU  23          2HD1      LEU  23  19.089  -0.935  -6.800
  155   HD13  LEU  23          3HD1      LEU  23  17.657  -1.942  -6.472
  156   HD21  LEU  23          3HD2      LEU  23  20.324  -4.350  -7.583
  157   HD22  LEU  23          1HD2      LEU  23  19.129  -4.026  -6.300
  158   HD23  LEU  23          2HD2      LEU  23  20.510  -2.929  -6.563
  159    H    MET  24           H        MET  24  20.248  -6.348  -8.867
  160    HA   MET  24           HA       MET  24  18.606  -8.653  -8.398
  161    HB2  MET  24           HB2      MET  24  20.659  -9.749  -7.628
  162    HB3  MET  24           HB3      MET  24  20.858  -8.918  -9.172
  163    HG2  MET  24           HG2      MET  24  21.944  -7.017  -7.889
  164    HG3  MET  24           HG3      MET  24  21.900  -8.032  -6.451
  165    HE1  MET  24           HE1      MET  24  25.569  -7.654  -8.267
  166    HE2  MET  24           HE2      MET  24  24.212  -6.730  -8.938
  167    HE3  MET  24           HE3      MET  24  24.438  -6.824  -7.181
  168    H    THR  25           H        THR  25  19.866  -6.253  -6.178
  169    HA   THR  25           HA       THR  25  19.391  -5.676  -4.035
  170    HB   THR  25           HB       THR  25  17.109  -7.662  -4.019
  171    HG1  THR  25           HG1      THR  25  15.927  -5.975  -5.004
  172   HG21  THR  25          1HG2      THR  25  17.529  -4.925  -2.735
  173   HG22  THR  25          2HG2      THR  25  17.496  -6.489  -1.892
  174   HG23  THR  25          3HG2      THR  25  16.027  -5.880  -2.666
  175    H    ASP  26           H        ASP  26  19.617  -9.102  -4.575
  176    HA   ASP  26           HA       ASP  26  21.178  -9.460  -2.040
  177    HB2  ASP  26           HB2      ASP  26  19.165 -11.282  -3.416
  178    HB3  ASP  26           HB3      ASP  26  20.388 -11.877  -2.283
  179    HA   PRO  27           HA       PRO  27  24.008 -10.435  -5.585
  180    HB2  PRO  27           HB2      PRO  27  26.211  -9.129  -4.616
  181    HB3  PRO  27           HB3      PRO  27  24.948  -8.318  -5.573
  182    HG2  PRO  27           HG2      PRO  27  25.233  -8.355  -2.571
  183    HG3  PRO  27           HG3      PRO  27  24.911  -6.953  -3.641
  184    HD2  PRO  27           HD2      PRO  27  22.904  -8.237  -2.322
  185    HD3  PRO  27           HD3      PRO  27  22.669  -7.605  -3.981
  186    H    VAL  28           H        VAL  28  25.042 -12.314  -5.491
  187    HA   VAL  28           HA       VAL  28  26.264 -13.305  -2.937
  188    HB   VAL  28           HB       VAL  28  24.558 -14.804  -4.970
  189   HG11  VAL  28          1HG1      VAL  28  26.402 -16.294  -4.305
  190   HG12  VAL  28          2HG1      VAL  28  26.070 -15.969  -2.588
  191   HG13  VAL  28          3HG1      VAL  28  24.873 -16.816  -3.588
  192   HG21  VAL  28          3HG2      VAL  28  24.215 -14.313  -1.967
  193   HG22  VAL  28          1HG2      VAL  28  23.276 -13.550  -3.263
  194   HG23  VAL  28          2HG2      VAL  28  23.149 -15.298  -2.990
  195    H    ARG  29           H        ARG  29  28.163 -14.237  -3.052
  196    HA   ARG  29           HA       ARG  29  29.791 -13.905  -5.455
  197    HB2  ARG  29           HB2      ARG  29  30.307 -13.254  -2.946
  198    HB3  ARG  29           HB3      ARG  29  30.643 -14.948  -2.726
  199    HG2  ARG  29           HG2      ARG  29  32.727 -13.994  -3.130
  200    HG3  ARG  29           HG3      ARG  29  32.323 -14.700  -4.700
  201    HD2  ARG  29           HD2      ARG  29  31.621 -12.497  -5.545
  202    HD3  ARG  29           HD3      ARG  29  31.881 -11.782  -3.931
  203    HE   ARG  29           HE       ARG  29  34.303 -13.008  -4.696
  204   HH11  ARG  29          1HH1      ARG  29  32.379 -10.223  -5.718
  205   HH12  ARG  29          2HH1      ARG  29  33.767  -9.364  -6.313
  206   HH21  ARG  29          1HH2      ARG  29  36.055 -11.842  -5.455
  207   HH22  ARG  29          2HH2      ARG  29  35.819 -10.277  -6.172
  208    H    LEU  30           H        LEU  30  30.421 -15.545  -6.730
  209    HA   LEU  30           HA       LEU  30  30.038 -18.404  -5.959
  210    HB2  LEU  30           HB2      LEU  30  30.394 -16.894  -8.575
  211    HB3  LEU  30           HB3      LEU  30  30.781 -18.581  -8.508
  212    HG   LEU  30           HG       LEU  30  28.436 -19.020  -7.599
  213   HD11  LEU  30          1HD1      LEU  30  26.698 -17.325  -8.266
  214   HD12  LEU  30          2HD1      LEU  30  28.004 -16.156  -8.550
  215   HD13  LEU  30          3HD1      LEU  30  27.706 -16.806  -6.919
  216   HD21  LEU  30          3HD2      LEU  30  27.458 -18.961  -9.885
  217   HD22  LEU  30          1HD2      LEU  30  29.118 -19.580  -9.873
  218   HD23  LEU  30          2HD2      LEU  30  28.802 -17.916 -10.409
  219    HA   PRO  31           HA       PRO  31  34.225 -19.045  -5.023
  220    HB2  PRO  31           HB2      PRO  31  34.941 -21.458  -6.163
  221    HB3  PRO  31           HB3      PRO  31  33.794 -21.296  -4.798
  222    HG2  PRO  31           HG2      PRO  31  33.152 -21.508  -7.754
  223    HG3  PRO  31           HG3      PRO  31  32.458 -22.468  -6.408
  224    HD2  PRO  31           HD2      PRO  31  31.165 -20.336  -7.390
  225    HD3  PRO  31           HD3      PRO  31  31.192 -20.608  -5.631
  226    H    SER  32           H        SER  32  33.547 -18.959  -8.509
  227    HA   SER  32           HA       SER  32  36.291 -18.561  -9.385
  228    HB2  SER  32           HB2      SER  32  35.121 -17.909 -11.501
  229    HB3  SER  32           HB3      SER  32  34.646 -19.483 -10.871
  230    HG   SER  32           HG       SER  32  33.137 -17.159 -11.147
  231    H    GLY  33           H        GLY  33  34.284 -16.578  -7.552
  232    HA2  GLY  33           HA2      GLY  33  34.708 -14.393  -6.830
  233    HA3  GLY  33           HA3      GLY  33  35.768 -14.099  -8.228
  234    H    THR  34           H        THR  34  32.976 -15.460  -9.423
  235    HA   THR  34           HA       THR  34  31.971 -13.035 -10.588
  236    HB   THR  34           HB       THR  34  30.716 -15.811 -10.459
  237    HG1  THR  34           HG1      THR  34  31.754 -15.989 -12.500
  238   HG21  THR  34          1HG2      THR  34  29.616 -15.147 -12.589
  239   HG22  THR  34          2HG2      THR  34  30.230 -13.494 -12.391
  240   HG23  THR  34          3HG2      THR  34  29.061 -14.176 -11.234
  241    H    VAL  35           H        VAL  35  30.172 -11.822 -10.093
  242    HA   VAL  35           HA       VAL  35  28.695 -12.418  -7.563
  243    HB   VAL  35           HB       VAL  35  28.957  -9.768  -9.023
  244   HG11  VAL  35          1HG1      VAL  35  27.761  -8.823  -7.062
  245   HG12  VAL  35          2HG1      VAL  35  26.736  -9.938  -7.929
  246   HG13  VAL  35          3HG1      VAL  35  27.513 -10.459  -6.417
  247   HG21  VAL  35          3HG2      VAL  35  31.030 -10.361  -7.816
  248   HG22  VAL  35          1HG2      VAL  35  30.184  -9.061  -6.974
  249   HG23  VAL  35          2HG2      VAL  35  30.086 -10.721  -6.354
  250    H    MET  36           H        MET  36  26.556 -12.766  -7.622
  251    HA   MET  36           HA       MET  36  24.952 -12.434 -10.097
  252    HB2  MET  36           HB2      MET  36  26.307 -14.682  -9.903
  253    HB3  MET  36           HB3      MET  36  25.109 -15.103  -8.674
  254    HG2  MET  36           HG2      MET  36  23.314 -14.776 -10.344
  255    HG3  MET  36           HG3      MET  36  24.508 -14.314 -11.559
  256    HE1  MET  36           HE1      MET  36  26.390 -15.883 -12.443
  257    HE2  MET  36           HE2      MET  36  26.900 -16.577 -10.887
  258    HE3  MET  36           HE3      MET  36  26.437 -17.650 -12.212
  259    H    ASP  37           H        ASP  37  22.673 -12.786  -9.738
  260    HA   ASP  37           HA       ASP  37  21.598 -11.916  -7.184
  261    HB2  ASP  37           HB2      ASP  37  20.625 -11.515  -9.445
  262    HB3  ASP  37           HB3      ASP  37  20.225 -13.217  -9.557
  263    H    ARG  38           H        ARG  38  21.131 -13.084  -5.442
  264    HA   ARG  38           HA       ARG  38  21.611 -15.746  -4.854
  265    HB2  ARG  38           HB2      ARG  38  20.985 -13.858  -3.272
  266    HB3  ARG  38           HB3      ARG  38  19.308 -14.055  -3.780
  267    HG2  ARG  38           HG2      ARG  38  19.562 -16.532  -3.007
  268    HG3  ARG  38           HG3      ARG  38  21.057 -16.012  -2.240
  269    HD2  ARG  38           HD2      ARG  38  18.245 -14.964  -1.710
  270    HD3  ARG  38           HD3      ARG  38  19.146 -16.047  -0.668
  271    HE   ARG  38           HE       ARG  38  19.304 -13.169  -0.824
  272   HH11  ARG  38          1HH1      ARG  38  21.305 -15.929   0.109
  273   HH12  ARG  38          2HH1      ARG  38  22.273 -14.960   1.180
  274   HH21  ARG  38          1HH2      ARG  38  20.580 -11.995   0.489
  275   HH22  ARG  38          2HH2      ARG  38  21.871 -12.751   1.391
  276    H    SER  39           H        SER  39  18.559 -14.395  -6.158
  277    HA   SER  39           HA       SER  39  17.049 -16.871  -5.913
  278    HB2  SER  39           HB2      SER  39  16.133 -14.530  -5.913
  279    HB3  SER  39           HB3      SER  39  16.464 -14.441  -7.653
  280    HG   SER  39           HG       SER  39  14.288 -15.116  -7.138
  281    H    ILE  40           H        ILE  40  18.930 -15.348  -8.553
  282    HA   ILE  40           HA       ILE  40  17.979 -17.227 -10.575
  283    HB   ILE  40           HB       ILE  40  20.240 -15.197 -10.669
  284   HG12  ILE  40          2HG1      ILE  40  17.391 -15.126 -11.790
  285   HG13  ILE  40          3HG1      ILE  40  17.907 -14.279 -10.329
  286   HG21  ILE  40          1HG2      ILE  40  20.144 -15.531 -13.129
  287   HG22  ILE  40          2HG2      ILE  40  20.613 -17.008 -12.311
  288   HG23  ILE  40          3HG2      ILE  40  18.949 -16.826 -12.913
  289   HD11  ILE  40          3HD1      ILE  40  17.855 -12.674 -12.050
  290   HD12  ILE  40          1HD1      ILE  40  19.555 -12.982 -11.695
  291   HD13  ILE  40          2HD1      ILE  40  18.803 -13.675 -13.150
  292    H    ILE  41           H        ILE  41  20.965 -17.002  -8.575
  293    HA   ILE  41           HA       ILE  41  22.053 -19.394  -9.779
  294    HB   ILE  41           HB       ILE  41  23.463 -17.705  -8.661
  295   HG12  ILE  41          2HG1      ILE  41  25.070 -19.212  -7.663
  296   HG13  ILE  41          3HG1      ILE  41  23.864 -20.478  -7.457
  297   HG21  ILE  41          1HG2      ILE  41  22.134 -17.264  -6.641
  298   HG22  ILE  41          2HG2      ILE  41  22.504 -18.891  -6.035
  299   HG23  ILE  41          3HG2      ILE  41  23.800 -17.710  -6.260
  300   HD11  ILE  41          3HD1      ILE  41  25.442 -20.791  -9.412
  301   HD12  ILE  41          1HD1      ILE  41  23.736 -20.800  -9.871
  302   HD13  ILE  41          2HD1      ILE  41  24.742 -19.351 -10.155
  303    H    LEU  42           H        LEU  42  20.047 -18.998  -6.795
  304    HA   LEU  42           HA       LEU  42  20.155 -21.831  -6.266
  305    HB2  LEU  42           HB2      LEU  42  18.692 -21.527  -4.505
  306    HB3  LEU  42           HB3      LEU  42  19.692 -20.094  -4.572
  307    HG   LEU  42           HG       LEU  42  17.677 -18.984  -5.797
  308   HD11  LEU  42          1HD1      LEU  42  15.451 -19.855  -5.080
  309   HD12  LEU  42          2HD1      LEU  42  16.239 -21.336  -4.471
  310   HD13  LEU  42          3HD1      LEU  42  16.225 -20.960  -6.199
  311   HD21  LEU  42          3HD2      LEU  42  16.682 -18.374  -3.633
  312   HD22  LEU  42          1HD2      LEU  42  18.446 -18.445  -3.503
  313   HD23  LEU  42          2HD2      LEU  42  17.454 -19.780  -2.869
  314    H    ARG  43           H        ARG  43  17.988 -19.894  -8.302
  315    HA   ARG  43           HA       ARG  43  16.142 -22.005  -8.928
  316    HB2  ARG  43           HB2      ARG  43  15.730 -19.614  -9.428
  317    HB3  ARG  43           HB3      ARG  43  17.033 -19.637 -10.621
  318    HG2  ARG  43           HG2      ARG  43  15.703 -21.459 -11.854
  319    HG3  ARG  43           HG3      ARG  43  14.391 -21.146 -10.695
  320    HD2  ARG  43           HD2      ARG  43  14.446 -18.733 -11.429
  321    HD3  ARG  43           HD3      ARG  43  15.690 -19.170 -12.623
  322    HE   ARG  43           HE       ARG  43  13.598 -20.930 -13.109
  323   HH11  ARG  43          1HH1      ARG  43  13.825 -17.392 -13.107
  324   HH12  ARG  43          2HH1      ARG  43  12.552 -17.225 -14.283
  325   HH21  ARG  43          1HH2      ARG  43  11.986 -20.639 -14.620
  326   HH22  ARG  43          2HH2      ARG  43  11.540 -19.038 -15.140
  327    H    HIS  44           H        HIS  44  19.213 -20.929 -10.571
  328    HA   HIS  44           HA       HIS  44  19.007 -23.041 -12.502
  329    HB2  HIS  44           HB2      HIS  44  20.379 -20.924 -12.722
  330    HB3  HIS  44           HB3      HIS  44  21.605 -21.695 -11.708
  331    HD1  HIS  44           HD1      HIS  44  23.006 -23.706 -12.910
  332    HD2  HIS  44           HD2      HIS  44  19.710 -22.221 -15.075
  333    HE1  HIS  44           HE1      HIS  44  23.038 -24.874 -15.163
  334    H    LEU  45           H        LEU  45  20.647 -22.977  -9.288
  335    HA   LEU  45           HA       LEU  45  21.853 -25.536  -9.413
  336    HB2  LEU  45           HB2      LEU  45  20.754 -23.811  -7.194
  337    HB3  LEU  45           HB3      LEU  45  21.341 -25.421  -6.837
  338    HG   LEU  45           HG       LEU  45  23.062 -23.384  -8.310
  339   HD11  LEU  45          1HD1      LEU  45  22.964 -23.998  -5.325
  340   HD12  LEU  45          2HD1      LEU  45  22.433 -22.478  -6.081
  341   HD13  LEU  45          3HD1      LEU  45  24.143 -22.949  -6.122
  342   HD21  LEU  45          3HD2      LEU  45  24.889 -24.870  -7.398
  343   HD22  LEU  45          1HD2      LEU  45  23.848 -25.679  -8.570
  344   HD23  LEU  45          2HD2      LEU  45  23.647 -25.993  -6.834
  345    H    LEU  46           H        LEU  46  18.446 -24.725  -8.802
  346    HA   LEU  46           HA       LEU  46  17.556 -27.397  -8.195
  347    HB2  LEU  46           HB2      LEU  46  16.456 -24.944  -8.047
  348    HB3  LEU  46           HB3      LEU  46  15.830 -25.370  -9.638
  349    HG   LEU  46           HG       LEU  46  15.388 -26.924  -7.052
  350   HD11  LEU  46          1HD1      LEU  46  13.099 -26.019  -7.176
  351   HD12  LEU  46          2HD1      LEU  46  13.525 -25.102  -8.633
  352   HD13  LEU  46          3HD1      LEU  46  14.296 -24.711  -7.078
  353   HD21  LEU  46          3HD2      LEU  46  14.205 -27.355  -9.831
  354   HD22  LEU  46          1HD2      LEU  46  13.565 -28.081  -8.337
  355   HD23  LEU  46          2HD2      LEU  46  15.183 -28.508  -8.875
  356    H    ASN  47           H        ASN  47  17.904 -25.603 -11.282
  357    HA   ASN  47           HA       ASN  47  16.899 -27.692 -12.986
  358    HB2  ASN  47           HB2      ASN  47  16.928 -25.344 -13.655
  359    HB3  ASN  47           HB3      ASN  47  18.676 -25.282 -13.540
  360   HD21  ASN  47          1HD2      ASN  47  19.682 -25.317 -15.529
  361   HD22  ASN  47          2HD2      ASN  47  19.097 -26.257 -16.893
  362    H    SER  48           H        SER  48  20.277 -26.812 -12.075
  363    HA   SER  48           HA       SER  48  21.246 -29.541 -12.485
  364    HB2  SER  48           HB2      SER  48  21.876 -27.340 -14.452
  365    HB3  SER  48           HB3      SER  48  23.080 -28.582 -14.107
  366    HG   SER  48           HG       SER  48  20.402 -29.184 -14.924
  367    HA   PRO  49           HA       PRO  49  24.159 -27.930  -9.500
  368    HB2  PRO  49           HB2      PRO  49  26.055 -29.864  -9.392
  369    HB3  PRO  49           HB3      PRO  49  24.347 -30.199  -8.980
  370    HG2  PRO  49           HG2      PRO  49  25.704 -30.650 -11.668
  371    HG3  PRO  49           HG3      PRO  49  24.784 -31.844 -10.693
  372    HD2  PRO  49           HD2      PRO  49  23.634 -30.410 -12.700
  373    HD3  PRO  49           HD3      PRO  49  22.735 -30.814 -11.210
  374    H    THR  50           H        THR  50  24.330 -26.368 -11.688
  375    HA   THR  50           HA       THR  50  27.194 -25.839 -12.128
  376    HB   THR  50           HB       THR  50  26.624 -25.432 -14.600
  377    HG1  THR  50           HG1      THR  50  24.922 -26.763 -15.370
  378   HG21  THR  50          1HG2      THR  50  26.590 -28.330 -13.668
  379   HG22  THR  50          2HG2      THR  50  28.036 -27.305 -13.878
  380   HG23  THR  50          3HG2      THR  50  27.040 -27.710 -15.282
  381    H    ASP  51           H        ASP  51  27.659 -23.875 -13.047
  382    HA   ASP  51           HA       ASP  51  26.194 -21.574 -12.161
  383    HB2  ASP  51           HB2      ASP  51  28.630 -21.794 -12.354
  384    HB3  ASP  51           HB3      ASP  51  28.512 -21.980 -14.097
  385    HA   PRO  52           HA       PRO  52  23.324 -21.389 -15.622
  386    HB2  PRO  52           HB2      PRO  52  22.552 -18.674 -15.366
  387    HB3  PRO  52           HB3      PRO  52  21.835 -20.080 -14.518
  388    HG2  PRO  52           HG2      PRO  52  23.882 -18.106 -13.568
  389    HG3  PRO  52           HG3      PRO  52  22.567 -18.888 -12.634
  390    HD2  PRO  52           HD2      PRO  52  25.177 -19.659 -12.478
  391    HD3  PRO  52           HD3      PRO  52  23.847 -20.837 -12.323
  392    H    PHE  53           H        PHE  53  26.048 -19.143 -15.475
  393    HA   PHE  53           HA       PHE  53  25.636 -18.348 -18.336
  394    HB2  PHE  53           HB2      PHE  53  27.313 -17.094 -16.127
  395    HB3  PHE  53           HB3      PHE  53  27.124 -16.462 -17.754
  396    HD1  PHE  53           HD2      PHE  53  24.907 -15.492 -18.492
  397    HD2  PHE  53           HD1      PHE  53  25.645 -16.730 -14.434
  398    HE1  PHE  53           HE2      PHE  53  22.967 -14.131 -17.724
  399    HE2  PHE  53           HE1      PHE  53  23.687 -15.382 -13.673
  400    HZ   PHE  53           HZ       PHE  53  22.386 -14.075 -15.304
  401    H    ASN  54           H        ASN  54  28.050 -19.662 -16.043
  402    HA   ASN  54           HA       ASN  54  30.101 -19.735 -18.199
  403    HB2  ASN  54           HB2      ASN  54  30.355 -20.142 -15.200
  404    HB3  ASN  54           HB3      ASN  54  31.684 -20.034 -16.335
  405   HD21  ASN  54          1HD2      ASN  54  29.737 -18.199 -14.216
  406   HD22  ASN  54          2HD2      ASN  54  30.183 -16.614 -14.839
  407    H    ARG  55           H        ARG  55  28.024 -21.922 -16.484
  408    HA   ARG  55           HA       ARG  55  27.697 -24.101 -16.483
  409    HB2  ARG  55           HB2      ARG  55  29.476 -24.252 -18.959
  410    HB3  ARG  55           HB3      ARG  55  28.282 -25.434 -18.450
  411    HG2  ARG  55           HG2      ARG  55  27.700 -22.602 -19.398
  412    HG3  ARG  55           HG3      ARG  55  27.403 -24.103 -20.276
  413    HD2  ARG  55           HD2      ARG  55  25.811 -24.831 -18.492
  414    HD3  ARG  55           HD3      ARG  55  26.072 -23.282 -17.665
  415    HE   ARG  55           HE       ARG  55  25.254 -22.874 -20.394
  416   HH11  ARG  55          1HH1      ARG  55  24.045 -23.578 -17.175
  417   HH12  ARG  55          2HH1      ARG  55  22.410 -23.119 -17.545
  418   HH21  ARG  55          1HH2      ARG  55  23.134 -22.203 -20.835
  419   HH22  ARG  55          2HH2      ARG  55  21.923 -22.257 -19.582
  420    H    GLN  56           H        GLN  56  30.324 -23.035 -15.247
  421    HA   GLN  56           HA       GLN  56  31.933 -25.420 -14.755
  422    HB2  GLN  56           HB2      GLN  56  32.844 -24.128 -12.888
  423    HB3  GLN  56           HB3      GLN  56  32.846 -23.168 -14.368
  424    HG2  GLN  56           HG2      GLN  56  30.814 -21.979 -13.603
  425    HG3  GLN  56           HG3      GLN  56  30.797 -22.921 -12.111
  426   HE21  GLN  56          1HE2      GLN  56  30.837 -20.043 -12.199
  427   HE22  GLN  56          2HE2      GLN  56  32.380 -19.561 -11.501
  428    H    MET  57           H        MET  57  31.868 -26.745 -12.850
  429    HA   MET  57           HA       MET  57  29.244 -27.406 -11.840
  430    HB2  MET  57           HB2      MET  57  32.026 -28.161 -10.858
  431    HB3  MET  57           HB3      MET  57  30.519 -28.841 -10.233
  432    HG2  MET  57           HG2      MET  57  31.503 -29.051 -13.107
  433    HG3  MET  57           HG3      MET  57  31.607 -30.313 -11.896
  434    HE1  MET  57           HE1      MET  57  28.677 -30.213 -10.445
  435    HE2  MET  57           HE2      MET  57  27.939 -31.496 -11.419
  436    HE3  MET  57           HE3      MET  57  29.631 -31.648 -10.903
  437    H    LEU  58           H        LEU  58  28.245 -26.926  -9.944
  438    HA   LEU  58           HA       LEU  58  29.450 -25.007  -8.050
  439    HB2  LEU  58           HB2      LEU  58  28.580 -23.862 -10.184
  440    HB3  LEU  58           HB3      LEU  58  26.966 -24.336  -9.713
  441    HG   LEU  58           HG       LEU  58  27.698 -21.968  -9.331
  442   HD11  LEU  58          1HD1      LEU  58  26.523 -21.639  -7.265
  443   HD12  LEU  58          2HD1      LEU  58  26.725 -23.324  -6.799
  444   HD13  LEU  58          3HD1      LEU  58  25.725 -22.897  -8.208
  445   HD21  LEU  58          3HD2      LEU  58  29.267 -23.045  -6.961
  446   HD22  LEU  58          1HD2      LEU  58  29.026 -21.350  -7.413
  447   HD23  LEU  58          2HD2      LEU  58  29.975 -22.412  -8.471
  448    H    THR  59           H        THR  59  28.480 -25.016  -6.048
  449    HA   THR  59           HA       THR  59  26.065 -26.707  -5.547
  450    HB   THR  59           HB       THR  59  28.645 -26.858  -3.931
  451    HG1  THR  59           HG1      THR  59  28.873 -27.861  -5.959
  452   HG21  THR  59          1HG2      THR  59  26.680 -27.465  -2.568
  453   HG22  THR  59          2HG2      THR  59  27.587 -28.908  -2.986
  454   HG23  THR  59          3HG2      THR  59  26.089 -28.539  -3.858
  455    H    GLU  60           H        GLU  60  24.914 -26.130  -3.641
  456    HA   GLU  60           HA       GLU  60  24.623 -23.415  -3.027
  457    HB2  GLU  60           HB2      GLU  60  23.953 -25.876  -1.357
  458    HB3  GLU  60           HB3      GLU  60  23.393 -24.243  -0.986
  459    HG2  GLU  60           HG2      GLU  60  22.185 -24.113  -3.109
  460    HG3  GLU  60           HG3      GLU  60  22.732 -25.736  -3.549
  461    H    SER  61           H        SER  61  26.825 -25.748  -1.481
  462    HA   SER  61           HA       SER  61  27.470 -24.165   0.840
  463    HB2  SER  61           HB2      SER  61  29.329 -25.824   1.034
  464    HB3  SER  61           HB3      SER  61  27.727 -26.550   0.883
  465    HG   SER  61           HG       SER  61  29.322 -27.578  -0.467
  466    H    MET  62           H        MET  62  28.422 -23.824  -2.445
  467    HA   MET  62           HA       MET  62  31.028 -22.553  -1.868
  468    HB2  MET  62           HB2      MET  62  29.538 -22.867  -4.506
  469    HB3  MET  62           HB3      MET  62  31.223 -22.382  -4.283
  470    HG2  MET  62           HG2      MET  62  31.791 -24.572  -3.342
  471    HG3  MET  62           HG3      MET  62  30.111 -25.096  -3.468
  472    HE1  MET  62           HE1      MET  62  31.958 -27.297  -6.109
  473    HE2  MET  62           HE2      MET  62  32.644 -26.693  -4.590
  474    HE3  MET  62           HE3      MET  62  30.964 -27.291  -4.630
  475    H    LEU  63           H        LEU  63  27.846 -21.509  -1.746
  476    HA   LEU  63           HA       LEU  63  28.220 -18.829  -2.918
  477    HB2  LEU  63           HB2      LEU  63  25.860 -20.108  -1.483
  478    HB3  LEU  63           HB3      LEU  63  25.835 -18.571  -2.319
  479    HG   LEU  63           HG       LEU  63  26.255 -21.306  -3.614
  480   HD11  LEU  63          1HD1      LEU  63  24.063 -20.875  -4.645
  481   HD12  LEU  63          2HD1      LEU  63  23.929 -19.336  -3.767
  482   HD13  LEU  63          3HD1      LEU  63  23.938 -20.883  -2.874
  483   HD21  LEU  63          3HD2      LEU  63  27.535 -19.662  -4.899
  484   HD22  LEU  63          1HD2      LEU  63  26.148 -18.543  -4.888
  485   HD23  LEU  63          2HD2      LEU  63  26.048 -20.075  -5.761
  486    H    GLU  64           H        GLU  64  28.027 -16.900  -1.818
  487    HA   GLU  64           HA       GLU  64  27.598 -16.746   1.056
  488    HB2  GLU  64           HB2      GLU  64  29.988 -17.239   1.034
  489    HB3  GLU  64           HB3      GLU  64  30.288 -15.956  -0.142
  490    HG2  GLU  64           HG2      GLU  64  29.621 -14.255   1.499
  491    HG3  GLU  64           HG3      GLU  64  29.147 -15.509   2.649
  492    HA   PRO  65           HA       PRO  65  25.840 -13.074  -0.848
  493    HB2  PRO  65           HB2      PRO  65  24.911 -11.692   1.325
  494    HB3  PRO  65           HB3      PRO  65  24.138 -13.170   0.681
  495    HG2  PRO  65           HG2      PRO  65  26.119 -12.959   2.982
  496    HG3  PRO  65           HG3      PRO  65  24.552 -13.836   2.949
  497    HD2  PRO  65           HD2      PRO  65  26.911 -15.113   2.501
  498    HD3  PRO  65           HD3      PRO  65  25.448 -15.558   1.575
  499    H    VAL  66           H        VAL  66  26.512 -11.038  -1.406
  500    HA   VAL  66           HA       VAL  66  29.189 -10.237  -0.457
  501    HB   VAL  66           HB       VAL  66  27.545  -9.046  -2.708
  502   HG11  VAL  66          1HG1      VAL  66  29.218  -7.445  -1.903
  503   HG12  VAL  66          2HG1      VAL  66  30.469  -8.703  -1.916
  504   HG13  VAL  66          3HG1      VAL  66  29.755  -8.119  -3.440
  505   HG21  VAL  66          3HG2      VAL  66  28.138 -11.403  -3.185
  506   HG22  VAL  66          1HG2      VAL  66  29.048 -10.292  -4.210
  507   HG23  VAL  66          2HG2      VAL  66  29.833 -11.043  -2.793
  508    HA   PRO  67           HA       PRO  67  26.954  -7.217   2.125
  509    HB2  PRO  67           HB2      PRO  67  28.975  -6.463   3.801
  510    HB3  PRO  67           HB3      PRO  67  28.191  -8.069   3.904
  511    HG2  PRO  67           HG2      PRO  67  30.797  -7.358   2.522
  512    HG3  PRO  67           HG3      PRO  67  30.480  -8.710   3.649
  513    HD2  PRO  67           HD2      PRO  67  30.430  -9.013   0.912
  514    HD3  PRO  67           HD3      PRO  67  29.354  -9.935   2.005
  515    H    GLU  68           H        GLU  68  30.141  -6.430   0.635
  516    HA   GLU  68           HA       GLU  68  29.891  -3.628   0.929
  517    HB2  GLU  68           HB2      GLU  68  31.805  -3.476  -0.550
  518    HB3  GLU  68           HB3      GLU  68  32.027  -4.745   0.643
  519    HG2  GLU  68           HG2      GLU  68  31.479  -6.475  -1.055
  520    HG3  GLU  68           HG3      GLU  68  31.203  -5.218  -2.265
  521    H    LEU  69           H        LEU  69  28.430  -5.716  -1.434
  522    HA   LEU  69           HA       LEU  69  27.587  -3.377  -3.098
  523    HB2  LEU  69           HB2      LEU  69  27.307  -6.385  -3.444
  524    HB3  LEU  69           HB3      LEU  69  26.491  -5.202  -4.483
  525    HG   LEU  69           HG       LEU  69  29.512  -5.431  -4.163
  526   HD11  LEU  69          1HD1      LEU  69  29.441  -6.384  -6.440
  527   HD12  LEU  69          2HD1      LEU  69  27.666  -6.286  -6.443
  528   HD13  LEU  69          3HD1      LEU  69  28.496  -7.372  -5.317
  529   HD21  LEU  69          3HD2      LEU  69  29.567  -3.938  -6.174
  530   HD22  LEU  69          1HD2      LEU  69  28.911  -3.122  -4.756
  531   HD23  LEU  69          2HD2      LEU  69  27.810  -3.710  -6.024
  532    H    LYS  70           H        LYS  70  26.117  -5.959  -1.035
  533    HA   LYS  70           HA       LYS  70  23.458  -5.048  -1.434
  534    HB2  LYS  70           HB2      LYS  70  24.140  -7.259  -0.499
  535    HB3  LYS  70           HB3      LYS  70  24.578  -6.466   1.028
  536    HG2  LYS  70           HG2      LYS  70  22.241  -5.684   1.296
  537    HG3  LYS  70           HG3      LYS  70  21.819  -6.382  -0.272
  538    HD2  LYS  70           HD2      LYS  70  22.303  -8.663   0.599
  539    HD3  LYS  70           HD3      LYS  70  22.792  -7.954   2.151
  540    HE2  LYS  70           HE2      LYS  70  20.555  -8.637   2.511
  541    HE3  LYS  70           HE3      LYS  70  20.487  -6.887   2.291
  542    HZ1  LYS  70           HZ1      LYS  70  18.760  -7.859   1.004
  543    HZ2  LYS  70           HZ2      LYS  70  19.728  -8.985   0.339
  544    HZ3  LYS  70           HZ3      LYS  70  19.881  -7.411  -0.117
  545    H    GLU  71           H        GLU  71  25.822  -4.010   1.032
  546    HA   GLU  71           HA       GLU  71  24.061  -2.218   2.432
  547    HB2  GLU  71           HB2      GLU  71  26.204  -3.173   3.288
  548    HB3  GLU  71           HB3      GLU  71  27.097  -2.115   2.183
  549    HG2  GLU  71           HG2      GLU  71  26.184  -0.132   3.333
  550    HG3  GLU  71           HG3      GLU  71  25.161  -1.159   4.351
  551    H    GLN  72           H        GLN  72  26.096  -1.764  -0.463
  552    HA   GLN  72           HA       GLN  72  25.573   1.123  -0.647
  553    HB2  GLN  72           HB2      GLN  72  26.751  -0.899  -2.604
  554    HB3  GLN  72           HB3      GLN  72  26.464   0.805  -2.997
  555    HG2  GLN  72           HG2      GLN  72  27.869   1.472  -1.024
  556    HG3  GLN  72           HG3      GLN  72  28.260  -0.225  -0.777
  557   HE21  GLN  72          1HE2      GLN  72  29.618  -1.298  -2.408
  558   HE22  GLN  72          2HE2      GLN  72  30.566  -0.336  -3.550
  559    H    ILE  73           H        ILE  73  24.177  -1.791  -2.190
  560    HA   ILE  73           HA       ILE  73  22.301  -0.479  -3.871
  561    HB   ILE  73           HB       ILE  73  22.324  -3.202  -2.516
  562   HG12  ILE  73          2HG1      ILE  73  22.552  -2.444  -5.462
  563   HG13  ILE  73          3HG1      ILE  73  23.942  -2.580  -4.405
  564   HG21  ILE  73          1HG2      ILE  73  19.961  -2.752  -2.773
  565   HG22  ILE  73          2HG2      ILE  73  20.198  -2.083  -4.398
  566   HG23  ILE  73          3HG2      ILE  73  20.430  -3.814  -4.082
  567   HD11  ILE  73          3HD1      ILE  73  22.058  -4.857  -5.149
  568   HD12  ILE  73          1HD1      ILE  73  23.734  -4.635  -5.651
  569   HD13  ILE  73          2HD1      ILE  73  23.369  -4.983  -3.955
  570    H    GLN  74           H        GLN  74  21.759  -1.618  -0.489
  571    HA   GLN  74           HA       GLN  74  19.069  -0.641  -0.424
  572    HB2  GLN  74           HB2      GLN  74  19.091  -1.155   1.940
  573    HB3  GLN  74           HB3      GLN  74  19.889  -2.422   1.015
  574    HG2  GLN  74           HG2      GLN  74  21.322  -2.238   2.813
  575    HG3  GLN  74           HG3      GLN  74  22.109  -1.230   1.645
  576   HE21  GLN  74          1HE2      GLN  74  23.087   0.431   2.778
  577   HE22  GLN  74          2HE2      GLN  74  22.293   1.345   4.065
  578    H    ALA  75           H        ALA  75  22.108   1.020   0.331
  579    HA   ALA  75           HA       ALA  75  20.873   3.418   1.416
  580    HB1  ALA  75           HB1      ALA  75  23.243   2.806   1.844
  581    HB2  ALA  75           HB2      ALA  75  23.597   2.945   0.109
  582    HB3  ALA  75           HB3      ALA  75  23.129   4.381   1.047
  583    H    TRP  76           H        TRP  76  21.968   2.452  -1.867
  584    HA   TRP  76           HA       TRP  76  21.299   4.916  -3.161
  585    HB2  TRP  76           HB2      TRP  76  22.848   3.191  -4.039
  586    HB3  TRP  76           HB3      TRP  76  21.494   2.102  -4.279
  587    HD1  TRP  76           HD1      TRP  76  23.022   5.328  -5.641
  588    HE1  TRP  76           HE1      TRP  76  22.125   5.807  -7.996
  589    HE3  TRP  76           HE3      TRP  76  19.522   1.620  -5.921
  590    HZ2  TRP  76           HZ2      TRP  76  20.114   4.723  -9.769
  591    HZ3  TRP  76           HZ3      TRP  76  18.120   1.366  -7.959
  592    HH2  TRP  76           HH2      TRP  76  18.399   2.911  -9.877
  593    H    MET  77           H        MET  77  19.388   1.861  -2.827
  594    HA   MET  77           HA       MET  77  17.027   2.746  -4.164
  595    HB2  MET  77           HB2      MET  77  17.432   0.817  -1.845
  596    HB3  MET  77           HB3      MET  77  15.882   1.051  -2.663
  597    HG2  MET  77           HG2      MET  77  16.811   0.297  -4.791
  598    HG3  MET  77           HG3      MET  77  18.428   0.218  -4.102
  599    HE1  MET  77           HE1      MET  77  14.999  -1.485  -4.496
  600    HE2  MET  77           HE2      MET  77  15.006  -2.774  -3.273
  601    HE3  MET  77           HE3      MET  77  14.881  -1.075  -2.772
  602    H    ARG  78           H        ARG  78  18.070   3.328  -0.797
  603    HA   ARG  78           HA       ARG  78  15.649   4.684   0.032
  604    HB2  ARG  78           HB2      ARG  78  17.313   3.655   1.553
  605    HB3  ARG  78           HB3      ARG  78  18.471   4.934   1.134
  606    HG2  ARG  78           HG2      ARG  78  16.956   6.634   2.069
  607    HG3  ARG  78           HG3      ARG  78  15.745   5.376   2.416
  608    HD2  ARG  78           HD2      ARG  78  17.378   4.268   3.960
  609    HD3  ARG  78           HD3      ARG  78  18.575   5.507   3.580
  610    HE   ARG  78           HE       ARG  78  17.492   7.050   4.906
  611   HH11  ARG  78          1HH1      ARG  78  15.362   4.235   4.666
  612   HH12  ARG  78          2HH1      ARG  78  14.349   4.789   5.972
  613   HH21  ARG  78          1HH2      ARG  78  16.168   7.685   6.575
  614   HH22  ARG  78          2HH2      ARG  78  14.791   6.719   7.019
  615    H    GLU  79           H        GLU  79  18.796   5.931  -1.205
  616    HA   GLU  79           HA       GLU  79  18.111   8.688  -1.128
  617    HB2  GLU  79           HB2      GLU  79  20.403   7.720  -1.335
  618    HB3  GLU  79           HB3      GLU  79  20.048   7.264  -3.005
  619    HG2  GLU  79           HG2      GLU  79  19.792   9.629  -3.617
  620    HG3  GLU  79           HG3      GLU  79  19.964  10.121  -1.930
  621    H    LYS  80           H        LYS  80  17.651   6.302  -3.778
  622    HA   LYS  80           HA       LYS  80  16.582   8.136  -5.701
  623    HB2  LYS  80           HB2      LYS  80  16.247   5.149  -5.243
  624    HB3  LYS  80           HB3      LYS  80  15.560   5.964  -6.632
  625    HG2  LYS  80           HG2      LYS  80  18.519   5.764  -5.985
  626    HG3  LYS  80           HG3      LYS  80  17.661   4.844  -7.196
  627    HD2  LYS  80           HD2      LYS  80  18.134   7.854  -7.241
  628    HD3  LYS  80           HD3      LYS  80  18.996   6.643  -8.174
  629    HE2  LYS  80           HE2      LYS  80  16.898   5.979  -9.315
  630    HE3  LYS  80           HE3      LYS  80  16.012   7.215  -8.409
  631    HZ1  LYS  80           HZ1      LYS  80  16.656   8.036 -10.595
  632    HZ2  LYS  80           HZ2      LYS  80  18.239   7.736 -10.305
  633    HZ3  LYS  80           HZ3      LYS  80  17.443   8.891  -9.452
  634    H    GLN  81           H        GLN  81  14.999   6.676  -2.908
  635    HA   GLN  81           HA       GLN  81  12.291   7.473  -3.758
  636    HB2  GLN  81           HB2      GLN  81  13.476   6.518  -1.122
  637    HB3  GLN  81           HB3      GLN  81  11.786   7.001  -1.310
  638    HG2  GLN  81           HG2      GLN  81  11.307   5.250  -2.866
  639    HG3  GLN  81           HG3      GLN  81  13.008   4.859  -3.088
  640   HE21  GLN  81          1HE2      GLN  81  14.022   3.450  -1.631
  641   HE22  GLN  81          2HE2      GLN  81  13.151   2.685  -0.292
  642    H    SER  82           H        SER  82  14.865   8.986  -1.730
  643    HA   SER  82           HA       SER  82  13.263  11.290  -1.008
  644    HB2  SER  82           HB2      SER  82  16.279  10.970  -1.174
  645    HB3  SER  82           HB3      SER  82  15.406  12.277  -0.360
  646    HG   SER  82           HG       SER  82  16.054  10.614   1.115
  647    H    SER  83           H        SER  83  14.908  10.442  -3.946
  648    HA   SER  83           HA       SER  83  15.405  13.095  -4.994
  649    HB2  SER  83           HB2      SER  83  15.085  10.419  -6.400
  650    HB3  SER  83           HB3      SER  83  15.703  11.903  -7.140
  651    HG   SER  83           HG       SER  83  16.889  10.589  -4.858
  652    H    ASP  84           H        ASP  84  12.427  11.444  -4.630
  653    HA   ASP  84           HA       ASP  84  11.073  13.323  -6.535
  654    HB2  ASP  84           HB2      ASP  84  10.719  10.975  -7.178
  655    HB3  ASP  84           HB3      ASP  84  10.146  10.594  -5.547
  656    H    HIS  85           H        HIS  85   9.741  14.775  -5.660
  657    HA   HIS  85           HA       HIS  85   8.425  14.679  -3.105
  658    HB2  HIS  85           HB2      HIS  85   9.837  16.451  -2.002
  659    HB3  HIS  85           HB3      HIS  85  10.546  14.852  -2.070
  660    HD1  HIS  85           HD1      HIS  85  12.949  14.699  -3.171
  661    HD2  HIS  85           HD2      HIS  85  10.867  18.308  -3.881
  662    HE1  HIS  85           HE1      HIS  85  14.585  16.253  -4.346
  Start of MODEL   15
    1    H2   PRO   1           H2       PRO   1  -1.793  -2.102  -0.577
    2    H3   PRO   1           H3       PRO   1  -1.574  -0.916  -1.724
    3    HA   PRO   1           HA       PRO   1  -0.043   0.232  -0.459
    4    HB2  PRO   1           HB2      PRO   1  -0.494  -1.453   1.989
    5    HB3  PRO   1           HB3      PRO   1  -0.093   0.280   1.840
    6    HG2  PRO   1           HG2      PRO   1  -2.716  -0.997   2.000
    7    HG3  PRO   1           HG3      PRO   1  -2.402   0.758   1.868
    8    HD2  PRO   1           HD2      PRO   1  -3.608  -0.670  -0.158
    9    HD3  PRO   1           HD3      PRO   1  -2.553   0.739  -0.444
   10    H    GLY   2           H        GLY   2   2.721  -2.038  -0.746
   11    HA2  GLY   2           HA2      GLY   2   2.011   0.712  -0.080
   12    HA3  GLY   2           HA3      GLY   2   3.506   0.116  -0.825
   13    H    SER   3           H        SER   3   1.733  -1.208  -2.925
   14    HA   SER   3           HA       SER   3   0.600  -0.891  -4.862
   15    HB2  SER   3           HB2      SER   3  -0.057   1.908  -3.899
   16    HB3  SER   3           HB3      SER   3  -0.857   0.996  -5.180
   17    HG   SER   3           HG       SER   3  -2.034   0.882  -3.250
   18    H    ALA   4           H        ALA   4   3.395   0.825  -4.271
   19    HA   ALA   4           HA       ALA   4   3.908   1.292  -7.115
   20    HB1  ALA   4           HB1      ALA   4   4.454   3.695  -6.781
   21    HB2  ALA   4           HB2      ALA   4   2.738   3.374  -6.470
   22    HB3  ALA   4           HB3      ALA   4   3.864   3.600  -5.109
   23    H    GLU   5           H        GLU   5   6.139   2.023  -7.504
   24    HA   GLU   5           HA       GLU   5   8.190   1.852  -5.499
   25    HB2  GLU   5           HB2      GLU   5   9.310  -0.172  -6.230
   26    HB3  GLU   5           HB3      GLU   5   7.713  -0.536  -5.619
   27    HG2  GLU   5           HG2      GLU   5   6.868  -0.639  -8.003
   28    HG3  GLU   5           HG3      GLU   5   8.543  -0.429  -8.547
   29    H    ILE   6           H        ILE   6  10.402   1.925  -6.545
   30    HA   ILE   6           HA       ILE   6  10.331   3.953  -8.672
   31    HB   ILE   6           HB       ILE   6  12.680   2.763  -7.162
   32   HG12  ILE   6          2HG1      ILE   6  11.235   3.827  -5.522
   33   HG13  ILE   6          3HG1      ILE   6  12.692   4.768  -5.766
   34   HG21  ILE   6          1HG2      ILE   6  12.486   5.231  -8.937
   35   HG22  ILE   6          2HG2      ILE   6  13.834   4.911  -7.831
   36   HG23  ILE   6          3HG2      ILE   6  13.516   3.798  -9.152
   37   HD11  ILE   6          3HD1      ILE   6   9.949   5.430  -6.939
   38   HD12  ILE   6          1HD1      ILE   6  10.723   6.213  -5.551
   39   HD13  ILE   6          2HD1      ILE   6  11.429   6.399  -7.167
   40    H    ASP   7           H        ASP   7  11.171   3.821 -10.694
   41    HA   ASP   7           HA       ASP   7  11.621   1.179 -11.903
   42    HB2  ASP   7           HB2      ASP   7  10.252   2.890 -13.029
   43    HB3  ASP   7           HB3      ASP   7  11.615   3.994 -13.061
   44    H    TYR   8           H        TYR   8  13.537   0.420 -11.008
   45    HA   TYR   8           HA       TYR   8  15.921   2.026 -10.805
   46    HB2  TYR   8           HB2      TYR   8  15.515  -0.960 -10.413
   47    HB3  TYR   8           HB3      TYR   8  16.946  -0.061  -9.955
   48    HD1  TYR   8           HD2      TYR   8  16.384   2.190  -8.464
   49    HD2  TYR   8           HD1      TYR   8  14.106  -1.477  -8.596
   50    HE1  TYR   8           HE2      TYR   8  15.525   2.644  -6.179
   51    HE2  TYR   8           HE1      TYR   8  13.259  -1.023  -6.300
   52    HH   TYR   8           HH       TYR   8  14.188   1.906  -4.466
   53    H    SER   9           H        SER   9  14.868   1.379 -13.654
   54    HA   SER   9           HA       SER   9  17.010   0.034 -15.039
   55    HB2  SER   9           HB2      SER   9  15.066   2.166 -15.983
   56    HB3  SER   9           HB3      SER   9  16.131   1.214 -17.034
   57    HG   SER   9           HG       SER   9  13.963   0.339 -16.841
   58    H    ASP  10           H        ASP  10  17.046   3.022 -13.396
   59    HA   ASP  10           HA       ASP  10  19.248   4.281 -14.858
   60    HB2  ASP  10           HB2      ASP  10  17.437   5.501 -13.646
   61    HB3  ASP  10           HB3      ASP  10  18.018   4.823 -12.128
   62    H    ALA  11           H        ALA  11  19.122   1.619 -12.703
   63    HA   ALA  11           HA       ALA  11  21.327   2.136 -10.987
   64    HB1  ALA  11           HB1      ALA  11  21.233  -0.334 -10.594
   65    HB2  ALA  11           HB2      ALA  11  19.639   0.436 -10.503
   66    HB3  ALA  11           HB3      ALA  11  20.101  -0.491 -11.947
   67    HA   PRO  12           HA       PRO  12  24.890   1.338 -13.595
   68    HB2  PRO  12           HB2      PRO  12  26.779   0.601 -11.791
   69    HB3  PRO  12           HB3      PRO  12  26.120   2.261 -11.851
   70    HG2  PRO  12           HG2      PRO  12  25.259  -0.018 -10.032
   71    HG3  PRO  12           HG3      PRO  12  25.691   1.664  -9.562
   72    HD2  PRO  12           HD2      PRO  12  23.099   0.916  -9.942
   73    HD3  PRO  12           HD3      PRO  12  23.676   2.533 -10.437
   74    H    ASP  13           H        ASP  13  26.167  -0.399 -14.434
   75    HA   ASP  13           HA       ASP  13  24.796  -2.833 -14.775
   76    HB2  ASP  13           HB2      ASP  13  26.394  -1.806 -16.355
   77    HB3  ASP  13           HB3      ASP  13  27.730  -2.181 -15.260
   78    H    GLU  14           H        GLU  14  27.303  -2.037 -12.413
   79    HA   GLU  14           HA       GLU  14  27.881  -4.761 -11.645
   80    HB2  GLU  14           HB2      GLU  14  29.178  -3.824  -9.863
   81    HB3  GLU  14           HB3      GLU  14  29.470  -2.939 -11.361
   82    HG2  GLU  14           HG2      GLU  14  27.861  -1.149 -10.527
   83    HG3  GLU  14           HG3      GLU  14  27.805  -2.016  -8.992
   84    H    PHE  15           H        PHE  15  25.188  -2.726 -10.873
   85    HA   PHE  15           HA       PHE  15  24.441  -4.316  -8.466
   86    HB2  PHE  15           HB2      PHE  15  23.191  -1.902  -9.840
   87    HB3  PHE  15           HB3      PHE  15  22.453  -2.754  -8.512
   88    HD1  PHE  15           HD1      PHE  15  25.912  -2.733  -7.685
   89    HD2  PHE  15           HD2      PHE  15  22.421  -0.205  -7.908
   90    HE1  PHE  15           HE1      PHE  15  26.916  -1.208  -6.024
   91    HE2  PHE  15           HE2      PHE  15  23.458   1.336  -6.267
   92    HZ   PHE  15           HZ       PHE  15  25.703   0.844  -5.318
   93    H    ARG  16           H        ARG  16  24.192  -4.732 -11.792
   94    HA   ARG  16           HA       ARG  16  21.385  -5.747 -11.703
   95    HB2  ARG  16           HB2      ARG  16  23.012  -4.563 -13.973
   96    HB3  ARG  16           HB3      ARG  16  21.388  -5.240 -14.146
   97    HG2  ARG  16           HG2      ARG  16  20.406  -3.557 -12.726
   98    HG3  ARG  16           HG3      ARG  16  21.978  -3.025 -12.145
   99    HD2  ARG  16           HD2      ARG  16  21.379  -1.376 -13.599
  100    HD3  ARG  16           HD3      ARG  16  22.525  -2.329 -14.550
  101    HE   ARG  16           HE       ARG  16  20.195  -3.427 -15.355
  102   HH11  ARG  16          1HH1      ARG  16  20.990   0.016 -14.999
  103   HH12  ARG  16          2HH1      ARG  16  19.722   0.503 -16.088
  104   HH21  ARG  16          1HH2      ARG  16  18.719  -2.779 -16.801
  105   HH22  ARG  16          2HH2      ARG  16  18.538  -1.094 -17.234
  106    H    ASP  17           H        ASP  17  20.865  -7.726 -12.377
  107    HA   ASP  17           HA       ASP  17  22.993  -9.697 -12.744
  108    HB2  ASP  17           HB2      ASP  17  20.974 -10.056 -11.346
  109    HB3  ASP  17           HB3      ASP  17  19.981 -10.095 -12.804
  110    HA   PRO  18           HA       PRO  18  23.003  -9.583 -17.187
  111    HB2  PRO  18           HB2      PRO  18  23.572 -12.523 -17.235
  112    HB3  PRO  18           HB3      PRO  18  24.504 -11.183 -17.944
  113    HG2  PRO  18           HG2      PRO  18  25.261 -12.489 -15.659
  114    HG3  PRO  18           HG3      PRO  18  25.574 -10.731 -15.909
  115    HD2  PRO  18           HD2      PRO  18  23.475 -12.080 -14.262
  116    HD3  PRO  18           HD3      PRO  18  24.408 -10.586 -13.939
  117    H    LEU  19           H        LEU  19  21.152 -12.282 -15.719
  118    HA   LEU  19           HA       LEU  19  19.735 -12.963 -18.169
  119    HB2  LEU  19           HB2      LEU  19  20.113 -14.627 -16.424
  120    HB3  LEU  19           HB3      LEU  19  19.214 -13.659 -15.252
  121    HG   LEU  19           HG       LEU  19  17.138 -14.043 -16.521
  122   HD11  LEU  19          1HD1      LEU  19  18.845 -15.852 -18.301
  123   HD12  LEU  19          2HD1      LEU  19  18.042 -14.347 -18.808
  124   HD13  LEU  19          3HD1      LEU  19  17.078 -15.744 -18.324
  125   HD21  LEU  19          3HD2      LEU  19  17.727 -15.561 -14.704
  126   HD22  LEU  19          1HD2      LEU  19  18.672 -16.578 -15.821
  127   HD23  LEU  19          2HD2      LEU  19  16.907 -16.447 -15.995
  128    H    MET  20           H        MET  20  18.685 -11.280 -15.174
  129    HA   MET  20           HA       MET  20  16.142 -10.518 -16.495
  130    HB2  MET  20           HB2      MET  20  17.158 -10.250 -13.644
  131    HB3  MET  20           HB3      MET  20  15.605  -9.613 -14.181
  132    HG2  MET  20           HG2      MET  20  16.473 -12.516 -14.326
  133    HG3  MET  20           HG3      MET  20  15.364 -11.835 -13.146
  134    HE1  MET  20           HE1      MET  20  13.464  -9.926 -15.000
  135    HE2  MET  20           HE2      MET  20  12.154 -11.100 -15.240
  136    HE3  MET  20           HE3      MET  20  12.960 -10.986 -13.656
  137    H    ASP  21           H        ASP  21  19.161  -9.016 -16.218
  138    HA   ASP  21           HA       ASP  21  19.967  -7.090 -16.978
  139    HB2  ASP  21           HB2      ASP  21  18.338  -7.622 -18.841
  140    HB3  ASP  21           HB3      ASP  21  17.223  -6.471 -18.125
  141    H    THR  22           H        THR  22  18.222  -7.141 -14.371
  142    HA   THR  22           HA       THR  22  18.199  -4.205 -13.856
  143    HB   THR  22           HB       THR  22  15.956  -5.039 -14.630
  144    HG1  THR  22           HG1      THR  22  14.953  -3.819 -13.046
  145   HG21  THR  22          1HG2      THR  22  15.855  -6.347 -11.879
  146   HG22  THR  22          2HG2      THR  22  15.925  -7.221 -13.414
  147   HG23  THR  22          3HG2      THR  22  14.525  -6.206 -13.055
  148    H    LEU  23           H        LEU  23  17.540  -3.850 -11.501
  149    HA   LEU  23           HA       LEU  23  19.844  -4.468 -10.034
  150    HB2  LEU  23           HB2      LEU  23  17.942  -2.570  -9.913
  151    HB3  LEU  23           HB3      LEU  23  17.316  -3.588  -8.631
  152    HG   LEU  23           HG       LEU  23  20.003  -2.189  -8.791
  153   HD11  LEU  23          1HD1      LEU  23  19.187  -0.981  -6.818
  154   HD12  LEU  23          2HD1      LEU  23  17.684  -1.927  -6.830
  155   HD13  LEU  23          3HD1      LEU  23  18.052  -0.818  -8.164
  156   HD21  LEU  23          3HD2      LEU  23  19.059  -4.038  -6.557
  157   HD22  LEU  23          1HD2      LEU  23  20.496  -2.997  -6.515
  158   HD23  LEU  23          2HD2      LEU  23  20.440  -4.325  -7.647
  159    H    MET  24           H        MET  24  20.447  -6.271  -8.949
  160    HA   MET  24           HA       MET  24  18.653  -8.480  -8.620
  161    HB2  MET  24           HB2      MET  24  20.580  -9.572  -7.473
  162    HB3  MET  24           HB3      MET  24  20.898  -8.960  -9.099
  163    HG2  MET  24           HG2      MET  24  21.991  -6.951  -8.001
  164    HG3  MET  24           HG3      MET  24  21.824  -7.779  -6.463
  165    HE1  MET  24           HE1      MET  24  24.453  -6.767  -8.708
  166    HE2  MET  24           HE2      MET  24  24.430  -6.791  -6.936
  167    HE3  MET  24           HE3      MET  24  25.640  -7.736  -7.831
  168    H    THR  25           H        THR  25  19.575  -6.021  -6.364
  169    HA   THR  25           HA       THR  25  18.980  -5.419  -4.285
  170    HB   THR  25           HB       THR  25  16.902  -5.899  -3.334
  171    HG1  THR  25           HG1      THR  25  16.894  -8.125  -5.061
  172   HG21  THR  25          1HG2      THR  25  15.365  -5.318  -5.092
  173   HG22  THR  25          2HG2      THR  25  16.454  -5.925  -6.345
  174   HG23  THR  25          3HG2      THR  25  16.899  -4.488  -5.398
  175    H    ASP  26           H        ASP  26  19.350  -8.853  -4.658
  176    HA   ASP  26           HA       ASP  26  20.707  -9.043  -1.991
  177    HB2  ASP  26           HB2      ASP  26  18.762 -10.979  -3.285
  178    HB3  ASP  26           HB3      ASP  26  19.870 -11.420  -1.989
  179    HA   PRO  27           HA       PRO  27  23.602 -10.322  -5.356
  180    HB2  PRO  27           HB2      PRO  27  25.870  -9.154  -4.355
  181    HB3  PRO  27           HB3      PRO  27  24.639  -8.255  -5.265
  182    HG2  PRO  27           HG2      PRO  27  24.929  -8.447  -2.264
  183    HG3  PRO  27           HG3      PRO  27  24.707  -6.971  -3.270
  184    HD2  PRO  27           HD2      PRO  27  22.622  -8.147  -2.032
  185    HD3  PRO  27           HD3      PRO  27  22.433  -7.493  -3.694
  186    H    VAL  28           H        VAL  28  24.588 -12.252  -5.385
  187    HA   VAL  28           HA       VAL  28  25.881 -13.312  -2.888
  188    HB   VAL  28           HB       VAL  28  24.258 -14.954  -4.876
  189   HG11  VAL  28          1HG1      VAL  28  26.138 -16.238  -3.931
  190   HG12  VAL  28          2HG1      VAL  28  25.640 -15.779  -2.292
  191   HG13  VAL  28          3HG1      VAL  28  24.592 -16.804  -3.306
  192   HG21  VAL  28          3HG2      VAL  28  22.715 -15.329  -2.955
  193   HG22  VAL  28          1HG2      VAL  28  23.657 -14.181  -1.969
  194   HG23  VAL  28          2HG2      VAL  28  22.770 -13.624  -3.412
  195    H    ARG  29           H        ARG  29  27.867 -13.909  -3.115
  196    HA   ARG  29           HA       ARG  29  29.238 -13.704  -5.707
  197    HB2  ARG  29           HB2      ARG  29  29.974 -12.519  -3.617
  198    HB3  ARG  29           HB3      ARG  29  30.288 -14.085  -2.868
  199    HG2  ARG  29           HG2      ARG  29  31.945 -14.512  -4.770
  200    HG3  ARG  29           HG3      ARG  29  31.649 -12.869  -5.314
  201    HD2  ARG  29           HD2      ARG  29  33.676 -12.902  -3.970
  202    HD3  ARG  29           HD3      ARG  29  32.419 -12.015  -3.104
  203    HE   ARG  29           HE       ARG  29  32.537 -13.538  -1.401
  204   HH11  ARG  29          1HH1      ARG  29  33.851 -15.257  -4.220
  205   HH12  ARG  29          2HH1      ARG  29  34.516 -16.514  -3.212
  206   HH21  ARG  29          1HH2      ARG  29  33.237 -15.229  -0.249
  207   HH22  ARG  29          2HH2      ARG  29  34.128 -16.544  -1.003
  208    H    LEU  30           H        LEU  30  30.172 -15.324  -6.729
  209    HA   LEU  30           HA       LEU  30  29.849 -18.153  -5.884
  210    HB2  LEU  30           HB2      LEU  30  30.312 -16.659  -8.499
  211    HB3  LEU  30           HB3      LEU  30  30.691 -18.345  -8.407
  212    HG   LEU  30           HG       LEU  30  28.338 -18.819  -7.625
  213   HD11  LEU  30          1HD1      LEU  30  27.936 -15.902  -8.402
  214   HD12  LEU  30          2HD1      LEU  30  27.534 -16.662  -6.850
  215   HD13  LEU  30          3HD1      LEU  30  26.612 -17.077  -8.297
  216   HD21  LEU  30          3HD2      LEU  30  28.795 -17.578 -10.359
  217   HD22  LEU  30          1HD2      LEU  30  27.414 -18.601  -9.938
  218   HD23  LEU  30          2HD2      LEU  30  29.059 -19.266  -9.883
  219    HA   PRO  31           HA       PRO  31  34.110 -18.900  -5.019
  220    HB2  PRO  31           HB2      PRO  31  34.781 -21.197  -6.394
  221    HB3  PRO  31           HB3      PRO  31  33.738 -21.153  -4.934
  222    HG2  PRO  31           HG2      PRO  31  32.872 -21.182  -7.846
  223    HG3  PRO  31           HG3      PRO  31  32.287 -22.234  -6.528
  224    HD2  PRO  31           HD2      PRO  31  30.896 -20.057  -7.244
  225    HD3  PRO  31           HD3      PRO  31  31.086 -20.421  -5.510
  226    H    SER  32           H        SER  32  33.250 -18.511  -8.438
  227    HA   SER  32           HA       SER  32  35.936 -18.119  -9.453
  228    HB2  SER  32           HB2      SER  32  34.712 -17.219 -11.391
  229    HB3  SER  32           HB3      SER  32  34.046 -18.777 -10.862
  230    HG   SER  32           HG       SER  32  32.346 -17.338 -11.242
  231    H    GLY  33           H        GLY  33  33.994 -16.200  -7.396
  232    HA2  GLY  33           HA2      GLY  33  34.431 -14.063  -6.520
  233    HA3  GLY  33           HA3      GLY  33  35.569 -13.721  -7.850
  234    H    THR  34           H        THR  34  32.899 -14.926  -9.355
  235    HA   THR  34           HA       THR  34  31.899 -12.302 -10.215
  236    HB   THR  34           HB       THR  34  30.852 -15.089 -10.891
  237    HG1  THR  34           HG1      THR  34  32.930 -14.992 -11.604
  238   HG21  THR  34          1HG2      THR  34  29.240 -13.383 -11.542
  239   HG22  THR  34          2HG2      THR  34  30.075 -13.971 -12.977
  240   HG23  THR  34          3HG2      THR  34  30.531 -12.405 -12.295
  241    H    VAL  35           H        VAL  35  29.759 -11.516  -9.873
  242    HA   VAL  35           HA       VAL  35  28.331 -12.702  -7.519
  243    HB   VAL  35           HB       VAL  35  28.496  -9.766  -8.282
  244   HG11  VAL  35          1HG1      VAL  35  27.138 -11.181  -5.932
  245   HG12  VAL  35          2HG1      VAL  35  27.361  -9.428  -6.073
  246   HG13  VAL  35          3HG1      VAL  35  26.336 -10.267  -7.237
  247   HG21  VAL  35          3HG2      VAL  35  30.626 -10.581  -7.263
  248   HG22  VAL  35          1HG2      VAL  35  29.763  -9.494  -6.175
  249   HG23  VAL  35          2HG2      VAL  35  29.713 -11.254  -5.905
  250    H    MET  36           H        MET  36  26.295 -13.194  -7.732
  251    HA   MET  36           HA       MET  36  24.681 -12.359 -10.109
  252    HB2  MET  36           HB2      MET  36  25.519 -15.053  -9.224
  253    HB3  MET  36           HB3      MET  36  23.766 -14.905  -9.267
  254    HG2  MET  36           HG2      MET  36  24.464 -15.675 -11.412
  255    HG3  MET  36           HG3      MET  36  23.878 -14.031 -11.574
  256    HE1  MET  36           HE1      MET  36  28.168 -15.558 -12.199
  257    HE2  MET  36           HE2      MET  36  27.406 -15.673 -10.607
  258    HE3  MET  36           HE3      MET  36  26.706 -16.528 -12.002
  259    H    ASP  37           H        ASP  37  22.366 -12.617  -9.798
  260    HA   ASP  37           HA       ASP  37  21.256 -11.641  -7.323
  261    HB2  ASP  37           HB2      ASP  37  20.299 -11.268  -9.575
  262    HB3  ASP  37           HB3      ASP  37  20.068 -13.001  -9.778
  263    H    ARG  38           H        ARG  38  20.692 -12.688  -5.537
  264    HA   ARG  38           HA       ARG  38  21.193 -15.264  -4.768
  265    HB2  ARG  38           HB2      ARG  38  20.516 -13.485  -3.244
  266    HB3  ARG  38           HB3      ARG  38  18.898 -13.429  -3.946
  267    HG2  ARG  38           HG2      ARG  38  18.495 -15.752  -3.137
  268    HG3  ARG  38           HG3      ARG  38  20.112 -15.777  -2.400
  269    HD2  ARG  38           HD2      ARG  38  19.454 -13.974  -0.898
  270    HD3  ARG  38           HD3      ARG  38  17.903 -13.779  -1.736
  271    HE   ARG  38           HE       ARG  38  18.635 -15.850   0.209
  272   HH11  ARG  38          1HH1      ARG  38  16.276 -15.045  -2.328
  273   HH12  ARG  38          2HH1      ARG  38  15.089 -16.121  -1.666
  274   HH21  ARG  38          1HH2      ARG  38  17.060 -17.268   0.946
  275   HH22  ARG  38          2HH2      ARG  38  15.526 -17.364   0.139
  276    H    SER  39           H        SER  39  18.038 -14.179  -6.135
  277    HA   SER  39           HA       SER  39  16.783 -16.765  -5.698
  278    HB2  SER  39           HB2      SER  39  15.879 -14.353  -7.316
  279    HB3  SER  39           HB3      SER  39  14.902 -15.775  -6.918
  280    HG   SER  39           HG       SER  39  14.577 -14.033  -5.432
  281    H    ILE  40           H        ILE  40  18.345 -15.155  -8.478
  282    HA   ILE  40           HA       ILE  40  17.581 -17.239 -10.387
  283    HB   ILE  40           HB       ILE  40  19.775 -15.129 -10.588
  284   HG12  ILE  40          2HG1      ILE  40  16.905 -15.172 -11.673
  285   HG13  ILE  40          3HG1      ILE  40  17.425 -14.225 -10.280
  286   HG21  ILE  40          1HG2      ILE  40  18.494 -16.886 -12.727
  287   HG22  ILE  40          2HG2      ILE  40  19.660 -15.581 -13.037
  288   HG23  ILE  40          3HG2      ILE  40  20.171 -17.006 -12.147
  289   HD11  ILE  40          3HD1      ILE  40  18.236 -13.792 -13.157
  290   HD12  ILE  40          1HD1      ILE  40  17.309 -12.728 -12.079
  291   HD13  ILE  40          2HD1      ILE  40  19.026 -12.990 -11.775
  292    H    ILE  41           H        ILE  41  20.600 -16.671  -8.472
  293    HA   ILE  41           HA       ILE  41  21.840 -19.013  -9.573
  294    HB   ILE  41           HB       ILE  41  23.114 -17.145  -8.549
  295   HG12  ILE  41          2HG1      ILE  41  24.857 -18.489  -7.440
  296   HG13  ILE  41          3HG1      ILE  41  23.761 -19.871  -7.347
  297   HG21  ILE  41          1HG2      ILE  41  22.374 -18.360  -5.842
  298   HG22  ILE  41          2HG2      ILE  41  23.527 -17.048  -6.140
  299   HG23  ILE  41          3HG2      ILE  41  21.815 -16.799  -6.460
  300   HD11  ILE  41          3HD1      ILE  41  23.745 -20.071  -9.781
  301   HD12  ILE  41          1HD1      ILE  41  24.686 -18.559  -9.934
  302   HD13  ILE  41          2HD1      ILE  41  25.419 -20.003  -9.201
  303    H    LEU  42           H        LEU  42  19.944 -18.660  -6.540
  304    HA   LEU  42           HA       LEU  42  20.304 -21.441  -5.868
  305    HB2  LEU  42           HB2      LEU  42  18.947 -21.125  -4.049
  306    HB3  LEU  42           HB3      LEU  42  19.779 -19.599  -4.273
  307    HG   LEU  42           HG       LEU  42  17.575 -18.832  -5.476
  308   HD11  LEU  42          1HD1      LEU  42  15.527 -19.864  -4.477
  309   HD12  LEU  42          2HD1      LEU  42  16.524 -21.159  -3.790
  310   HD13  LEU  42          3HD1      LEU  42  16.345 -20.996  -5.540
  311   HD21  LEU  42          3HD2      LEU  42  16.687 -18.082  -3.316
  312   HD22  LEU  42          1HD2      LEU  42  18.455 -18.010  -3.278
  313   HD23  LEU  42          2HD2      LEU  42  17.621 -19.337  -2.465
  314    H    ARG  43           H        ARG  43  17.866 -19.803  -7.908
  315    HA   ARG  43           HA       ARG  43  16.215 -22.159  -8.193
  316    HB2  ARG  43           HB2      ARG  43  15.390 -19.905  -8.612
  317    HB3  ARG  43           HB3      ARG  43  16.462 -19.726 -10.007
  318    HG2  ARG  43           HG2      ARG  43  14.495 -22.033  -9.863
  319    HG3  ARG  43           HG3      ARG  43  13.908 -20.422 -10.245
  320    HD2  ARG  43           HD2      ARG  43  15.233 -20.242 -12.210
  321    HD3  ARG  43           HD3      ARG  43  16.138 -21.711 -11.874
  322    HE   ARG  43           HE       ARG  43  13.466 -21.499 -13.017
  323   HH11  ARG  43          1HH1      ARG  43  15.630 -23.774 -11.326
  324   HH12  ARG  43          2HH1      ARG  43  14.758 -25.151 -11.952
  325   HH21  ARG  43          1HH2      ARG  43  12.437 -23.328 -13.762
  326   HH22  ARG  43          2HH2      ARG  43  12.988 -24.905 -13.277
  327    H    HIS  44           H        HIS  44  19.055 -20.927 -10.037
  328    HA   HIS  44           HA       HIS  44  18.842 -22.815 -12.152
  329    HB2  HIS  44           HB2      HIS  44  20.328 -20.759 -12.046
  330    HB3  HIS  44           HB3      HIS  44  21.468 -21.712 -11.092
  331    HD1  HIS  44           HD1      HIS  44  23.130 -23.184 -12.574
  332    HD2  HIS  44           HD2      HIS  44  19.609 -21.952 -14.547
  333    HE1  HIS  44           HE1      HIS  44  23.327 -23.980 -14.968
  334    H    LEU  45           H        LEU  45  20.270 -23.264  -8.915
  335    HA   LEU  45           HA       LEU  45  21.554 -25.751  -9.308
  336    HB2  LEU  45           HB2      LEU  45  20.173 -24.545  -6.887
  337    HB3  LEU  45           HB3      LEU  45  21.057 -26.057  -6.810
  338    HG   LEU  45           HG       LEU  45  22.308 -23.406  -7.660
  339   HD11  LEU  45          1HD1      LEU  45  21.619 -23.357  -5.288
  340   HD12  LEU  45          2HD1      LEU  45  23.383 -23.465  -5.427
  341   HD13  LEU  45          3HD1      LEU  45  22.434 -24.910  -5.009
  342   HD21  LEU  45          3HD2      LEU  45  24.460 -24.693  -7.196
  343   HD22  LEU  45          1HD2      LEU  45  23.573 -25.256  -8.610
  344   HD23  LEU  45          2HD2      LEU  45  23.499 -26.166  -7.084
  345    H    LEU  46           H        LEU  46  18.074 -25.152  -8.847
  346    HA   LEU  46           HA       LEU  46  17.371 -27.961  -8.556
  347    HB2  LEU  46           HB2      LEU  46  15.753 -25.480  -9.282
  348    HB3  LEU  46           HB3      LEU  46  15.067 -27.079  -9.231
  349    HG   LEU  46           HG       LEU  46  14.461 -25.983  -7.255
  350   HD11  LEU  46          1HD1      LEU  46  15.020 -28.396  -7.051
  351   HD12  LEU  46          2HD1      LEU  46  15.222 -27.502  -5.526
  352   HD13  LEU  46          3HD1      LEU  46  16.642 -27.951  -6.472
  353   HD21  LEU  46          3HD2      LEU  46  17.388 -25.528  -6.533
  354   HD22  LEU  46          1HD2      LEU  46  15.965 -25.062  -5.586
  355   HD23  LEU  46          2HD2      LEU  46  16.262 -24.287  -7.148
  356    H    ASN  47           H        ASN  47  18.127 -25.985 -11.344
  357    HA   ASN  47           HA       ASN  47  17.037 -27.967 -13.255
  358    HB2  ASN  47           HB2      ASN  47  16.990 -25.451 -13.636
  359    HB3  ASN  47           HB3      ASN  47  18.744 -25.515 -13.848
  360   HD21  ASN  47          1HD2      ASN  47  19.538 -27.148 -15.629
  361   HD22  ASN  47          2HD2      ASN  47  18.498 -27.257 -17.032
  362    H    SER  48           H        SER  48  20.254 -26.622 -12.299
  363    HA   SER  48           HA       SER  48  21.624 -29.171 -12.958
  364    HB2  SER  48           HB2      SER  48  22.313 -26.515 -14.280
  365    HB3  SER  48           HB3      SER  48  23.235 -28.019 -14.420
  366    HG   SER  48           HG       SER  48  21.919 -27.803 -16.231
  367    HA   PRO  49           HA       PRO  49  24.095 -27.525  -9.563
  368    HB2  PRO  49           HB2      PRO  49  25.990 -29.432  -9.304
  369    HB3  PRO  49           HB3      PRO  49  24.266 -29.800  -9.056
  370    HG2  PRO  49           HG2      PRO  49  25.893 -30.234 -11.584
  371    HG3  PRO  49           HG3      PRO  49  24.857 -31.419 -10.721
  372    HD2  PRO  49           HD2      PRO  49  23.953 -29.949 -12.858
  373    HD3  PRO  49           HD3      PRO  49  22.882 -30.423 -11.504
  374    H    THR  50           H        THR  50  24.408 -25.902 -11.627
  375    HA   THR  50           HA       THR  50  27.314 -25.474 -12.069
  376    HB   THR  50           HB       THR  50  26.832 -25.051 -14.487
  377    HG1  THR  50           HG1      THR  50  24.967 -26.029 -15.329
  378   HG21  THR  50          1HG2      THR  50  26.944 -27.326 -15.232
  379   HG22  THR  50          2HG2      THR  50  26.281 -27.934 -13.692
  380   HG23  THR  50          3HG2      THR  50  27.890 -27.177 -13.751
  381    H    ASP  51           H        ASP  51  27.858 -23.510 -13.012
  382    HA   ASP  51           HA       ASP  51  26.542 -21.161 -11.986
  383    HB2  ASP  51           HB2      ASP  51  28.951 -21.358 -12.313
  384    HB3  ASP  51           HB3      ASP  51  28.747 -21.648 -14.030
  385    HA   PRO  52           HA       PRO  52  23.433 -20.947 -15.149
  386    HB2  PRO  52           HB2      PRO  52  22.501 -18.352 -14.877
  387    HB3  PRO  52           HB3      PRO  52  22.196 -19.665 -13.706
  388    HG2  PRO  52           HG2      PRO  52  24.349 -17.547 -13.594
  389    HG3  PRO  52           HG3      PRO  52  23.211 -18.038 -12.302
  390    HD2  PRO  52           HD2      PRO  52  25.740 -19.017 -12.406
  391    HD3  PRO  52           HD3      PRO  52  24.368 -20.102 -11.984
  392    H    PHE  53           H        PHE  53  26.248 -18.927 -15.535
  393    HA   PHE  53           HA       PHE  53  25.438 -18.311 -18.376
  394    HB2  PHE  53           HB2      PHE  53  27.203 -16.672 -16.520
  395    HB3  PHE  53           HB3      PHE  53  26.711 -16.244 -18.153
  396    HD1  PHE  53           HD1      PHE  53  24.074 -16.154 -18.574
  397    HD2  PHE  53           HD2      PHE  53  25.965 -15.782 -14.728
  398    HE1  PHE  53           HE1      PHE  53  22.020 -15.076 -17.669
  399    HE2  PHE  53           HE2      PHE  53  23.903 -14.700 -13.825
  400    HZ   PHE  53           HZ       PHE  53  21.950 -14.359 -15.271
  401    H    ASN  54           H        ASN  54  27.965 -19.453 -16.260
  402    HA   ASN  54           HA       ASN  54  29.950 -19.653 -18.490
  403    HB2  ASN  54           HB2      ASN  54  30.337 -19.891 -15.473
  404    HB3  ASN  54           HB3      ASN  54  31.603 -19.927 -16.679
  405   HD21  ASN  54          1HD2      ASN  54  29.305 -17.855 -14.973
  406   HD22  ASN  54          2HD2      ASN  54  30.018 -16.338 -15.516
  407    H    ARG  55           H        ARG  55  28.141 -21.588 -16.153
  408    HA   ARG  55           HA       ARG  55  27.630 -23.720 -15.985
  409    HB2  ARG  55           HB2      ARG  55  28.131 -23.550 -18.971
  410    HB3  ARG  55           HB3      ARG  55  27.351 -24.947 -18.197
  411    HG2  ARG  55           HG2      ARG  55  25.637 -23.573 -17.211
  412    HG3  ARG  55           HG3      ARG  55  26.409 -22.079 -17.759
  413    HD2  ARG  55           HD2      ARG  55  25.956 -22.605 -20.065
  414    HD3  ARG  55           HD3      ARG  55  25.180 -24.137 -19.606
  415    HE   ARG  55           HE       ARG  55  24.125 -21.409 -19.336
  416   HH11  ARG  55          1HH1      ARG  55  23.620 -24.738 -18.194
  417   HH12  ARG  55          2HH1      ARG  55  22.216 -24.257 -17.270
  418   HH21  ARG  55          1HH2      ARG  55  22.373 -20.923 -18.043
  419   HH22  ARG  55          2HH2      ARG  55  21.537 -22.203 -17.195
  420    H    GLN  56           H        GLN  56  30.427 -23.103 -15.497
  421    HA   GLN  56           HA       GLN  56  31.624 -25.792 -15.286
  422    HB2  GLN  56           HB2      GLN  56  33.038 -24.758 -13.590
  423    HB3  GLN  56           HB3      GLN  56  33.111 -23.852 -15.103
  424    HG2  GLN  56           HG2      GLN  56  31.991 -21.992 -14.210
  425    HG3  GLN  56           HG3      GLN  56  31.161 -22.928 -12.972
  426   HE21  GLN  56          1HE2      GLN  56  32.328 -23.605 -11.027
  427   HE22  GLN  56          2HE2      GLN  56  33.806 -22.751 -10.588
  428    H    MET  57           H        MET  57  31.745 -26.786 -13.062
  429    HA   MET  57           HA       MET  57  29.199 -27.151 -11.855
  430    HB2  MET  57           HB2      MET  57  31.987 -27.786 -10.790
  431    HB3  MET  57           HB3      MET  57  30.466 -28.352 -10.096
  432    HG2  MET  57           HG2      MET  57  31.215 -30.158 -11.369
  433    HG3  MET  57           HG3      MET  57  29.940 -29.427 -12.335
  434    HE1  MET  57           HE1      MET  57  31.863 -31.594 -13.433
  435    HE2  MET  57           HE2      MET  57  30.648 -30.788 -14.454
  436    HE3  MET  57           HE3      MET  57  32.322 -30.934 -15.017
  437    H    LEU  58           H        LEU  58  28.334 -26.555  -9.913
  438    HA   LEU  58           HA       LEU  58  29.552 -24.545  -8.174
  439    HB2  LEU  58           HB2      LEU  58  28.637 -23.275 -10.124
  440    HB3  LEU  58           HB3      LEU  58  27.057 -23.967  -9.834
  441    HG   LEU  58           HG       LEU  58  27.461 -21.567  -9.157
  442   HD11  LEU  58          1HD1      LEU  58  26.400 -23.300  -6.904
  443   HD12  LEU  58          2HD1      LEU  58  25.509 -22.883  -8.380
  444   HD13  LEU  58          3HD1      LEU  58  25.996 -21.621  -7.254
  445   HD21  LEU  58          3HD2      LEU  58  29.674 -21.864  -8.102
  446   HD22  LEU  58          1HD2      LEU  58  28.914 -22.746  -6.753
  447   HD23  LEU  58          2HD2      LEU  58  28.517 -21.050  -7.039
  448    H    THR  59           H        THR  59  28.793 -24.760  -6.126
  449    HA   THR  59           HA       THR  59  26.336 -26.377  -5.567
  450    HB   THR  59           HB       THR  59  28.951 -26.617  -4.033
  451    HG1  THR  59           HG1      THR  59  29.238 -27.576  -6.016
  452   HG21  THR  59          1HG2      THR  59  27.038 -27.260  -2.640
  453   HG22  THR  59          2HG2      THR  59  27.880 -28.716  -3.157
  454   HG23  THR  59          3HG2      THR  59  26.371 -28.251  -3.964
  455    H    GLU  60           H        GLU  60  25.257 -25.810  -3.640
  456    HA   GLU  60           HA       GLU  60  25.200 -23.050  -3.062
  457    HB2  GLU  60           HB2      GLU  60  23.562 -23.568  -1.365
  458    HB3  GLU  60           HB3      GLU  60  23.279 -24.538  -2.809
  459    HG2  GLU  60           HG2      GLU  60  24.340 -26.503  -1.713
  460    HG3  GLU  60           HG3      GLU  60  24.616 -25.545  -0.255
  461    H    SER  61           H        SER  61  27.249 -25.464  -1.564
  462    HA   SER  61           HA       SER  61  27.840 -24.008   0.876
  463    HB2  SER  61           HB2      SER  61  29.732 -25.658   0.961
  464    HB3  SER  61           HB3      SER  61  28.136 -26.392   0.801
  465    HG   SER  61           HG       SER  61  29.683 -27.325  -0.629
  466    H    MET  62           H        MET  62  28.864 -23.643  -2.424
  467    HA   MET  62           HA       MET  62  31.370 -22.196  -1.760
  468    HB2  MET  62           HB2      MET  62  30.064 -22.771  -4.441
  469    HB3  MET  62           HB3      MET  62  31.682 -22.126  -4.171
  470    HG2  MET  62           HG2      MET  62  30.817 -24.899  -3.291
  471    HG3  MET  62           HG3      MET  62  31.594 -24.522  -4.812
  472    HE1  MET  62           HE1      MET  62  33.652 -25.058  -0.782
  473    HE2  MET  62           HE2      MET  62  32.206 -24.041  -0.851
  474    HE3  MET  62           HE3      MET  62  32.118 -25.747  -1.354
  475    H    LEU  63           H        LEU  63  28.089 -21.394  -2.035
  476    HA   LEU  63           HA       LEU  63  28.409 -18.691  -3.166
  477    HB2  LEU  63           HB2      LEU  63  26.046 -20.147  -1.908
  478    HB3  LEU  63           HB3      LEU  63  25.972 -18.548  -2.624
  479    HG   LEU  63           HG       LEU  63  26.629 -21.130  -4.111
  480   HD11  LEU  63          1HD1      LEU  63  24.452 -20.807  -5.179
  481   HD12  LEU  63          2HD1      LEU  63  24.186 -19.318  -4.244
  482   HD13  LEU  63          3HD1      LEU  63  24.247 -20.883  -3.424
  483   HD21  LEU  63          3HD2      LEU  63  27.820 -19.281  -5.186
  484   HD22  LEU  63          1HD2      LEU  63  26.360 -18.269  -5.149
  485   HD23  LEU  63          2HD2      LEU  63  26.426 -19.717  -6.171
  486    H    GLU  64           H        GLU  64  28.183 -16.777  -2.089
  487    HA   GLU  64           HA       GLU  64  27.831 -16.724   0.848
  488    HB2  GLU  64           HB2      GLU  64  30.242 -16.990   0.531
  489    HB3  GLU  64           HB3      GLU  64  30.278 -15.631  -0.603
  490    HG2  GLU  64           HG2      GLU  64  29.622 -14.082   1.220
  491    HG3  GLU  64           HG3      GLU  64  29.481 -15.451   2.337
  492    HA   PRO  65           HA       PRO  65  25.637 -13.067  -0.774
  493    HB2  PRO  65           HB2      PRO  65  24.568 -12.101   1.541
  494    HB3  PRO  65           HB3      PRO  65  23.916 -13.540   0.684
  495    HG2  PRO  65           HG2      PRO  65  25.802 -13.489   3.055
  496    HG3  PRO  65           HG3      PRO  65  24.329 -14.486   2.814
  497    HD2  PRO  65           HD2      PRO  65  26.835 -15.442   2.318
  498    HD3  PRO  65           HD3      PRO  65  25.435 -15.934   1.324
  499    H    VAL  66           H        VAL  66  26.785 -11.280  -1.326
  500    HA   VAL  66           HA       VAL  66  29.190 -10.693   0.239
  501    HB   VAL  66           HB       VAL  66  29.627 -10.966  -1.989
  502   HG11  VAL  66          1HG1      VAL  66  27.641  -8.796  -2.730
  503   HG12  VAL  66          2HG1      VAL  66  28.784  -9.588  -3.834
  504   HG13  VAL  66          3HG1      VAL  66  27.494 -10.534  -3.070
  505   HG21  VAL  66          3HG2      VAL  66  30.922  -9.188  -0.861
  506   HG22  VAL  66          1HG2      VAL  66  30.798  -8.922  -2.603
  507   HG23  VAL  66          2HG2      VAL  66  29.800  -7.963  -1.496
  508    HA   PRO  67           HA       PRO  67  26.870  -7.503   2.268
  509    HB2  PRO  67           HB2      PRO  67  28.602  -6.784   4.259
  510    HB3  PRO  67           HB3      PRO  67  27.824  -8.395   4.207
  511    HG2  PRO  67           HG2      PRO  67  30.607  -7.635   3.216
  512    HG3  PRO  67           HG3      PRO  67  30.145  -9.005   4.270
  513    HD2  PRO  67           HD2      PRO  67  30.473  -9.314   1.577
  514    HD3  PRO  67           HD3      PRO  67  29.220 -10.211   2.486
  515    H    GLU  68           H        GLU  68  30.188  -6.598   1.155
  516    HA   GLU  68           HA       GLU  68  29.774  -3.794   1.490
  517    HB2  GLU  68           HB2      GLU  68  31.672  -3.486  -0.000
  518    HB3  GLU  68           HB3      GLU  68  31.979  -4.712   1.224
  519    HG2  GLU  68           HG2      GLU  68  31.579  -6.495  -0.490
  520    HG3  GLU  68           HG3      GLU  68  31.319  -5.245  -1.714
  521    H    LEU  69           H        LEU  69  28.959  -5.938  -1.234
  522    HA   LEU  69           HA       LEU  69  28.005  -3.778  -2.937
  523    HB2  LEU  69           HB2      LEU  69  28.838  -6.375  -3.324
  524    HB3  LEU  69           HB3      LEU  69  27.086  -6.599  -3.392
  525    HG   LEU  69           HG       LEU  69  28.752  -4.661  -5.070
  526   HD11  LEU  69          1HD1      LEU  69  29.117  -7.079  -5.587
  527   HD12  LEU  69          2HD1      LEU  69  28.325  -6.218  -6.923
  528   HD13  LEU  69          3HD1      LEU  69  27.362  -7.247  -5.842
  529   HD21  LEU  69          3HD2      LEU  69  26.669  -4.492  -6.468
  530   HD22  LEU  69          1HD2      LEU  69  26.501  -3.757  -4.871
  531   HD23  LEU  69          2HD2      LEU  69  25.793  -5.361  -5.196
  532    H    LYS  70           H        LYS  70  26.445  -6.146  -0.706
  533    HA   LYS  70           HA       LYS  70  23.745  -5.355  -1.233
  534    HB2  LYS  70           HB2      LYS  70  24.503  -7.460  -0.102
  535    HB3  LYS  70           HB3      LYS  70  24.943  -6.500   1.321
  536    HG2  LYS  70           HG2      LYS  70  22.576  -5.838   1.617
  537    HG3  LYS  70           HG3      LYS  70  22.142  -6.642   0.112
  538    HD2  LYS  70           HD2      LYS  70  21.498  -8.025   1.985
  539    HD3  LYS  70           HD3      LYS  70  22.790  -8.829   1.077
  540    HE2  LYS  70           HE2      LYS  70  24.447  -8.114   2.763
  541    HE3  LYS  70           HE3      LYS  70  23.220  -7.166   3.616
  542    HZ1  LYS  70           HZ1      LYS  70  23.573  -9.315   4.669
  543    HZ2  LYS  70           HZ2      LYS  70  23.192 -10.114   3.292
  544    HZ3  LYS  70           HZ3      LYS  70  22.047  -9.247   4.074
  545    H    GLU  71           H        GLU  71  26.065  -4.161   1.225
  546    HA   GLU  71           HA       GLU  71  24.323  -2.271   2.478
  547    HB2  GLU  71           HB2      GLU  71  26.450  -3.127   3.415
  548    HB3  GLU  71           HB3      GLU  71  27.359  -2.223   2.197
  549    HG2  GLU  71           HG2      GLU  71  26.488  -0.105   3.133
  550    HG3  GLU  71           HG3      GLU  71  25.495  -1.011   4.284
  551    H    GLN  72           H        GLN  72  26.447  -2.003  -0.385
  552    HA   GLN  72           HA       GLN  72  25.961   0.839  -0.822
  553    HB2  GLN  72           HB2      GLN  72  26.981  -1.414  -2.587
  554    HB3  GLN  72           HB3      GLN  72  26.747   0.231  -3.195
  555    HG2  GLN  72           HG2      GLN  72  28.335   1.147  -1.617
  556    HG3  GLN  72           HG3      GLN  72  28.482  -0.376  -0.773
  557   HE21  GLN  72          1HE2      GLN  72  30.870   0.287  -1.299
  558   HE22  GLN  72          2HE2      GLN  72  31.497  -0.374  -2.806
  559    H    ILE  73           H        ILE  73  24.475  -2.126  -2.246
  560    HA   ILE  73           HA       ILE  73  22.565  -0.759  -3.861
  561    HB   ILE  73           HB       ILE  73  22.797  -3.548  -2.709
  562   HG12  ILE  73          2HG1      ILE  73  22.674  -2.422  -5.552
  563   HG13  ILE  73          3HG1      ILE  73  24.156  -2.787  -4.658
  564   HG21  ILE  73          1HG2      ILE  73  20.767  -4.249  -3.975
  565   HG22  ILE  73          2HG2      ILE  73  20.423  -3.254  -2.585
  566   HG23  ILE  73          3HG2      ILE  73  20.356  -2.526  -4.211
  567   HD11  ILE  73          3HD1      ILE  73  23.750  -4.574  -6.202
  568   HD12  ILE  73          1HD1      ILE  73  23.462  -5.195  -4.557
  569   HD13  ILE  73          2HD1      ILE  73  22.100  -4.809  -5.631
  570    H    GLN  74           H        GLN  74  22.141  -1.940  -0.481
  571    HA   GLN  74           HA       GLN  74  19.390  -1.137  -0.419
  572    HB2  GLN  74           HB2      GLN  74  19.342  -1.824   1.814
  573    HB3  GLN  74           HB3      GLN  74  20.428  -2.907   0.982
  574    HG2  GLN  74           HG2      GLN  74  21.665  -2.553   2.878
  575    HG3  GLN  74           HG3      GLN  74  22.315  -1.258   1.898
  576   HE21  GLN  74          1HE2      GLN  74  19.574  -1.855   4.233
  577   HE22  GLN  74          2HE2      GLN  74  19.744  -0.287   5.017
  578    H    ALA  75           H        ALA  75  22.331   0.685   0.372
  579    HA   ALA  75           HA       ALA  75  20.900   2.984   1.433
  580    HB1  ALA  75           HB1      ALA  75  23.086   4.106   1.131
  581    HB2  ALA  75           HB2      ALA  75  23.291   2.529   1.924
  582    HB3  ALA  75           HB3      ALA  75  23.692   2.719   0.202
  583    H    TRP  76           H        TRP  76  22.233   2.111  -1.818
  584    HA   TRP  76           HA       TRP  76  21.506   4.536  -3.106
  585    HB2  TRP  76           HB2      TRP  76  23.126   2.851  -3.932
  586    HB3  TRP  76           HB3      TRP  76  21.791   1.760  -4.297
  587    HD1  TRP  76           HD1      TRP  76  23.445   5.003  -5.437
  588    HE1  TRP  76           HE1      TRP  76  22.709   5.592  -7.824
  589    HE3  TRP  76           HE3      TRP  76  19.851   1.413  -6.090
  590    HZ2  TRP  76           HZ2      TRP  76  20.771   4.670  -9.752
  591    HZ3  TRP  76           HZ3      TRP  76  18.552   1.326  -8.205
  592    HH2  TRP  76           HH2      TRP  76  18.988   2.948 -10.028
  593    H    MET  77           H        MET  77  19.587   1.481  -2.770
  594    HA   MET  77           HA       MET  77  17.336   2.390  -4.309
  595    HB2  MET  77           HB2      MET  77  17.508   0.440  -1.979
  596    HB3  MET  77           HB3      MET  77  16.027   0.747  -2.890
  597    HG2  MET  77           HG2      MET  77  17.255   0.146  -4.998
  598    HG3  MET  77           HG3      MET  77  18.619  -0.374  -4.018
  599    HE1  MET  77           HE1      MET  77  18.459  -2.288  -2.214
  600    HE2  MET  77           HE2      MET  77  16.905  -1.829  -1.483
  601    HE3  MET  77           HE3      MET  77  17.125  -3.473  -2.096
  602    H    ARG  78           H        ARG  78  18.143   2.977  -0.853
  603    HA   ARG  78           HA       ARG  78  15.692   4.392  -0.273
  604    HB2  ARG  78           HB2      ARG  78  17.157   3.379   1.451
  605    HB3  ARG  78           HB3      ARG  78  18.397   4.600   1.130
  606    HG2  ARG  78           HG2      ARG  78  16.801   6.396   1.775
  607    HG3  ARG  78           HG3      ARG  78  15.547   5.171   2.075
  608    HD2  ARG  78           HD2      ARG  78  16.956   4.166   3.849
  609    HD3  ARG  78           HD3      ARG  78  18.222   5.367   3.519
  610    HE   ARG  78           HE       ARG  78  15.762   6.714   4.031
  611   HH11  ARG  78          1HH1      ARG  78  18.179   4.861   5.869
  612   HH12  ARG  78          2HH1      ARG  78  17.803   5.684   7.352
  613   HH21  ARG  78          1HH2      ARG  78  15.320   7.705   5.999
  614   HH22  ARG  78          2HH2      ARG  78  16.223   7.284   7.418
  615    H    GLU  79           H        GLU  79  18.936   5.531  -1.345
  616    HA   GLU  79           HA       GLU  79  18.327   8.318  -1.428
  617    HB2  GLU  79           HB2      GLU  79  20.220   6.674  -3.158
  618    HB3  GLU  79           HB3      GLU  79  20.153   8.432  -3.165
  619    HG2  GLU  79           HG2      GLU  79  20.840   6.740  -0.723
  620    HG3  GLU  79           HG3      GLU  79  22.001   7.510  -1.779
  621    H    LYS  80           H        LYS  80  17.782   5.780  -3.926
  622    HA   LYS  80           HA       LYS  80  16.629   7.594  -5.868
  623    HB2  LYS  80           HB2      LYS  80  16.476   4.584  -5.490
  624    HB3  LYS  80           HB3      LYS  80  15.767   5.410  -6.858
  625    HG2  LYS  80           HG2      LYS  80  18.722   5.301  -6.184
  626    HG3  LYS  80           HG3      LYS  80  17.897   4.413  -7.448
  627    HD2  LYS  80           HD2      LYS  80  18.248   7.439  -7.356
  628    HD3  LYS  80           HD3      LYS  80  19.186   6.303  -8.327
  629    HE2  LYS  80           HE2      LYS  80  17.117   5.582  -9.506
  630    HE3  LYS  80           HE3      LYS  80  16.189   6.768  -8.581
  631    HZ1  LYS  80           HZ1      LYS  80  16.793   7.665 -10.723
  632    HZ2  LYS  80           HZ2      LYS  80  18.379   7.364 -10.494
  633    HZ3  LYS  80           HZ3      LYS  80  17.612   8.502  -9.577
  634    H    GLN  81           H        GLN  81  15.147   5.669  -3.243
  635    HA   GLN  81           HA       GLN  81  12.412   6.309  -3.898
  636    HB2  GLN  81           HB2      GLN  81  13.155   4.459  -2.411
  637    HB3  GLN  81           HB3      GLN  81  13.645   5.646  -1.190
  638    HG2  GLN  81           HG2      GLN  81  11.273   6.442  -1.050
  639    HG3  GLN  81           HG3      GLN  81  10.819   5.290  -2.312
  640   HE21  GLN  81          1HE2      GLN  81   9.234   4.754  -0.425
  641   HE22  GLN  81          2HE2      GLN  81   9.791   3.522   0.699
  642    H    SER  82           H        SER  82  14.820   7.865  -1.817
  643    HA   SER  82           HA       SER  82  15.207  10.183  -2.374
  644    HB2  SER  82           HB2      SER  82  12.957  10.793  -3.140
  645    HB3  SER  82           HB3      SER  82  12.371  10.733  -1.452
  646    HG   SER  82           HG       SER  82  12.991  12.866  -2.247
  647    H    SER  83           H        SER  83  16.267  11.402  -0.850
  648    HA   SER  83           HA       SER  83  16.172  10.530   1.971
  649    HB2  SER  83           HB2      SER  83  18.200  11.985   2.113
  650    HB3  SER  83           HB3      SER  83  18.333  10.680   0.927
  651    HG   SER  83           HG       SER  83  19.100  12.658   0.048
  652    H    ASP  84           H        ASP  84  14.685  12.964   0.072
  653    HA   ASP  84           HA       ASP  84  14.677  15.081   2.117
  654    HB2  ASP  84           HB2      ASP  84  14.749  15.641  -0.276
  655    HB3  ASP  84           HB3      ASP  84  13.211  14.804  -0.534
  656    H    HIS  85           H        HIS  85  13.224  15.340   3.674
  657    HA   HIS  85           HA       HIS  85  10.481  14.389   3.577
  658    HB2  HIS  85           HB2      HIS  85  11.981  12.315   4.091
  659    HB3  HIS  85           HB3      HIS  85  12.261  13.063   5.654
  660    HD1  HIS  85           HD1      HIS  85   9.321  11.754   3.474
  661    HD2  HIS  85           HD2      HIS  85  10.334  12.637   7.466
  662    HE1  HIS  85           HE1      HIS  85   7.395  10.896   4.909
  Start of MODEL   16
    1    H2   PRO   1           H2       PRO   1   3.517   8.203  -9.657
    2    H3   PRO   1           H3       PRO   1   3.962   9.218  -8.429
    3    HA   PRO   1           HA       PRO   1   2.111   8.661  -7.120
    4    HB2  PRO   1           HB2      PRO   1   0.921   7.035  -9.378
    5    HB3  PRO   1           HB3      PRO   1   0.097   7.925  -8.052
    6    HG2  PRO   1           HG2      PRO   1   0.750   8.881 -10.700
    7    HG3  PRO   1           HG3      PRO   1   0.106   9.864  -9.358
    8    HD2  PRO   1           HD2      PRO   1   2.640  10.229 -10.431
    9    HD3  PRO   1           HD3      PRO   1   2.165  10.655  -8.773
   10    H    GLY   2           H        GLY   2   1.442   6.554  -6.109
   11    HA2  GLY   2           HA2      GLY   2   3.700   4.703  -5.936
   12    HA3  GLY   2           HA3      GLY   2   2.219   4.719  -4.951
   13    H    SER   3           H        SER   3   1.089   4.688  -8.034
   14    HA   SER   3           HA       SER   3   0.165   2.005  -7.942
   15    HB2  SER   3           HB2      SER   3   0.219   3.885 -10.336
   16    HB3  SER   3           HB3      SER   3  -0.888   2.533 -10.049
   17    HG   SER   3           HG       SER   3  -1.876   4.526  -9.510
   18    H    ALA   4           H        ALA   4   3.229   3.042  -8.974
   19    HA   ALA   4           HA       ALA   4   3.791   0.456 -10.315
   20    HB1  ALA   4           HB1      ALA   4   3.213   2.042 -12.147
   21    HB2  ALA   4           HB2      ALA   4   4.445   3.174 -11.561
   22    HB3  ALA   4           HB3      ALA   4   4.931   1.589 -12.196
   23    H    GLU   5           H        GLU   5   6.092   0.056 -10.541
   24    HA   GLU   5           HA       GLU   5   7.613   0.869  -8.158
   25    HB2  GLU   5           HB2      GLU   5   8.223  -1.141 -10.353
   26    HB3  GLU   5           HB3      GLU   5   9.196  -0.873  -8.900
   27    HG2  GLU   5           HG2      GLU   5   7.264  -1.510  -7.482
   28    HG3  GLU   5           HG3      GLU   5   6.303  -1.843  -8.933
   29    H    ILE   6           H        ILE   6   9.938   1.391  -8.351
   30    HA   ILE   6           HA       ILE   6  10.484   3.596 -10.120
   31    HB   ILE   6           HB       ILE   6  12.218   1.951  -8.222
   32   HG12  ILE   6          2HG1      ILE   6  11.230   4.824  -7.887
   33   HG13  ILE   6          3HG1      ILE   6  10.278   3.452  -7.344
   34   HG21  ILE   6          1HG2      ILE   6  13.737   2.936  -9.865
   35   HG22  ILE   6          2HG2      ILE   6  12.971   4.526  -9.673
   36   HG23  ILE   6          3HG2      ILE   6  13.894   3.798  -8.350
   37   HD11  ILE   6          3HD1      ILE   6  11.492   4.373  -5.492
   38   HD12  ILE   6          1HD1      ILE   6  12.103   2.746  -5.839
   39   HD13  ILE   6          2HD1      ILE   6  13.042   4.172  -6.318
   40    H    ASP   7           H        ASP   7  11.252   0.253 -10.254
   41    HA   ASP   7           HA       ASP   7  11.876  -1.175 -11.848
   42    HB2  ASP   7           HB2      ASP   7  10.294   0.300 -13.233
   43    HB3  ASP   7           HB3      ASP   7  11.748   1.039 -13.916
   44    H    TYR   8           H        TYR   8  13.764   1.347 -11.130
   45    HA   TYR   8           HA       TYR   8  16.010   1.738 -11.024
   46    HB2  TYR   8           HB2      TYR   8  15.962  -1.285 -10.769
   47    HB3  TYR   8           HB3      TYR   8  17.227  -0.217 -10.174
   48    HD1  TYR   8           HD2      TYR   8  16.304   1.834  -8.640
   49    HD2  TYR   8           HD1      TYR   8  14.350  -1.967  -9.184
   50    HE1  TYR   8           HE2      TYR   8  15.182   2.111  -6.456
   51    HE2  TYR   8           HE1      TYR   8  13.180  -1.673  -6.993
   52    HH   TYR   8           HH       TYR   8  13.780   1.194  -4.913
   53    H    SER   9           H        SER   9  15.170   1.387 -13.851
   54    HA   SER   9           HA       SER   9  17.279   0.418 -15.472
   55    HB2  SER   9           HB2      SER   9  15.645   2.958 -15.846
   56    HB3  SER   9           HB3      SER   9  16.531   2.079 -17.098
   57    HG   SER   9           HG       SER   9  14.290   1.536 -17.082
   58    H    ASP  10           H        ASP  10  17.279   3.219 -13.359
   59    HA   ASP  10           HA       ASP  10  19.631   4.514 -14.493
   60    HB2  ASP  10           HB2      ASP  10  17.693   5.641 -13.336
   61    HB3  ASP  10           HB3      ASP  10  18.211   4.895 -11.823
   62    H    ALA  11           H        ALA  11  19.328   1.720 -12.543
   63    HA   ALA  11           HA       ALA  11  21.498   2.120 -10.711
   64    HB1  ALA  11           HB1      ALA  11  20.222  -0.452 -11.731
   65    HB2  ALA  11           HB2      ALA  11  21.278  -0.316 -10.312
   66    HB3  ALA  11           HB3      ALA  11  19.706   0.489 -10.314
   67    HA   PRO  12           HA       PRO  12  24.996   1.310 -13.364
   68    HB2  PRO  12           HB2      PRO  12  26.904   0.525 -11.595
   69    HB3  PRO  12           HB3      PRO  12  26.259   2.192 -11.633
   70    HG2  PRO  12           HG2      PRO  12  25.391  -0.083  -9.820
   71    HG3  PRO  12           HG3      PRO  12  25.850   1.587  -9.346
   72    HD2  PRO  12           HD2      PRO  12  23.244   0.873  -9.695
   73    HD3  PRO  12           HD3      PRO  12  23.837   2.486 -10.198
   74    H    ASP  13           H        ASP  13  26.295  -0.411 -14.230
   75    HA   ASP  13           HA       ASP  13  24.861  -2.850 -14.535
   76    HB2  ASP  13           HB2      ASP  13  26.623  -3.487 -16.027
   77    HB3  ASP  13           HB3      ASP  13  26.259  -1.792 -16.267
   78    H    GLU  14           H        GLU  14  27.233  -2.016 -12.167
   79    HA   GLU  14           HA       GLU  14  27.947  -4.770 -11.478
   80    HB2  GLU  14           HB2      GLU  14  29.229  -3.820  -9.683
   81    HB3  GLU  14           HB3      GLU  14  29.532  -2.933 -11.179
   82    HG2  GLU  14           HG2      GLU  14  27.915  -1.156 -10.363
   83    HG3  GLU  14           HG3      GLU  14  27.795  -2.030  -8.836
   84    H    PHE  15           H        PHE  15  25.268  -2.722 -10.709
   85    HA   PHE  15           HA       PHE  15  24.445  -4.417  -8.380
   86    HB2  PHE  15           HB2      PHE  15  23.309  -1.856  -9.564
   87    HB3  PHE  15           HB3      PHE  15  22.601  -2.738  -8.228
   88    HD1  PHE  15           HD2      PHE  15  25.971  -3.073  -7.407
   89    HD2  PHE  15           HD1      PHE  15  22.850  -0.093  -7.682
   90    HE1  PHE  15           HE2      PHE  15  27.168  -1.654  -5.772
   91    HE2  PHE  15           HE1      PHE  15  24.066   1.316  -6.052
   92    HZ   PHE  15           HZ       PHE  15  26.227   0.540  -5.098
   93    H    ARG  16           H        ARG  16  23.923  -4.127 -11.782
   94    HA   ARG  16           HA       ARG  16  21.232  -5.385 -11.692
   95    HB2  ARG  16           HB2      ARG  16  22.861  -4.160 -13.947
   96    HB3  ARG  16           HB3      ARG  16  21.282  -4.939 -14.165
   97    HG2  ARG  16           HG2      ARG  16  20.166  -3.286 -12.799
   98    HG3  ARG  16           HG3      ARG  16  21.694  -2.599 -12.259
   99    HD2  ARG  16           HD2      ARG  16  20.710  -1.137 -13.933
  100    HD3  ARG  16           HD3      ARG  16  22.228  -1.815 -14.504
  101    HE   ARG  16           HE       ARG  16  21.112  -2.988 -16.163
  102   HH11  ARG  16          1HH1      ARG  16  18.644  -1.570 -14.029
  103   HH12  ARG  16          2HH1      ARG  16  17.352  -2.090 -15.068
  104   HH21  ARG  16          1HH2      ARG  16  19.386  -3.582 -17.451
  105   HH22  ARG  16          2HH2      ARG  16  17.765  -3.237 -16.953
  106    H    ASP  17           H        ASP  17  20.850  -7.481 -12.204
  107    HA   ASP  17           HA       ASP  17  23.138  -9.247 -12.800
  108    HB2  ASP  17           HB2      ASP  17  21.646  -9.959 -11.089
  109    HB3  ASP  17           HB3      ASP  17  20.243  -9.800 -12.138
  110    HA   PRO  18           HA       PRO  18  22.631  -9.051 -17.146
  111    HB2  PRO  18           HB2      PRO  18  23.363 -11.954 -17.381
  112    HB3  PRO  18           HB3      PRO  18  24.127 -10.525 -18.129
  113    HG2  PRO  18           HG2      PRO  18  25.237 -11.844 -16.007
  114    HG3  PRO  18           HG3      PRO  18  25.363 -10.055 -16.176
  115    HD2  PRO  18           HD2      PRO  18  23.534 -11.671 -14.425
  116    HD3  PRO  18           HD3      PRO  18  24.397 -10.141 -14.097
  117    H    LEU  19           H        LEU  19  21.152 -11.980 -15.715
  118    HA   LEU  19           HA       LEU  19  19.333 -12.344 -18.035
  119    HB2  LEU  19           HB2      LEU  19  20.411 -14.311 -17.073
  120    HB3  LEU  19           HB3      LEU  19  19.798 -13.916 -15.478
  121    HG   LEU  19           HG       LEU  19  17.459 -14.331 -16.288
  122   HD11  LEU  19          1HD1      LEU  19  17.740 -13.858 -18.698
  123   HD12  LEU  19          2HD1      LEU  19  17.146 -15.502 -18.452
  124   HD13  LEU  19          3HD1      LEU  19  18.854 -15.237 -18.854
  125   HD21  LEU  19          3HD2      LEU  19  18.740 -16.101 -15.182
  126   HD22  LEU  19          1HD2      LEU  19  19.417 -16.618 -16.740
  127   HD23  LEU  19          2HD2      LEU  19  17.674 -16.778 -16.424
  128    H    MET  20           H        MET  20  19.213 -11.304 -14.648
  129    HA   MET  20           HA       MET  20  16.354 -11.081 -14.465
  130    HB2  MET  20           HB2      MET  20  18.331 -10.956 -12.653
  131    HB3  MET  20           HB3      MET  20  18.172  -9.219 -12.930
  132    HG2  MET  20           HG2      MET  20  15.696  -9.474 -12.457
  133    HG3  MET  20           HG3      MET  20  16.014 -11.152 -12.036
  134    HE1  MET  20           HE1      MET  20  14.530  -9.063 -10.178
  135    HE2  MET  20           HE2      MET  20  14.821 -10.745  -9.695
  136    HE3  MET  20           HE3      MET  20  15.249  -9.407  -8.590
  137    H    ASP  21           H        ASP  21  18.815  -8.907 -15.706
  138    HA   ASP  21           HA       ASP  21  18.832  -6.953 -16.790
  139    HB2  ASP  21           HB2      ASP  21  17.335  -8.272 -18.296
  140    HB3  ASP  21           HB3      ASP  21  15.932  -7.515 -17.532
  141    H    THR  22           H        THR  22  18.296  -6.894 -14.038
  142    HA   THR  22           HA       THR  22  17.625  -4.165 -13.552
  143    HB   THR  22           HB       THR  22  15.306  -5.111 -13.894
  144    HG1  THR  22           HG1      THR  22  14.561  -3.877 -12.221
  145   HG21  THR  22          1HG2      THR  22  15.643  -7.288 -12.740
  146   HG22  THR  22          2HG2      THR  22  14.263  -6.370 -12.114
  147   HG23  THR  22          3HG2      THR  22  15.783  -6.424 -11.193
  148    H    LEU  23           H        LEU  23  17.302  -3.875 -11.086
  149    HA   LEU  23           HA       LEU  23  19.808  -4.524  -9.907
  150    HB2  LEU  23           HB2      LEU  23  17.903  -2.599  -9.523
  151    HB3  LEU  23           HB3      LEU  23  17.545  -3.628  -8.141
  152    HG   LEU  23           HG       LEU  23  20.252  -2.386  -8.805
  153   HD11  LEU  23          1HD1      LEU  23  19.780  -0.896  -6.899
  154   HD12  LEU  23          2HD1      LEU  23  18.171  -1.632  -6.707
  155   HD13  LEU  23          3HD1      LEU  23  18.566  -0.721  -8.183
  156   HD21  LEU  23          3HD2      LEU  23  20.909  -3.037  -6.528
  157   HD22  LEU  23          1HD2      LEU  23  20.523  -4.463  -7.467
  158   HD23  LEU  23          2HD2      LEU  23  19.348  -3.849  -6.281
  159    H    MET  24           H        MET  24  20.435  -6.367  -8.956
  160    HA   MET  24           HA       MET  24  18.637  -8.539  -8.445
  161    HB2  MET  24           HB2      MET  24  20.588  -9.684  -7.478
  162    HB3  MET  24           HB3      MET  24  20.872  -8.997  -9.089
  163    HG2  MET  24           HG2      MET  24  22.001  -7.041  -7.907
  164    HG3  MET  24           HG3      MET  24  21.903  -7.970  -6.411
  165    HE1  MET  24           HE1      MET  24  24.423  -6.937  -6.934
  166    HE2  MET  24           HE2      MET  24  25.624  -7.796  -7.914
  167    HE3  MET  24           HE3      MET  24  24.387  -6.793  -8.695
  168    H    THR  25           H        THR  25  19.982  -6.155  -6.241
  169    HA   THR  25           HA       THR  25  19.438  -5.455  -4.153
  170    HB   THR  25           HB       THR  25  17.040  -7.319  -4.154
  171    HG1  THR  25           HG1      THR  25  15.996  -5.591  -5.145
  172   HG21  THR  25          1HG2      THR  25  17.628  -4.627  -2.841
  173   HG22  THR  25          2HG2      THR  25  17.487  -6.190  -2.001
  174   HG23  THR  25          3HG2      THR  25  16.068  -5.483  -2.781
  175    H    ASP  26           H        ASP  26  19.388  -8.936  -4.548
  176    HA   ASP  26           HA       ASP  26  20.870  -9.317  -1.963
  177    HB2  ASP  26           HB2      ASP  26  18.795 -11.084  -3.313
  178    HB3  ASP  26           HB3      ASP  26  19.916 -11.664  -2.080
  179    HA   PRO  27           HA       PRO  27  23.655 -10.552  -5.445
  180    HB2  PRO  27           HB2      PRO  27  25.956  -9.424  -4.468
  181    HB3  PRO  27           HB3      PRO  27  24.734  -8.506  -5.387
  182    HG2  PRO  27           HG2      PRO  27  25.055  -8.691  -2.381
  183    HG3  PRO  27           HG3      PRO  27  24.865  -7.218  -3.392
  184    HD2  PRO  27           HD2      PRO  27  22.762  -8.367  -2.100
  185    HD3  PRO  27           HD3      PRO  27  22.565  -7.667  -3.742
  186    H    VAL  28           H        VAL  28  24.642 -12.477  -5.459
  187    HA   VAL  28           HA       VAL  28  25.851 -13.582  -2.933
  188    HB   VAL  28           HB       VAL  28  24.385 -15.198  -5.060
  189   HG11  VAL  28          1HG1      VAL  28  24.592 -17.038  -3.435
  190   HG12  VAL  28          2HG1      VAL  28  26.177 -16.446  -3.906
  191   HG13  VAL  28          3HG1      VAL  28  25.501 -15.979  -2.333
  192   HG21  VAL  28          3HG2      VAL  28  23.486 -14.373  -2.255
  193   HG22  VAL  28          1HG2      VAL  28  22.722 -13.913  -3.785
  194   HG23  VAL  28          2HG2      VAL  28  22.679 -15.593  -3.261
  195    H    ARG  29           H        ARG  29  27.871 -14.132  -3.075
  196    HA   ARG  29           HA       ARG  29  29.281 -13.830  -5.647
  197    HB2  ARG  29           HB2      ARG  29  29.910 -12.624  -3.546
  198    HB3  ARG  29           HB3      ARG  29  30.359 -14.177  -2.821
  199    HG2  ARG  29           HG2      ARG  29  32.121 -14.464  -4.527
  200    HG3  ARG  29           HG3      ARG  29  31.600 -12.980  -5.349
  201    HD2  ARG  29           HD2      ARG  29  32.094 -11.704  -3.224
  202    HD3  ARG  29           HD3      ARG  29  32.686 -13.201  -2.502
  203    HE   ARG  29           HE       ARG  29  34.633 -13.077  -3.707
  204   HH11  ARG  29          1HH1      ARG  29  32.454 -10.632  -5.044
  205   HH12  ARG  29          2HH1      ARG  29  33.712  -9.872  -5.963
  206   HH21  ARG  29          1HH2      ARG  29  36.214 -12.034  -4.887
  207   HH22  ARG  29          2HH2      ARG  29  35.819 -10.646  -5.855
  208    H    LEU  30           H        LEU  30  30.305 -15.358  -6.703
  209    HA   LEU  30           HA       LEU  30  30.158 -18.225  -5.902
  210    HB2  LEU  30           HB2      LEU  30  30.460 -16.675  -8.516
  211    HB3  LEU  30           HB3      LEU  30  30.988 -18.334  -8.423
  212    HG   LEU  30           HG       LEU  30  28.665 -18.958  -7.578
  213   HD11  LEU  30          1HD1      LEU  30  27.747 -16.789  -6.934
  214   HD12  LEU  30          2HD1      LEU  30  26.809 -17.407  -8.288
  215   HD13  LEU  30          3HD1      LEU  30  28.018 -16.131  -8.557
  216   HD21  LEU  30          3HD2      LEU  30  29.444 -19.484  -9.800
  217   HD22  LEU  30          1HD2      LEU  30  29.041 -17.862 -10.376
  218   HD23  LEU  30          2HD2      LEU  30  27.742 -18.976  -9.885
  219    HA   PRO  31           HA       PRO  31  34.395 -18.555  -4.968
  220    HB2  PRO  31           HB2      PRO  31  35.321 -20.847  -6.186
  221    HB3  PRO  31           HB3      PRO  31  34.182 -20.829  -4.803
  222    HG2  PRO  31           HG2      PRO  31  33.503 -21.028  -7.760
  223    HG3  PRO  31           HG3      PRO  31  32.932 -22.081  -6.414
  224    HD2  PRO  31           HD2      PRO  31  31.406 -20.055  -7.290
  225    HD3  PRO  31           HD3      PRO  31  31.552 -20.343  -5.537
  226    H    SER  32           H        SER  32  33.756 -18.517  -8.468
  227    HA   SER  32           HA       SER  32  36.424 -17.851  -9.320
  228    HB2  SER  32           HB2      SER  32  33.776 -17.136 -10.633
  229    HB3  SER  32           HB3      SER  32  35.351 -17.266 -11.417
  230    HG   SER  32           HG       SER  32  35.328 -19.514 -10.926
  231    H    GLY  33           H        GLY  33  34.326 -16.002  -7.408
  232    HA2  GLY  33           HA2      GLY  33  34.607 -13.816  -6.635
  233    HA3  GLY  33           HA3      GLY  33  35.695 -13.435  -7.988
  234    H    THR  34           H        THR  34  33.177 -14.869  -9.470
  235    HA   THR  34           HA       THR  34  31.876 -12.504 -10.441
  236    HB   THR  34           HB       THR  34  30.886 -15.383 -10.617
  237    HG1  THR  34           HG1      THR  34  32.179 -15.457 -12.491
  238   HG21  THR  34          1HG2      THR  34  30.014 -14.658 -12.825
  239   HG22  THR  34          2HG2      THR  34  30.560 -12.993 -12.496
  240   HG23  THR  34          3HG2      THR  34  29.286 -13.728 -11.505
  241    H    VAL  35           H        VAL  35  29.739 -11.763 -10.020
  242    HA   VAL  35           HA       VAL  35  28.389 -12.869  -7.587
  243    HB   VAL  35           HB       VAL  35  28.621  -9.943  -8.390
  244   HG11  VAL  35          1HG1      VAL  35  26.384 -10.404  -7.396
  245   HG12  VAL  35          2HG1      VAL  35  27.170 -11.198  -6.011
  246   HG13  VAL  35          3HG1      VAL  35  27.391  -9.461  -6.309
  247   HG21  VAL  35          3HG2      VAL  35  30.675 -10.777  -7.302
  248   HG22  VAL  35          1HG2      VAL  35  29.803  -9.685  -6.223
  249   HG23  VAL  35          2HG2      VAL  35  29.723 -11.441  -5.965
  250    H    MET  36           H        MET  36  26.369 -13.434  -7.827
  251    HA   MET  36           HA       MET  36  24.748 -12.525 -10.179
  252    HB2  MET  36           HB2      MET  36  25.457 -15.283  -9.269
  253    HB3  MET  36           HB3      MET  36  23.725 -15.018  -9.470
  254    HG2  MET  36           HG2      MET  36  24.466 -15.774 -11.559
  255    HG3  MET  36           HG3      MET  36  24.148 -14.056 -11.722
  256    HE1  MET  36           HE1      MET  36  27.050 -16.484 -10.693
  257    HE2  MET  36           HE2      MET  36  26.605 -16.913 -12.355
  258    HE3  MET  36           HE3      MET  36  28.199 -16.229 -12.022
  259    H    ASP  37           H        ASP  37  22.453 -12.660  -9.890
  260    HA   ASP  37           HA       ASP  37  21.352 -11.790  -7.361
  261    HB2  ASP  37           HB2      ASP  37  20.210 -11.216  -9.409
  262    HB3  ASP  37           HB3      ASP  37  20.192 -12.891  -9.943
  263    H    ARG  38           H        ARG  38  20.641 -12.882  -5.672
  264    HA   ARG  38           HA       ARG  38  21.050 -15.521  -4.980
  265    HB2  ARG  38           HB2      ARG  38  20.384 -13.796  -3.405
  266    HB3  ARG  38           HB3      ARG  38  18.811 -13.608  -4.184
  267    HG2  ARG  38           HG2      ARG  38  18.213 -15.941  -3.553
  268    HG3  ARG  38           HG3      ARG  38  19.788 -16.114  -2.740
  269    HD2  ARG  38           HD2      ARG  38  19.189 -14.405  -1.137
  270    HD3  ARG  38           HD3      ARG  38  17.730 -13.978  -2.051
  271    HE   ARG  38           HE       ARG  38  18.102 -16.246  -0.232
  272   HH11  ARG  38          1HH1      ARG  38  16.034 -15.020  -2.854
  273   HH12  ARG  38          2HH1      ARG  38  14.707 -16.030  -2.388
  274   HH21  ARG  38          1HH2      ARG  38  16.344 -17.519   0.296
  275   HH22  ARG  38          2HH2      ARG  38  14.882 -17.428  -0.631
  276    H    SER  39           H        SER  39  17.940 -14.250  -6.357
  277    HA   SER  39           HA       SER  39  16.663 -16.783  -6.155
  278    HB2  SER  39           HB2      SER  39  15.882 -14.383  -7.844
  279    HB3  SER  39           HB3      SER  39  14.845 -15.765  -7.455
  280    HG   SER  39           HG       SER  39  14.527 -13.974  -6.005
  281    H    ILE  40           H        ILE  40  18.368 -15.249  -8.897
  282    HA   ILE  40           HA       ILE  40  17.776 -17.409 -10.764
  283    HB   ILE  40           HB       ILE  40  19.798 -15.141 -10.764
  284   HG12  ILE  40          2HG1      ILE  40  17.343 -15.702 -12.514
  285   HG13  ILE  40          3HG1      ILE  40  17.242 -14.775 -11.027
  286   HG21  ILE  40          1HG2      ILE  40  20.826 -16.957 -12.080
  287   HG22  ILE  40          2HG2      ILE  40  19.310 -17.195 -12.972
  288   HG23  ILE  40          3HG2      ILE  40  20.250 -15.695 -13.152
  289   HD11  ILE  40          3HD1      ILE  40  17.330 -13.257 -12.875
  290   HD12  ILE  40          1HD1      ILE  40  18.842 -13.122 -11.934
  291   HD13  ILE  40          2HD1      ILE  40  18.821 -13.991 -13.488
  292    H    ILE  41           H        ILE  41  20.649 -16.847  -8.624
  293    HA   ILE  41           HA       ILE  41  21.983 -19.167  -9.702
  294    HB   ILE  41           HB       ILE  41  23.187 -17.357  -8.527
  295   HG12  ILE  41          2HG1      ILE  41  24.813 -18.741  -7.318
  296   HG13  ILE  41          3HG1      ILE  41  23.696 -20.118  -7.343
  297   HG21  ILE  41          1HG2      ILE  41  23.391 -17.320  -6.086
  298   HG22  ILE  41          2HG2      ILE  41  21.734 -17.008  -6.580
  299   HG23  ILE  41          3HG2      ILE  41  22.170 -18.596  -5.930
  300   HD11  ILE  41          3HD1      ILE  41  24.786 -18.763  -9.840
  301   HD12  ILE  41          1HD1      ILE  41  25.511 -20.186  -9.075
  302   HD13  ILE  41          2HD1      ILE  41  23.875 -20.293  -9.746
  303    H    LEU  42           H        LEU  42  19.784 -18.868  -6.878
  304    HA   LEU  42           HA       LEU  42  19.967 -21.693  -6.286
  305    HB2  LEU  42           HB2      LEU  42  18.409 -21.362  -4.609
  306    HB3  LEU  42           HB3      LEU  42  19.367 -19.897  -4.673
  307    HG   LEU  42           HG       LEU  42  17.388 -18.938  -6.096
  308   HD11  LEU  42          1HD1      LEU  42  16.032 -21.004  -6.354
  309   HD12  LEU  42          2HD1      LEU  42  15.164 -19.801  -5.404
  310   HD13  LEU  42          3HD1      LEU  42  15.950 -21.171  -4.589
  311   HD21  LEU  42          3HD2      LEU  42  16.306 -18.174  -4.015
  312   HD22  LEU  42          1HD2      LEU  42  18.073 -18.189  -3.827
  313   HD23  LEU  42          2HD2      LEU  42  17.099 -19.479  -3.108
  314    H    ARG  43           H        ARG  43  17.834 -19.846  -8.482
  315    HA   ARG  43           HA       ARG  43  16.137 -22.091  -9.029
  316    HB2  ARG  43           HB2      ARG  43  15.393 -19.812  -9.428
  317    HB3  ARG  43           HB3      ARG  43  16.660 -19.558 -10.637
  318    HG2  ARG  43           HG2      ARG  43  14.474 -19.927 -11.686
  319    HG3  ARG  43           HG3      ARG  43  15.630 -21.177 -12.139
  320    HD2  ARG  43           HD2      ARG  43  14.587 -22.688 -10.365
  321    HD3  ARG  43           HD3      ARG  43  13.387 -21.422 -10.085
  322    HE   ARG  43           HE       ARG  43  12.346 -21.948 -12.095
  323   HH11  ARG  43          1HH1      ARG  43  15.442 -23.720 -12.022
  324   HH12  ARG  43          2HH1      ARG  43  14.941 -24.757 -13.320
  325   HH21  ARG  43          1HH2      ARG  43  11.833 -23.306 -13.791
  326   HH22  ARG  43          2HH2      ARG  43  12.977 -24.498 -14.345
  327    H    HIS  44           H        HIS  44  19.186 -20.962 -10.517
  328    HA   HIS  44           HA       HIS  44  19.120 -22.989 -12.596
  329    HB2  HIS  44           HB2      HIS  44  20.481 -20.798 -12.541
  330    HB3  HIS  44           HB3      HIS  44  21.623 -21.669 -11.513
  331    HD1  HIS  44           HD1      HIS  44  23.239 -23.386 -12.864
  332    HD2  HIS  44           HD2      HIS  44  20.036 -21.773 -15.075
  333    HE1  HIS  44           HE1      HIS  44  23.609 -24.093 -15.276
  334    H    LEU  45           H        LEU  45  20.538 -22.934  -9.285
  335    HA   LEU  45           HA       LEU  45  21.731 -25.505  -9.320
  336    HB2  LEU  45           HB2      LEU  45  20.528 -23.715  -7.199
  337    HB3  LEU  45           HB3      LEU  45  21.018 -25.341  -6.762
  338    HG   LEU  45           HG       LEU  45  22.926 -23.373  -8.096
  339   HD11  LEU  45          1HD1      LEU  45  22.448 -23.956  -5.150
  340   HD12  LEU  45          2HD1      LEU  45  22.204 -22.405  -5.971
  341   HD13  LEU  45          3HD1      LEU  45  23.842 -23.052  -5.787
  342   HD21  LEU  45          3HD2      LEU  45  24.639 -24.894  -7.061
  343   HD22  LEU  45          1HD2      LEU  45  23.674 -25.680  -8.310
  344   HD23  LEU  45          2HD2      LEU  45  23.335 -25.994  -6.592
  345    H    LEU  46           H        LEU  46  18.304 -24.664  -8.830
  346    HA   LEU  46           HA       LEU  46  17.418 -27.366  -8.293
  347    HB2  LEU  46           HB2      LEU  46  16.001 -24.869  -9.322
  348    HB3  LEU  46           HB3      LEU  46  15.153 -26.367  -9.001
  349    HG   LEU  46           HG       LEU  46  16.752 -24.893  -6.861
  350   HD11  LEU  46          1HD1      LEU  46  13.754 -24.806  -7.429
  351   HD12  LEU  46          2HD1      LEU  46  14.905 -23.462  -7.663
  352   HD13  LEU  46          3HD1      LEU  46  14.578 -24.078  -6.038
  353   HD21  LEU  46          3HD2      LEU  46  14.676 -27.130  -6.700
  354   HD22  LEU  46          1HD2      LEU  46  15.368 -26.274  -5.311
  355   HD23  LEU  46          2HD2      LEU  46  16.414 -27.274  -6.338
  356    H    ASN  47           H        ASN  47  18.319 -25.810 -11.303
  357    HA   ASN  47           HA       ASN  47  17.032 -27.932 -12.937
  358    HB2  ASN  47           HB2      ASN  47  17.038 -25.614 -13.758
  359    HB3  ASN  47           HB3      ASN  47  18.794 -25.566 -13.707
  360   HD21  ASN  47          1HD2      ASN  47  16.030 -27.314 -15.252
  361   HD22  ASN  47          2HD2      ASN  47  16.926 -27.710 -16.702
  362    H    SER  48           H        SER  48  20.360 -26.879 -12.012
  363    HA   SER  48           HA       SER  48  21.430 -29.584 -12.181
  364    HB2  SER  48           HB2      SER  48  21.989 -27.557 -14.367
  365    HB3  SER  48           HB3      SER  48  23.259 -28.680 -13.865
  366    HG   SER  48           HG       SER  48  20.647 -29.491 -14.699
  367    HA   PRO  49           HA       PRO  49  24.270 -27.612  -9.359
  368    HB2  PRO  49           HB2      PRO  49  26.231 -29.448  -9.088
  369    HB3  PRO  49           HB3      PRO  49  24.542 -29.815  -8.639
  370    HG2  PRO  49           HG2      PRO  49  25.933 -30.476 -11.257
  371    HG3  PRO  49           HG3      PRO  49  25.024 -31.589 -10.174
  372    HD2  PRO  49           HD2      PRO  49  23.880 -30.376 -12.342
  373    HD3  PRO  49           HD3      PRO  49  22.959 -30.692 -10.845
  374    H    THR  50           H        THR  50  24.386 -26.130 -11.486
  375    HA   THR  50           HA       THR  50  27.231 -25.702 -12.179
  376    HB   THR  50           HB       THR  50  26.421 -25.254 -14.579
  377    HG1  THR  50           HG1      THR  50  24.597 -26.539 -15.152
  378   HG21  THR  50          1HG2      THR  50  26.392 -28.143 -13.628
  379   HG22  THR  50          2HG2      THR  50  27.848 -27.183 -13.976
  380   HG23  THR  50          3HG2      THR  50  26.713 -27.550 -15.278
  381    H    ASP  51           H        ASP  51  27.735 -23.755 -13.056
  382    HA   ASP  51           HA       ASP  51  26.543 -21.383 -11.985
  383    HB2  ASP  51           HB2      ASP  51  28.908 -21.793 -12.370
  384    HB3  ASP  51           HB3      ASP  51  28.645 -21.946 -14.101
  385    HA   PRO  52           HA       PRO  52  23.370 -20.855 -15.075
  386    HB2  PRO  52           HB2      PRO  52  22.719 -18.174 -14.752
  387    HB3  PRO  52           HB3      PRO  52  22.231 -19.487 -13.639
  388    HG2  PRO  52           HG2      PRO  52  24.572 -17.604 -13.376
  389    HG3  PRO  52           HG3      PRO  52  23.375 -18.074 -12.128
  390    HD2  PRO  52           HD2      PRO  52  25.821 -19.259 -12.268
  391    HD3  PRO  52           HD3      PRO  52  24.360 -20.238 -11.915
  392    H    PHE  53           H        PHE  53  26.291 -18.904 -15.359
  393    HA   PHE  53           HA       PHE  53  25.552 -18.238 -18.194
  394    HB2  PHE  53           HB2      PHE  53  27.345 -16.774 -16.219
  395    HB3  PHE  53           HB3      PHE  53  27.074 -16.313 -17.907
  396    HD1  PHE  53           HD2      PHE  53  24.613 -15.852 -18.651
  397    HD2  PHE  53           HD1      PHE  53  25.907 -15.885 -14.539
  398    HE1  PHE  53           HE2      PHE  53  22.617 -14.522 -18.011
  399    HE2  PHE  53           HE1      PHE  53  23.885 -14.558 -13.907
  400    HZ   PHE  53           HZ       PHE  53  22.269 -13.866 -15.623
  401    H    ASN  54           H        ASN  54  28.181 -19.429 -16.076
  402    HA   ASN  54           HA       ASN  54  29.963 -19.791 -18.436
  403    HB2  ASN  54           HB2      ASN  54  30.769 -18.661 -16.373
  404    HB3  ASN  54           HB3      ASN  54  30.461 -20.139 -15.454
  405   HD21  ASN  54          1HD2      ASN  54  32.450 -18.759 -18.121
  406   HD22  ASN  54          2HD2      ASN  54  33.741 -19.935 -17.953
  407    H    ARG  55           H        ARG  55  28.029 -21.710 -16.205
  408    HA   ARG  55           HA       ARG  55  27.479 -23.822 -16.007
  409    HB2  ARG  55           HB2      ARG  55  28.233 -23.910 -18.949
  410    HB3  ARG  55           HB3      ARG  55  27.540 -25.281 -18.094
  411    HG2  ARG  55           HG2      ARG  55  25.733 -24.274 -19.132
  412    HG3  ARG  55           HG3      ARG  55  25.584 -23.892 -17.421
  413    HD2  ARG  55           HD2      ARG  55  26.508 -21.611 -17.905
  414    HD3  ARG  55           HD3      ARG  55  26.573 -22.011 -19.619
  415    HE   ARG  55           HE       ARG  55  24.296 -21.233 -17.988
  416   HH11  ARG  55          1HH1      ARG  55  25.053 -22.985 -20.966
  417   HH12  ARG  55          2HH1      ARG  55  23.463 -22.717 -21.621
  418   HH21  ARG  55          1HH2      ARG  55  22.323 -20.908 -18.873
  419   HH22  ARG  55          2HH2      ARG  55  21.923 -21.558 -20.443
  420    H    GLN  56           H        GLN  56  30.394 -23.076 -15.553
  421    HA   GLN  56           HA       GLN  56  31.730 -25.619 -15.111
  422    HB2  GLN  56           HB2      GLN  56  32.915 -24.386 -13.344
  423    HB3  GLN  56           HB3      GLN  56  32.921 -23.486 -14.857
  424    HG2  GLN  56           HG2      GLN  56  31.060 -22.057 -13.990
  425    HG3  GLN  56           HG3      GLN  56  31.079 -22.959 -12.473
  426   HE21  GLN  56          1HE2      GLN  56  31.368 -20.152 -12.463
  427   HE22  GLN  56          2HE2      GLN  56  33.020 -19.837 -11.912
  428    H    MET  57           H        MET  57  31.797 -26.718 -13.003
  429    HA   MET  57           HA       MET  57  29.179 -27.247 -11.908
  430    HB2  MET  57           HB2      MET  57  31.944 -28.030 -10.916
  431    HB3  MET  57           HB3      MET  57  30.435 -28.634 -10.242
  432    HG2  MET  57           HG2      MET  57  31.346 -29.034 -13.122
  433    HG3  MET  57           HG3      MET  57  31.454 -30.227 -11.836
  434    HE1  MET  57           HE1      MET  57  30.177 -30.740 -14.691
  435    HE2  MET  57           HE2      MET  57  30.311 -31.980 -13.430
  436    HE3  MET  57           HE3      MET  57  28.749 -31.702 -14.244
  437    H    LEU  58           H        LEU  58  28.240 -26.682 -10.009
  438    HA   LEU  58           HA       LEU  58  29.496 -24.765  -8.158
  439    HB2  LEU  58           HB2      LEU  58  28.668 -23.487 -10.144
  440    HB3  LEU  58           HB3      LEU  58  27.052 -24.105  -9.860
  441    HG   LEU  58           HG       LEU  58  27.531 -21.738  -9.210
  442   HD11  LEU  58          1HD1      LEU  58  26.129 -21.706  -7.276
  443   HD12  LEU  58          2HD1      LEU  58  26.504 -23.382  -6.879
  444   HD13  LEU  58          3HD1      LEU  58  25.572 -23.008  -8.346
  445   HD21  LEU  58          3HD2      LEU  58  28.999 -22.928  -6.826
  446   HD22  LEU  58          1HD2      LEU  58  28.637 -21.224  -7.103
  447   HD23  LEU  58          2HD2      LEU  58  29.764 -22.063  -8.189
  448    H    THR  59           H        THR  59  28.738 -25.015  -6.137
  449    HA   THR  59           HA       THR  59  26.209 -26.540  -5.610
  450    HB   THR  59           HB       THR  59  28.848 -26.865  -4.110
  451    HG1  THR  59           HG1      THR  59  28.835 -28.917  -5.158
  452   HG21  THR  59          1HG2      THR  59  26.202 -28.389  -3.956
  453   HG22  THR  59          2HG2      THR  59  26.966 -27.450  -2.648
  454   HG23  THR  59          3HG2      THR  59  27.732 -28.929  -3.218
  455    H    GLU  60           H        GLU  60  25.180 -26.003  -3.625
  456    HA   GLU  60           HA       GLU  60  25.018 -23.313  -2.892
  457    HB2  GLU  60           HB2      GLU  60  24.416 -25.817  -1.258
  458    HB3  GLU  60           HB3      GLU  60  23.940 -24.196  -0.765
  459    HG2  GLU  60           HG2      GLU  60  22.576 -23.935  -2.805
  460    HG3  GLU  60           HG3      GLU  60  23.047 -25.555  -3.344
  461    H    SER  61           H        SER  61  27.127 -25.811  -1.408
  462    HA   SER  61           HA       SER  61  28.099 -24.317   0.783
  463    HB2  SER  61           HB2      SER  61  29.612 -26.410  -0.828
  464    HB3  SER  61           HB3      SER  61  29.870 -25.964   0.868
  465    HG   SER  61           HG       SER  61  28.618 -27.889   0.683
  466    H    MET  62           H        MET  62  28.792 -23.789  -2.554
  467    HA   MET  62           HA       MET  62  31.435 -22.501  -2.123
  468    HB2  MET  62           HB2      MET  62  29.788 -22.716  -4.665
  469    HB3  MET  62           HB3      MET  62  31.490 -22.283  -4.509
  470    HG2  MET  62           HG2      MET  62  32.017 -24.559  -3.698
  471    HG3  MET  62           HG3      MET  62  30.315 -25.009  -3.860
  472    HE1  MET  62           HE1      MET  62  30.940 -27.092  -5.330
  473    HE2  MET  62           HE2      MET  62  31.972 -27.006  -6.768
  474    HE3  MET  62           HE3      MET  62  32.659 -26.683  -5.158
  475    H    LEU  63           H        LEU  63  28.149 -21.572  -2.017
  476    HA   LEU  63           HA       LEU  63  28.513 -18.839  -3.098
  477    HB2  LEU  63           HB2      LEU  63  26.083 -20.325  -2.010
  478    HB3  LEU  63           HB3      LEU  63  26.057 -18.719  -2.700
  479    HG   LEU  63           HG       LEU  63  26.747 -21.290  -4.184
  480   HD11  LEU  63          1HD1      LEU  63  24.362 -19.399  -4.383
  481   HD12  LEU  63          2HD1      LEU  63  24.354 -21.002  -3.623
  482   HD13  LEU  63          3HD1      LEU  63  24.639 -20.860  -5.359
  483   HD21  LEU  63          3HD2      LEU  63  26.662 -18.400  -5.174
  484   HD22  LEU  63          1HD2      LEU  63  26.705 -19.826  -6.227
  485   HD23  LEU  63          2HD2      LEU  63  28.070 -19.493  -5.162
  486    H    GLU  64           H        GLU  64  28.073 -16.963  -2.006
  487    HA   GLU  64           HA       GLU  64  27.452 -16.966   0.865
  488    HB2  GLU  64           HB2      GLU  64  29.967 -17.214   0.717
  489    HB3  GLU  64           HB3      GLU  64  30.011 -15.692  -0.168
  490    HG2  GLU  64           HG2      GLU  64  30.556 -15.166   2.088
  491    HG3  GLU  64           HG3      GLU  64  28.897 -14.612   1.871
  492    HA   PRO  65           HA       PRO  65  25.351 -13.311  -0.937
  493    HB2  PRO  65           HB2      PRO  65  24.625 -12.984   1.966
  494    HB3  PRO  65           HB3      PRO  65  23.597 -12.782   0.510
  495    HG2  PRO  65           HG2      PRO  65  23.427 -15.042   2.004
  496    HG3  PRO  65           HG3      PRO  65  23.434 -15.145   0.214
  497    HD2  PRO  65           HD2      PRO  65  25.744 -15.593   2.121
  498    HD3  PRO  65           HD3      PRO  65  25.241 -16.571   0.705
  499    H    VAL  66           H        VAL  66  26.364 -11.379  -1.270
  500    HA   VAL  66           HA       VAL  66  28.747 -10.865   0.432
  501    HB   VAL  66           HB       VAL  66  29.395 -11.279  -1.718
  502   HG11  VAL  66          1HG1      VAL  66  27.585  -9.094  -2.789
  503   HG12  VAL  66          2HG1      VAL  66  28.778 -10.023  -3.719
  504   HG13  VAL  66          3HG1      VAL  66  27.383 -10.842  -3.017
  505   HG21  VAL  66          3HG2      VAL  66  30.685  -9.326  -2.293
  506   HG22  VAL  66          1HG2      VAL  66  29.588  -8.263  -1.385
  507   HG23  VAL  66          2HG2      VAL  66  30.590  -9.459  -0.530
  508    HA   PRO  67           HA       PRO  67  26.375  -7.454   2.036
  509    HB2  PRO  67           HB2      PRO  67  27.898  -6.763   4.179
  510    HB3  PRO  67           HB3      PRO  67  26.994  -8.307   4.103
  511    HG2  PRO  67           HG2      PRO  67  29.931  -7.833   3.458
  512    HG3  PRO  67           HG3      PRO  67  29.213  -9.095   4.513
  513    HD2  PRO  67           HD2      PRO  67  29.857  -9.579   1.902
  514    HD3  PRO  67           HD3      PRO  67  28.423 -10.314   2.683
  515    H    GLU  68           H        GLU  68  29.852  -6.979   1.234
  516    HA   GLU  68           HA       GLU  68  29.803  -4.160   1.485
  517    HB2  GLU  68           HB2      GLU  68  31.877  -4.132   0.259
  518    HB3  GLU  68           HB3      GLU  68  31.863  -5.420   1.460
  519    HG2  GLU  68           HG2      GLU  68  31.451  -7.096  -0.301
  520    HG3  GLU  68           HG3      GLU  68  31.368  -5.823  -1.523
  521    H    LEU  69           H        LEU  69  28.488  -6.123  -1.067
  522    HA   LEU  69           HA       LEU  69  27.972  -3.736  -2.789
  523    HB2  LEU  69           HB2      LEU  69  27.384  -6.707  -3.077
  524    HB3  LEU  69           HB3      LEU  69  26.724  -5.488  -4.161
  525    HG   LEU  69           HG       LEU  69  29.699  -6.000  -3.743
  526   HD11  LEU  69          1HD1      LEU  69  29.590  -6.971  -6.010
  527   HD12  LEU  69          2HD1      LEU  69  27.834  -6.710  -6.058
  528   HD13  LEU  69          3HD1      LEU  69  28.540  -7.851  -4.892
  529   HD21  LEU  69          3HD2      LEU  69  29.916  -4.569  -5.814
  530   HD22  LEU  69          1HD2      LEU  69  29.376  -3.666  -4.398
  531   HD23  LEU  69          2HD2      LEU  69  28.200  -4.132  -5.648
  532    H    LYS  70           H        LYS  70  26.129  -6.112  -0.758
  533    HA   LYS  70           HA       LYS  70  23.613  -4.974  -1.333
  534    HB2  LYS  70           HB2      LYS  70  24.019  -7.196  -0.318
  535    HB3  LYS  70           HB3      LYS  70  24.450  -6.406   1.215
  536    HG2  LYS  70           HG2      LYS  70  22.236  -5.482   1.461
  537    HG3  LYS  70           HG3      LYS  70  21.774  -5.974  -0.182
  538    HD2  LYS  70           HD2      LYS  70  21.914  -8.342   0.438
  539    HD3  LYS  70           HD3      LYS  70  22.465  -7.915   2.068
  540    HE2  LYS  70           HE2      LYS  70  20.356  -6.728   2.509
  541    HE3  LYS  70           HE3      LYS  70  19.810  -7.013   0.850
  542    HZ1  LYS  70           HZ1      LYS  70  19.680  -9.337   1.279
  543    HZ2  LYS  70           HZ2      LYS  70  18.864  -8.585   2.468
  544    HZ3  LYS  70           HZ3      LYS  70  20.352  -9.193   2.777
  545    H    GLU  71           H        GLU  71  25.920  -3.983   1.225
  546    HA   GLU  71           HA       GLU  71  24.185  -2.052   2.425
  547    HB2  GLU  71           HB2      GLU  71  26.003  -1.293   3.652
  548    HB3  GLU  71           HB3      GLU  71  26.192  -3.033   3.504
  549    HG2  GLU  71           HG2      GLU  71  27.920  -2.664   1.717
  550    HG3  GLU  71           HG3      GLU  71  27.739  -0.927   1.934
  551    H    GLN  72           H        GLN  72  26.337  -1.857  -0.351
  552    HA   GLN  72           HA       GLN  72  26.076   1.055  -0.700
  553    HB2  GLN  72           HB2      GLN  72  27.180  -1.127  -2.509
  554    HB3  GLN  72           HB3      GLN  72  27.093   0.586  -2.930
  555    HG2  GLN  72           HG2      GLN  72  28.462   1.167  -0.932
  556    HG3  GLN  72           HG3      GLN  72  28.648  -0.550  -0.575
  557   HE21  GLN  72          1HE2      GLN  72  30.005  -1.850  -1.978
  558   HE22  GLN  72          2HE2      GLN  72  31.102  -1.092  -3.133
  559    H    ILE  73           H        ILE  73  24.612  -1.850  -2.170
  560    HA   ILE  73           HA       ILE  73  22.861  -0.580  -4.007
  561    HB   ILE  73           HB       ILE  73  22.800  -3.219  -2.499
  562   HG12  ILE  73          2HG1      ILE  73  23.072  -2.615  -5.478
  563   HG13  ILE  73          3HG1      ILE  73  24.445  -2.741  -4.396
  564   HG21  ILE  73          1HG2      ILE  73  20.698  -2.175  -4.425
  565   HG22  ILE  73          2HG2      ILE  73  20.909  -3.899  -4.031
  566   HG23  ILE  73          3HG2      ILE  73  20.457  -2.780  -2.766
  567   HD11  ILE  73          3HD1      ILE  73  24.233  -4.830  -5.517
  568   HD12  ILE  73          1HD1      ILE  73  23.746  -5.097  -3.835
  569   HD13  ILE  73          2HD1      ILE  73  22.522  -4.988  -5.118
  570    H    GLN  74           H        GLN  74  22.108  -1.536  -0.591
  571    HA   GLN  74           HA       GLN  74  19.488  -0.412  -0.716
  572    HB2  GLN  74           HB2      GLN  74  19.356  -0.776   1.640
  573    HB3  GLN  74           HB3      GLN  74  20.177  -2.125   0.889
  574    HG2  GLN  74           HG2      GLN  74  21.456  -1.791   2.806
  575    HG3  GLN  74           HG3      GLN  74  22.379  -0.961   1.573
  576   HE21  GLN  74          1HE2      GLN  74  23.397   0.686   2.686
  577   HE22  GLN  74          2HE2      GLN  74  22.561   1.820   3.743
  578    H    ALA  75           H        ALA  75  22.597   1.146   0.094
  579    HA   ALA  75           HA       ALA  75  21.434   3.612   1.063
  580    HB1  ALA  75           HB1      ALA  75  24.159   3.032  -0.195
  581    HB2  ALA  75           HB2      ALA  75  23.706   4.501   0.694
  582    HB3  ALA  75           HB3      ALA  75  23.780   2.953   1.536
  583    H    TRP  76           H        TRP  76  22.491   2.514  -2.188
  584    HA   TRP  76           HA       TRP  76  21.857   4.973  -3.545
  585    HB2  TRP  76           HB2      TRP  76  23.418   3.260  -4.393
  586    HB3  TRP  76           HB3      TRP  76  22.081   2.127  -4.585
  587    HD1  TRP  76           HD1      TRP  76  23.601   5.268  -6.107
  588    HE1  TRP  76           HE1      TRP  76  22.589   5.729  -8.423
  589    HE3  TRP  76           HE3      TRP  76  19.971   1.669  -6.109
  590    HZ2  TRP  76           HZ2      TRP  76  20.361   4.757  -9.997
  591    HZ3  TRP  76           HZ3      TRP  76  18.414   1.463  -8.025
  592    HH2  TRP  76           HH2      TRP  76  18.557   3.023  -9.945
  593    H    MET  77           H        MET  77  19.968   1.914  -3.129
  594    HA   MET  77           HA       MET  77  17.630   2.734  -4.536
  595    HB2  MET  77           HB2      MET  77  18.016   0.840  -2.177
  596    HB3  MET  77           HB3      MET  77  16.473   1.043  -3.021
  597    HG2  MET  77           HG2      MET  77  17.469   0.278  -5.130
  598    HG3  MET  77           HG3      MET  77  19.052   0.188  -4.389
  599    HE1  MET  77           HE1      MET  77  15.676  -1.518  -5.015
  600    HE2  MET  77           HE2      MET  77  15.579  -2.780  -3.773
  601    HE3  MET  77           HE3      MET  77  15.388  -1.071  -3.315
  602    H    ARG  78           H        ARG  78  18.576   3.364  -1.144
  603    HA   ARG  78           HA       ARG  78  16.164   4.493  -0.218
  604    HB2  ARG  78           HB2      ARG  78  18.291   3.891   1.062
  605    HB3  ARG  78           HB3      ARG  78  18.930   5.471   0.572
  606    HG2  ARG  78           HG2      ARG  78  16.918   6.527   1.688
  607    HG3  ARG  78           HG3      ARG  78  16.413   4.913   2.216
  608    HD2  ARG  78           HD2      ARG  78  18.995   6.357   2.952
  609    HD3  ARG  78           HD3      ARG  78  17.580   6.158   3.992
  610    HE   ARG  78           HE       ARG  78  18.673   3.617   3.058
  611   HH11  ARG  78          1HH1      ARG  78  19.089   6.078   5.564
  612   HH12  ARG  78          2HH1      ARG  78  19.862   4.964   6.654
  613   HH21  ARG  78          1HH2      ARG  78  19.752   2.241   4.498
  614   HH22  ARG  78          2HH2      ARG  78  20.216   2.853   6.062
  615    H    GLU  79           H        GLU  79  18.805   6.094  -2.049
  616    HA   GLU  79           HA       GLU  79  17.680   8.731  -1.974
  617    HB2  GLU  79           HB2      GLU  79  19.545   7.471  -4.036
  618    HB3  GLU  79           HB3      GLU  79  19.173   9.181  -3.917
  619    HG2  GLU  79           HG2      GLU  79  20.550   7.534  -1.743
  620    HG3  GLU  79           HG3      GLU  79  21.370   8.564  -2.911
  621    H    LYS  80           H        LYS  80  17.173   5.987  -4.237
  622    HA   LYS  80           HA       LYS  80  15.482   7.511  -6.045
  623    HB2  LYS  80           HB2      LYS  80  15.525   4.488  -5.625
  624    HB3  LYS  80           HB3      LYS  80  14.962   5.373  -7.034
  625    HG2  LYS  80           HG2      LYS  80  17.834   5.090  -6.100
  626    HG3  LYS  80           HG3      LYS  80  17.101   4.270  -7.455
  627    HD2  LYS  80           HD2      LYS  80  17.498   7.292  -7.291
  628    HD3  LYS  80           HD3      LYS  80  18.585   6.164  -8.095
  629    HE2  LYS  80           HE2      LYS  80  16.816   5.445  -9.644
  630    HE3  LYS  80           HE3      LYS  80  15.654   6.510  -8.850
  631    HZ1  LYS  80           HZ1      LYS  80  17.100   8.399  -9.502
  632    HZ2  LYS  80           HZ2      LYS  80  16.550   7.577 -10.801
  633    HZ3  LYS  80           HZ3      LYS  80  18.098   7.363 -10.314
  634    H    GLN  81           H        GLN  81  14.798   5.337  -3.286
  635    HA   GLN  81           HA       GLN  81  11.932   5.525  -3.415
  636    HB2  GLN  81           HB2      GLN  81  13.899   4.800  -1.204
  637    HB3  GLN  81           HB3      GLN  81  12.149   4.746  -0.966
  638    HG2  GLN  81           HG2      GLN  81  13.559   3.170  -3.165
  639    HG3  GLN  81           HG3      GLN  81  13.234   2.543  -1.556
  640   HE21  GLN  81          1HE2      GLN  81  12.122   0.912  -3.195
  641   HE22  GLN  81          2HE2      GLN  81  10.419   1.236  -3.451
  642    H    SER  82           H        SER  82  14.328   7.663  -1.852
  643    HA   SER  82           HA       SER  82  12.488   9.184  -0.300
  644    HB2  SER  82           HB2      SER  82  15.095  10.012  -1.641
  645    HB3  SER  82           HB3      SER  82  14.212  10.988  -0.456
  646    HG   SER  82           HG       SER  82  15.376   8.403  -0.055
  647    H    SER  83           H        SER  83  12.779   9.124  -3.772
  648    HA   SER  83           HA       SER  83  11.467  11.726  -4.193
  649    HB2  SER  83           HB2      SER  83  12.019   9.431  -6.108
  650    HB3  SER  83           HB3      SER  83  11.438  11.045  -6.540
  651    HG   SER  83           HG       SER  83  13.703  10.906  -6.832
  652    H    ASP  84           H        ASP  84  10.313   8.577  -3.321
  653    HA   ASP  84           HA       ASP  84   7.728   8.786  -4.741
  654    HB2  ASP  84           HB2      ASP  84   8.901   6.612  -4.416
  655    HB3  ASP  84           HB3      ASP  84   8.713   6.782  -2.667
  656    H    HIS  85           H        HIS  85   9.007   9.501  -1.546
  657    HA   HIS  85           HA       HIS  85   6.494   9.548  -0.131
  658    HB2  HIS  85           HB2      HIS  85   8.683   9.059   0.925
  659    HB3  HIS  85           HB3      HIS  85   9.198  10.717   0.641
  660    HD1  HIS  85           HD1      HIS  85   8.168  12.564   2.293
  661    HD2  HIS  85           HD2      HIS  85   6.806   8.630   2.854
  662    HE1  HIS  85           HE1      HIS  85   6.920  12.553   4.524
  Start of MODEL   17
    1    H2   PRO   1           H2       PRO   1   2.662   2.436 -12.620
    2    H3   PRO   1           H3       PRO   1   3.559   1.825 -11.379
    3    HA   PRO   1           HA       PRO   1   5.352   1.276 -12.718
    4    HB2  PRO   1           HB2      PRO   1   3.546   1.688 -15.139
    5    HB3  PRO   1           HB3      PRO   1   5.090   0.780 -15.050
    6    HG2  PRO   1           HG2      PRO   1   2.641  -0.439 -14.687
    7    HG3  PRO   1           HG3      PRO   1   4.088  -0.955 -13.760
    8    HD2  PRO   1           HD2      PRO   1   1.697   0.418 -12.756
    9    HD3  PRO   1           HD3      PRO   1   3.037  -0.322 -11.858
   10    H    GLY   2           H        GLY   2   5.984   3.202 -11.634
   11    HA2  GLY   2           HA2      GLY   2   6.747   5.426 -11.554
   12    HA3  GLY   2           HA3      GLY   2   6.093   5.737 -13.178
   13    H    SER   3           H        SER   3   4.135   4.149 -10.785
   14    HA   SER   3           HA       SER   3   2.201   6.456 -10.780
   15    HB2  SER   3           HB2      SER   3   1.554   3.512 -10.420
   16    HB3  SER   3           HB3      SER   3   0.455   4.843 -10.827
   17    HG   SER   3           HG       SER   3   1.379   4.938 -12.902
   18    H    ALA   4           H        ALA   4   3.505   3.738  -8.887
   19    HA   ALA   4           HA       ALA   4   2.973   5.167  -6.309
   20    HB1  ALA   4           HB1      ALA   4   1.095   3.585  -6.771
   21    HB2  ALA   4           HB2      ALA   4   2.280   2.268  -6.977
   22    HB3  ALA   4           HB3      ALA   4   2.078   3.041  -5.397
   23    H    GLU   5           H        GLU   5   5.281   4.022  -8.256
   24    HA   GLU   5           HA       GLU   5   7.156   3.109  -6.161
   25    HB2  GLU   5           HB2      GLU   5   7.679   1.084  -7.365
   26    HB3  GLU   5           HB3      GLU   5   5.995   1.071  -6.894
   27    HG2  GLU   5           HG2      GLU   5   6.977   1.785  -9.710
   28    HG3  GLU   5           HG3      GLU   5   6.528   0.168  -9.198
   29    H    ILE   6           H        ILE   6   9.350   2.874  -6.957
   30    HA   ILE   6           HA       ILE   6  10.099   4.849  -9.050
   31    HB   ILE   6           HB       ILE   6  11.819   3.215  -7.150
   32   HG12  ILE   6          2HG1      ILE   6  10.500   4.725  -5.785
   33   HG13  ILE   6          3HG1      ILE   6  12.180   5.226  -5.825
   34   HG21  ILE   6          1HG2      ILE   6  13.597   4.893  -7.708
   35   HG22  ILE   6          2HG2      ILE   6  13.153   3.837  -9.038
   36   HG23  ILE   6          3HG2      ILE   6  12.554   5.509  -9.004
   37   HD11  ILE   6          3HD1      ILE   6   9.908   6.508  -7.416
   38   HD12  ILE   6          1HD1      ILE   6  10.673   7.156  -5.952
   39   HD13  ILE   6          2HD1      ILE   6  11.609   7.029  -7.451
   40    H    ASP   7           H        ASP   7  11.034   4.280 -10.969
   41    HA   ASP   7           HA       ASP   7  11.283   1.406 -11.718
   42    HB2  ASP   7           HB2      ASP   7  11.584   3.974 -13.317
   43    HB3  ASP   7           HB3      ASP   7  11.872   2.348 -13.957
   44    H    TYR   8           H        TYR   8  13.047   0.614 -10.644
   45    HA   TYR   8           HA       TYR   8  15.472   2.134 -10.286
   46    HB2  TYR   8           HB2      TYR   8  14.909  -0.780  -9.695
   47    HB3  TYR   8           HB3      TYR   8  16.302   0.135  -9.182
   48    HD1  TYR   8           HD1      TYR   8  15.956   2.265  -7.748
   49    HD2  TYR   8           HD2      TYR   8  12.937  -0.774  -8.276
   50    HE1  TYR   8           HE1      TYR   8  14.888   2.964  -5.623
   51    HE2  TYR   8           HE2      TYR   8  11.834  -0.038  -6.176
   52    HH   TYR   8           HH       TYR   8  13.198   2.596  -4.133
   53    H    SER   9           H        SER   9  14.530   1.008 -13.134
   54    HA   SER   9           HA       SER   9  16.741  -0.338 -14.308
   55    HB2  SER   9           HB2      SER   9  15.046   1.840 -15.559
   56    HB3  SER   9           HB3      SER   9  15.887   0.539 -16.406
   57    HG   SER   9           HG       SER   9  14.435  -0.946 -15.495
   58    H    ASP  10           H        ASP  10  16.540   2.914 -13.109
   59    HA   ASP  10           HA       ASP  10  18.749   4.108 -14.523
   60    HB2  ASP  10           HB2      ASP  10  16.844   5.292 -13.414
   61    HB3  ASP  10           HB3      ASP  10  17.469   4.766 -11.847
   62    H    ALA  11           H        ALA  11  18.801   1.602 -12.224
   63    HA   ALA  11           HA       ALA  11  20.998   2.288 -10.572
   64    HB1  ALA  11           HB1      ALA  11  21.081  -0.144 -10.111
   65    HB2  ALA  11           HB2      ALA  11  19.432   0.464 -10.077
   66    HB3  ALA  11           HB3      ALA  11  20.004  -0.451 -11.487
   67    HA   PRO  12           HA       PRO  12  24.527   1.692 -13.300
   68    HB2  PRO  12           HB2      PRO  12  26.540   1.345 -11.537
   69    HB3  PRO  12           HB3      PRO  12  25.694   2.914 -11.689
   70    HG2  PRO  12           HG2      PRO  12  25.202   0.730  -9.646
   71    HG3  PRO  12           HG3      PRO  12  25.416   2.491  -9.350
   72    HD2  PRO  12           HD2      PRO  12  22.980   1.270  -9.566
   73    HD3  PRO  12           HD3      PRO  12  23.247   2.962 -10.113
   74    H    ASP  13           H        ASP  13  25.979   0.023 -13.988
   75    HA   ASP  13           HA       ASP  13  25.010  -2.631 -13.939
   76    HB2  ASP  13           HB2      ASP  13  27.759  -1.514 -14.649
   77    HB3  ASP  13           HB3      ASP  13  27.229  -3.156 -14.998
   78    H    GLU  14           H        GLU  14  26.872  -1.058 -11.540
   79    HA   GLU  14           HA       GLU  14  28.257  -3.197 -10.222
   80    HB2  GLU  14           HB2      GLU  14  26.767  -0.895  -8.887
   81    HB3  GLU  14           HB3      GLU  14  28.132  -1.792  -8.239
   82    HG2  GLU  14           HG2      GLU  14  28.174   0.144 -10.583
   83    HG3  GLU  14           HG3      GLU  14  28.744   0.466  -8.967
   84    H    PHE  15           H        PHE  15  24.850  -2.160 -10.191
   85    HA   PHE  15           HA       PHE  15  24.133  -4.106  -8.054
   86    HB2  PHE  15           HB2      PHE  15  22.671  -1.702  -9.193
   87    HB3  PHE  15           HB3      PHE  15  22.159  -2.667  -7.803
   88    HD1  PHE  15           HD1      PHE  15  25.340  -2.687  -6.789
   89    HD2  PHE  15           HD2      PHE  15  22.314   0.254  -7.712
   90    HE1  PHE  15           HE1      PHE  15  26.480  -1.061  -5.342
   91    HE2  PHE  15           HE2      PHE  15  23.500   1.901  -6.295
   92    HZ   PHE  15           HZ       PHE  15  25.580   1.257  -5.110
   93    H    ARG  16           H        ARG  16  24.164  -4.167 -11.359
   94    HA   ARG  16           HA       ARG  16  21.485  -5.486 -11.638
   95    HB2  ARG  16           HB2      ARG  16  23.234  -3.918 -13.539
   96    HB3  ARG  16           HB3      ARG  16  21.910  -4.931 -14.122
   97    HG2  ARG  16           HG2      ARG  16  20.245  -3.622 -13.152
   98    HG3  ARG  16           HG3      ARG  16  21.327  -2.912 -11.955
   99    HD2  ARG  16           HD2      ARG  16  20.673  -1.269 -13.663
  100    HD3  ARG  16           HD3      ARG  16  22.421  -1.547 -13.593
  101    HE   ARG  16           HE       ARG  16  21.126  -3.193 -15.592
  102   HH11  ARG  16          1HH1      ARG  16  22.224   0.125 -15.045
  103   HH12  ARG  16          2HH1      ARG  16  22.666   0.346 -16.720
  104   HH21  ARG  16          1HH2      ARG  16  21.667  -2.812 -17.756
  105   HH22  ARG  16          2HH2      ARG  16  22.305  -1.273 -18.233
  106    H    ASP  17           H        ASP  17  21.312  -7.481 -12.317
  107    HA   ASP  17           HA       ASP  17  23.711  -9.120 -12.896
  108    HB2  ASP  17           HB2      ASP  17  22.245  -9.983 -11.232
  109    HB3  ASP  17           HB3      ASP  17  20.828  -9.773 -12.255
  110    HA   PRO  18           HA       PRO  18  23.143  -8.745 -17.247
  111    HB2  PRO  18           HB2      PRO  18  23.910 -11.627 -17.620
  112    HB3  PRO  18           HB3      PRO  18  24.653 -10.166 -18.312
  113    HG2  PRO  18           HG2      PRO  18  25.795 -11.552 -16.255
  114    HG3  PRO  18           HG3      PRO  18  25.909  -9.759 -16.372
  115    HD2  PRO  18           HD2      PRO  18  24.118 -11.452 -14.643
  116    HD3  PRO  18           HD3      PRO  18  24.959  -9.925 -14.266
  117    H    LEU  19           H        LEU  19  21.691 -11.685 -15.869
  118    HA   LEU  19           HA       LEU  19  19.877 -12.032 -18.216
  119    HB2  LEU  19           HB2      LEU  19  21.157 -13.966 -17.467
  120    HB3  LEU  19           HB3      LEU  19  20.559 -13.775 -15.825
  121    HG   LEU  19           HG       LEU  19  18.257 -14.339 -16.612
  122   HD11  LEU  19          1HD1      LEU  19  17.982 -15.336 -18.867
  123   HD12  LEU  19          2HD1      LEU  19  19.635 -14.860 -19.289
  124   HD13  LEU  19          3HD1      LEU  19  18.405 -13.625 -18.976
  125   HD21  LEU  19          3HD2      LEU  19  20.417 -16.363 -17.323
  126   HD22  LEU  19          1HD2      LEU  19  18.707 -16.733 -16.994
  127   HD23  LEU  19          2HD2      LEU  19  19.738 -16.079 -15.711
  128    H    MET  20           H        MET  20  19.759 -11.275 -14.730
  129    HA   MET  20           HA       MET  20  16.870 -11.085 -14.607
  130    HB2  MET  20           HB2      MET  20  19.002 -10.887 -12.790
  131    HB3  MET  20           HB3      MET  20  18.306  -9.263 -12.795
  132    HG2  MET  20           HG2      MET  20  16.876 -11.905 -12.273
  133    HG3  MET  20           HG3      MET  20  17.359 -10.731 -11.062
  134    HE1  MET  20           HE1      MET  20  13.474 -10.645 -10.894
  135    HE2  MET  20           HE2      MET  20  14.506 -12.048 -11.231
  136    HE3  MET  20           HE3      MET  20  14.987 -10.868  -9.987
  137    H    ASP  21           H        ASP  21  19.402  -8.837 -15.605
  138    HA   ASP  21           HA       ASP  21  19.403  -6.968 -16.830
  139    HB2  ASP  21           HB2      ASP  21  17.948  -8.443 -18.265
  140    HB3  ASP  21           HB3      ASP  21  16.536  -7.604 -17.621
  141    H    THR  22           H        THR  22  18.466  -6.879 -14.060
  142    HA   THR  22           HA       THR  22  17.847  -4.071 -13.779
  143    HB   THR  22           HB       THR  22  15.598  -5.046 -14.369
  144    HG1  THR  22           HG1      THR  22  14.617  -3.807 -12.788
  145   HG21  THR  22          1HG2      THR  22  15.792  -7.178 -13.081
  146   HG22  THR  22          2HG2      THR  22  14.343  -6.243 -12.702
  147   HG23  THR  22          3HG2      THR  22  15.714  -6.259 -11.569
  148    H    LEU  23           H        LEU  23  17.124  -3.837 -11.267
  149    HA   LEU  23           HA       LEU  23  19.523  -4.322  -9.833
  150    HB2  LEU  23           HB2      LEU  23  17.403  -2.626  -9.537
  151    HB3  LEU  23           HB3      LEU  23  16.984  -3.812  -8.301
  152    HG   LEU  23           HG       LEU  23  19.519  -2.148  -8.508
  153   HD11  LEU  23          1HD1      LEU  23  17.287  -2.171  -6.432
  154   HD12  LEU  23          2HD1      LEU  23  17.521  -0.955  -7.714
  155   HD13  LEU  23          3HD1      LEU  23  18.720  -1.112  -6.438
  156   HD21  LEU  23          3HD2      LEU  23  18.789  -4.162  -6.332
  157   HD22  LEU  23          1HD2      LEU  23  20.184  -3.059  -6.327
  158   HD23  LEU  23          2HD2      LEU  23  20.102  -4.356  -7.508
  159    H    MET  24           H        MET  24  20.257  -6.235  -9.131
  160    HA   MET  24           HA       MET  24  18.557  -8.556  -8.802
  161    HB2  MET  24           HB2      MET  24  20.608  -9.686  -7.995
  162    HB3  MET  24           HB3      MET  24  20.782  -8.892  -9.557
  163    HG2  MET  24           HG2      MET  24  21.931  -6.997  -8.394
  164    HG3  MET  24           HG3      MET  24  21.853  -7.916  -6.882
  165    HE1  MET  24           HE1      MET  24  25.578  -7.703  -8.346
  166    HE2  MET  24           HE2      MET  24  24.332  -6.701  -9.121
  167    HE3  MET  24           HE3      MET  24  24.359  -6.863  -7.348
  168    H    THR  25           H        THR  25  19.874  -6.274  -6.516
  169    HA   THR  25           HA       THR  25  19.334  -5.687  -4.383
  170    HB   THR  25           HB       THR  25  17.090  -7.725  -4.331
  171    HG1  THR  25           HG1      THR  25  16.750  -6.529  -6.176
  172   HG21  THR  25          1HG2      THR  25  16.031  -5.980  -2.921
  173   HG22  THR  25          2HG2      THR  25  17.490  -4.980  -3.067
  174   HG23  THR  25          3HG2      THR  25  17.554  -6.540  -2.211
  175    H    ASP  26           H        ASP  26  19.473  -9.144  -4.919
  176    HA   ASP  26           HA       ASP  26  21.048  -9.545  -2.398
  177    HB2  ASP  26           HB2      ASP  26  19.066 -11.356  -3.820
  178    HB3  ASP  26           HB3      ASP  26  20.211 -11.925  -2.603
  179    HA   PRO  27           HA       PRO  27  23.921 -10.485  -5.947
  180    HB2  PRO  27           HB2      PRO  27  26.130  -9.270  -4.825
  181    HB3  PRO  27           HB3      PRO  27  24.942  -8.420  -5.841
  182    HG2  PRO  27           HG2      PRO  27  25.109  -8.490  -2.824
  183    HG3  PRO  27           HG3      PRO  27  24.813  -7.076  -3.889
  184    HD2  PRO  27           HD2      PRO  27  22.806  -8.369  -2.627
  185    HD3  PRO  27           HD3      PRO  27  22.583  -7.705  -4.273
  186    H    VAL  28           H        VAL  28  24.959 -12.417  -5.921
  187    HA   VAL  28           HA       VAL  28  26.147 -13.434  -3.357
  188    HB   VAL  28           HB       VAL  28  24.661 -15.121  -5.423
  189   HG11  VAL  28          1HG1      VAL  28  26.404 -16.360  -4.160
  190   HG12  VAL  28          2HG1      VAL  28  25.687 -15.812  -2.632
  191   HG13  VAL  28          3HG1      VAL  28  24.776 -16.887  -3.713
  192   HG21  VAL  28          3HG2      VAL  28  23.713 -14.215  -2.665
  193   HG22  VAL  28          1HG2      VAL  28  23.022 -13.724  -4.231
  194   HG23  VAL  28          2HG2      VAL  28  22.909 -15.406  -3.719
  195    H    ARG  29           H        ARG  29  28.153 -14.155  -3.497
  196    HA   ARG  29           HA       ARG  29  29.551 -13.970  -6.062
  197    HB2  ARG  29           HB2      ARG  29  30.236 -13.004  -3.730
  198    HB3  ARG  29           HB3      ARG  29  30.843 -14.628  -3.408
  199    HG2  ARG  29           HG2      ARG  29  32.307 -14.449  -5.421
  200    HG3  ARG  29           HG3      ARG  29  31.594 -12.871  -5.792
  201    HD2  ARG  29           HD2      ARG  29  32.432 -12.038  -3.556
  202    HD3  ARG  29           HD3      ARG  29  33.283 -13.587  -3.363
  203    HE   ARG  29           HE       ARG  29  33.810 -12.196  -5.892
  204   HH11  ARG  29          1HH1      ARG  29  34.961 -12.442  -2.544
  205   HH12  ARG  29          2HH1      ARG  29  36.533 -11.828  -2.954
  206   HH21  ARG  29          1HH2      ARG  29  35.837 -11.428  -6.338
  207   HH22  ARG  29          2HH2      ARG  29  37.019 -11.257  -5.077
  208    H    LEU  30           H        LEU  30  30.417 -15.588  -7.166
  209    HA   LEU  30           HA       LEU  30  30.019 -18.432  -6.446
  210    HB2  LEU  30           HB2      LEU  30  30.827 -16.822  -8.894
  211    HB3  LEU  30           HB3      LEU  30  31.180 -18.525  -8.867
  212    HG   LEU  30           HG       LEU  30  29.148 -17.985 -10.076
  213   HD11  LEU  30          1HD1      LEU  30  27.685 -19.719  -9.171
  214   HD12  LEU  30          2HD1      LEU  30  28.594 -19.703  -7.641
  215   HD13  LEU  30          3HD1      LEU  30  29.394 -20.203  -9.149
  216   HD21  LEU  30          3HD2      LEU  30  28.305 -16.092  -8.691
  217   HD22  LEU  30          1HD2      LEU  30  27.813 -17.262  -7.434
  218   HD23  LEU  30          2HD2      LEU  30  27.067 -17.310  -9.038
  219    HA   PRO  31           HA       PRO  31  34.187 -19.167  -5.132
  220    HB2  PRO  31           HB2      PRO  31  34.980 -21.493  -6.370
  221    HB3  PRO  31           HB3      PRO  31  33.773 -21.423  -5.050
  222    HG2  PRO  31           HG2      PRO  31  33.266 -21.495  -8.040
  223    HG3  PRO  31           HG3      PRO  31  32.512 -22.522  -6.779
  224    HD2  PRO  31           HD2      PRO  31  31.262 -20.337  -7.719
  225    HD3  PRO  31           HD3      PRO  31  31.192 -20.688  -5.970
  226    H    SER  32           H        SER  32  33.696 -18.997  -8.662
  227    HA   SER  32           HA       SER  32  36.455 -18.414  -9.338
  228    HB2  SER  32           HB2      SER  32  33.880 -17.739 -10.817
  229    HB3  SER  32           HB3      SER  32  35.509 -17.795 -11.505
  230    HG   SER  32           HG       SER  32  35.566 -20.032 -11.148
  231    H    GLY  33           H        GLY  33  34.327 -16.581  -7.515
  232    HA2  GLY  33           HA2      GLY  33  34.759 -14.496  -6.568
  233    HA3  GLY  33           HA3      GLY  33  35.903 -14.103  -7.873
  234    H    THR  34           H        THR  34  33.383 -15.082  -9.623
  235    HA   THR  34           HA       THR  34  32.431 -12.474 -10.342
  236    HB   THR  34           HB       THR  34  31.066 -15.083 -11.080
  237    HG1  THR  34           HG1      THR  34  33.453 -14.039 -12.232
  238   HG21  THR  34          1HG2      THR  34  30.862 -13.973 -13.295
  239   HG22  THR  34          2HG2      THR  34  31.695 -12.536 -12.664
  240   HG23  THR  34          3HG2      THR  34  30.096 -13.004 -12.043
  241    H    VAL  35           H        VAL  35  30.312 -11.605 -10.114
  242    HA   VAL  35           HA       VAL  35  28.717 -12.686  -7.820
  243    HB   VAL  35           HB       VAL  35  28.938  -9.817  -8.794
  244   HG11  VAL  35          1HG1      VAL  35  27.628  -9.257  -6.760
  245   HG12  VAL  35          2HG1      VAL  35  26.682 -10.226  -7.897
  246   HG13  VAL  35          3HG1      VAL  35  27.382 -10.988  -6.448
  247   HG21  VAL  35          3HG2      VAL  35  29.955 -11.169  -6.248
  248   HG22  VAL  35          1HG2      VAL  35  30.961 -10.526  -7.561
  249   HG23  VAL  35          2HG2      VAL  35  30.006  -9.426  -6.573
  250    H    MET  36           H        MET  36  26.711 -13.297  -8.161
  251    HA   MET  36           HA       MET  36  25.127 -12.400 -10.539
  252    HB2  MET  36           HB2      MET  36  25.669 -15.252  -9.571
  253    HB3  MET  36           HB3      MET  36  24.233 -14.838 -10.500
  254    HG2  MET  36           HG2      MET  36  25.623 -15.498 -12.168
  255    HG3  MET  36           HG3      MET  36  25.811 -13.761 -12.229
  256    HE1  MET  36           HE1      MET  36  27.378 -17.196 -11.443
  257    HE2  MET  36           HE2      MET  36  27.676 -16.652 -13.102
  258    HE3  MET  36           HE3      MET  36  29.036 -16.864 -12.007
  259    H    ASP  37           H        ASP  37  22.849 -12.882 -10.347
  260    HA   ASP  37           HA       ASP  37  21.673 -11.935  -7.877
  261    HB2  ASP  37           HB2      ASP  37  20.698 -11.335  -9.979
  262    HB3  ASP  37           HB3      ASP  37  20.625 -13.017 -10.507
  263    H    ARG  38           H        ARG  38  20.782 -12.975  -6.198
  264    HA   ARG  38           HA       ARG  38  21.192 -15.657  -5.610
  265    HB2  ARG  38           HB2      ARG  38  20.727 -13.963  -3.916
  266    HB3  ARG  38           HB3      ARG  38  19.102 -13.714  -4.542
  267    HG2  ARG  38           HG2      ARG  38  19.073 -15.007  -2.476
  268    HG3  ARG  38           HG3      ARG  38  18.419 -15.941  -3.813
  269    HD2  ARG  38           HD2      ARG  38  20.643 -17.115  -4.007
  270    HD3  ARG  38           HD3      ARG  38  21.192 -16.224  -2.573
  271    HE   ARG  38           HE       ARG  38  18.878 -17.379  -1.699
  272   HH11  ARG  38          1HH1      ARG  38  21.748 -18.780  -3.226
  273   HH12  ARG  38          2HH1      ARG  38  21.479 -20.339  -2.502
  274   HH21  ARG  38          1HH2      ARG  38  18.615 -19.392  -0.776
  275   HH22  ARG  38          2HH2      ARG  38  19.753 -20.664  -1.102
  276    H    SER  39           H        SER  39  18.126 -14.248  -6.947
  277    HA   SER  39           HA       SER  39  16.646 -16.702  -6.740
  278    HB2  SER  39           HB2      SER  39  16.179 -14.330  -8.573
  279    HB3  SER  39           HB3      SER  39  15.017 -15.620  -8.215
  280    HG   SER  39           HG       SER  39  14.690 -13.745  -6.900
  281    H    ILE  40           H        ILE  40  18.622 -15.370  -9.392
  282    HA   ILE  40           HA       ILE  40  18.011 -17.522 -11.269
  283    HB   ILE  40           HB       ILE  40  20.097 -15.317 -11.150
  284   HG12  ILE  40          2HG1      ILE  40  17.765 -15.867 -13.055
  285   HG13  ILE  40          3HG1      ILE  40  17.625 -14.851 -11.628
  286   HG21  ILE  40          1HG2      ILE  40  21.184 -17.200 -12.314
  287   HG22  ILE  40          2HG2      ILE  40  19.767 -17.374 -13.383
  288   HG23  ILE  40          3HG2      ILE  40  20.794 -15.922 -13.448
  289   HD11  ILE  40          3HD1      ILE  40  17.911 -13.484 -13.610
  290   HD12  ILE  40          1HD1      ILE  40  19.308 -13.292 -12.525
  291   HD13  ILE  40          2HD1      ILE  40  19.434 -14.280 -13.995
  292    H    ILE  41           H        ILE  41  20.735 -16.981  -8.995
  293    HA   ILE  41           HA       ILE  41  22.119 -19.357  -9.851
  294    HB   ILE  41           HB       ILE  41  22.861 -17.203  -8.457
  295   HG12  ILE  41          2HG1      ILE  41  24.466 -18.487  -9.510
  296   HG13  ILE  41          3HG1      ILE  41  24.955 -18.349  -7.841
  297   HG21  ILE  41          1HG2      ILE  41  23.410 -17.684  -6.145
  298   HG22  ILE  41          2HG2      ILE  41  21.665 -17.758  -6.387
  299   HG23  ILE  41          3HG2      ILE  41  22.603 -19.260  -6.232
  300   HD11  ILE  41          3HD1      ILE  41  24.101 -20.712  -7.468
  301   HD12  ILE  41          1HD1      ILE  41  23.794 -20.805  -9.222
  302   HD13  ILE  41          2HD1      ILE  41  25.439 -20.569  -8.633
  303    H    LEU  42           H        LEU  42  19.740 -18.868  -7.179
  304    HA   LEU  42           HA       LEU  42  19.877 -21.651  -6.426
  305    HB2  LEU  42           HB2      LEU  42  18.270 -21.241  -4.825
  306    HB3  LEU  42           HB3      LEU  42  19.204 -19.767  -4.934
  307    HG   LEU  42           HG       LEU  42  17.255 -18.907  -6.472
  308   HD11  LEU  42          1HD1      LEU  42  15.830 -21.144  -4.938
  309   HD12  LEU  42          2HD1      LEU  42  15.950 -21.032  -6.699
  310   HD13  LEU  42          3HD1      LEU  42  15.021 -19.830  -5.816
  311   HD21  LEU  42          3HD2      LEU  42  16.051 -18.115  -4.471
  312   HD22  LEU  42          1HD2      LEU  42  17.797 -18.057  -4.231
  313   HD23  LEU  42          2HD2      LEU  42  16.859 -19.355  -3.480
  314    H    ARG  43           H        ARG  43  17.842 -19.914  -8.781
  315    HA   ARG  43           HA       ARG  43  16.105 -22.117  -9.375
  316    HB2  ARG  43           HB2      ARG  43  15.589 -19.836 -10.053
  317    HB3  ARG  43           HB3      ARG  43  17.029 -19.756 -11.058
  318    HG2  ARG  43           HG2      ARG  43  15.029 -20.032 -12.404
  319    HG3  ARG  43           HG3      ARG  43  16.085 -21.429 -12.604
  320    HD2  ARG  43           HD2      ARG  43  14.675 -22.750 -11.073
  321    HD3  ARG  43           HD3      ARG  43  13.651 -21.353 -10.767
  322    HE   ARG  43           HE       ARG  43  13.687 -23.091 -13.126
  323   HH11  ARG  43          1HH1      ARG  43  12.579 -19.930 -11.972
  324   HH12  ARG  43          2HH1      ARG  43  11.361 -19.809 -13.209
  325   HH21  ARG  43          1HH2      ARG  43  12.109 -22.861 -14.687
  326   HH22  ARG  43          2HH2      ARG  43  11.118 -21.435 -14.748
  327    H    HIS  44           H        HIS  44  19.311 -21.190 -10.714
  328    HA   HIS  44           HA       HIS  44  19.489 -23.456 -12.483
  329    HB2  HIS  44           HB2      HIS  44  21.536 -21.617 -11.210
  330    HB3  HIS  44           HB3      HIS  44  22.026 -23.042 -12.130
  331    HD1  HIS  44           HD1      HIS  44  20.096 -19.752 -12.727
  332    HD2  HIS  44           HD2      HIS  44  21.721 -23.066 -14.742
  333    HE1  HIS  44           HE1      HIS  44  19.967 -19.213 -15.227
  334    H    LEU  45           H        LEU  45  20.775 -23.116  -9.100
  335    HA   LEU  45           HA       LEU  45  21.685 -25.775  -8.839
  336    HB2  LEU  45           HB2      LEU  45  20.671 -23.712  -6.861
  337    HB3  LEU  45           HB3      LEU  45  21.208 -25.296  -6.319
  338    HG   LEU  45           HG       LEU  45  22.984 -23.479  -7.995
  339   HD11  LEU  45          1HD1      LEU  45  22.788 -23.731  -4.968
  340   HD12  LEU  45          2HD1      LEU  45  22.436 -22.288  -5.939
  341   HD13  LEU  45          3HD1      LEU  45  24.099 -22.918  -5.837
  342   HD21  LEU  45          3HD2      LEU  45  24.790 -24.898  -6.990
  343   HD22  LEU  45          1HD2      LEU  45  23.687 -25.827  -8.013
  344   HD23  LEU  45          2HD2      LEU  45  23.552 -25.911  -6.236
  345    H    LEU  46           H        LEU  46  18.371 -24.599  -8.355
  346    HA   LEU  46           HA       LEU  46  17.228 -27.025  -7.375
  347    HB2  LEU  46           HB2      LEU  46  16.247 -24.806  -7.216
  348    HB3  LEU  46           HB3      LEU  46  16.069 -24.686  -8.957
  349    HG   LEU  46           HG       LEU  46  14.689 -26.954  -7.503
  350   HD11  LEU  46          1HD1      LEU  46  13.674 -24.076  -7.619
  351   HD12  LEU  46          2HD1      LEU  46  14.158 -24.965  -6.160
  352   HD13  LEU  46          3HD1      LEU  46  12.736 -25.489  -7.073
  353   HD21  LEU  46          3HD2      LEU  46  13.902 -25.207  -9.898
  354   HD22  LEU  46          1HD2      LEU  46  12.952 -26.559  -9.249
  355   HD23  LEU  46          2HD2      LEU  46  14.518 -26.868  -9.988
  356    H    ASN  47           H        ASN  47  17.861 -25.922 -10.719
  357    HA   ASN  47           HA       ASN  47  16.563 -28.230 -11.944
  358    HB2  ASN  47           HB2      ASN  47  16.663 -25.994 -13.022
  359    HB3  ASN  47           HB3      ASN  47  18.424 -26.102 -13.090
  360   HD21  ASN  47          1HD2      ASN  47  19.424 -27.571 -14.648
  361   HD22  ASN  47          2HD2      ASN  47  18.455 -28.277 -15.927
  362    H    SER  48           H        SER  48  19.955 -27.235 -11.327
  363    HA   SER  48           HA       SER  48  21.024 -29.947 -11.432
  364    HB2  SER  48           HB2      SER  48  22.449 -29.462 -13.483
  365    HB3  SER  48           HB3      SER  48  20.740 -29.751 -13.774
  366    HG   SER  48           HG       SER  48  22.158 -27.287 -13.883
  367    HA   PRO  49           HA       PRO  49  24.185 -27.833  -9.175
  368    HB2  PRO  49           HB2      PRO  49  26.234 -29.611  -9.087
  369    HB3  PRO  49           HB3      PRO  49  24.633 -29.963  -8.380
  370    HG2  PRO  49           HG2      PRO  49  25.661 -30.784 -11.116
  371    HG3  PRO  49           HG3      PRO  49  24.916 -31.831  -9.864
  372    HD2  PRO  49           HD2      PRO  49  23.470 -30.762 -11.930
  373    HD3  PRO  49           HD3      PRO  49  22.769 -30.990 -10.298
  374    H    THR  50           H        THR  50  24.107 -26.272 -11.185
  375    HA   THR  50           HA       THR  50  26.836 -26.008 -12.355
  376    HB   THR  50           HB       THR  50  25.578 -25.159 -14.475
  377    HG1  THR  50           HG1      THR  50  23.486 -25.330 -13.593
  378   HG21  THR  50          1HG2      THR  50  25.617 -27.384 -15.475
  379   HG22  THR  50          2HG2      THR  50  25.686 -28.131 -13.853
  380   HG23  THR  50          3HG2      THR  50  27.032 -27.132 -14.441
  381    H    ASP  51           H        ASP  51  27.579 -24.110 -12.811
  382    HA   ASP  51           HA       ASP  51  26.665 -21.680 -11.588
  383    HB2  ASP  51           HB2      ASP  51  28.982 -22.333 -12.079
  384    HB3  ASP  51           HB3      ASP  51  28.644 -22.288 -13.815
  385    HA   PRO  52           HA       PRO  52  23.609 -20.559 -14.619
  386    HB2  PRO  52           HB2      PRO  52  23.320 -17.845 -14.228
  387    HB3  PRO  52           HB3      PRO  52  22.771 -19.088 -13.069
  388    HG2  PRO  52           HG2      PRO  52  25.385 -17.572 -13.034
  389    HG3  PRO  52           HG3      PRO  52  24.197 -17.779 -11.700
  390    HD2  PRO  52           HD2      PRO  52  26.371 -19.388 -11.878
  391    HD3  PRO  52           HD3      PRO  52  24.778 -20.072 -11.442
  392    H    PHE  53           H        PHE  53  26.774 -18.972 -14.921
  393    HA   PHE  53           HA       PHE  53  26.090 -18.271 -17.775
  394    HB2  PHE  53           HB2      PHE  53  27.810 -16.762 -15.787
  395    HB3  PHE  53           HB3      PHE  53  27.732 -16.411 -17.505
  396    HD1  PHE  53           HD1      PHE  53  25.466 -15.787 -18.553
  397    HD2  PHE  53           HD2      PHE  53  26.221 -15.775 -14.321
  398    HE1  PHE  53           HE1      PHE  53  23.512 -14.290 -18.204
  399    HE2  PHE  53           HE2      PHE  53  24.256 -14.298 -13.964
  400    HZ   PHE  53           HZ       PHE  53  22.918 -13.544 -15.894
  401    H    ASN  54           H        ASN  54  28.642 -19.466 -15.572
  402    HA   ASN  54           HA       ASN  54  30.519 -19.820 -17.827
  403    HB2  ASN  54           HB2      ASN  54  31.225 -18.984 -15.580
  404    HB3  ASN  54           HB3      ASN  54  30.776 -20.532 -14.876
  405   HD21  ASN  54          1HD2      ASN  54  33.004 -18.956 -17.218
  406   HD22  ASN  54          2HD2      ASN  54  34.203 -20.237 -17.175
  407    H    ARG  55           H        ARG  55  28.233 -21.714 -16.002
  408    HA   ARG  55           HA       ARG  55  27.330 -23.692 -16.225
  409    HB2  ARG  55           HB2      ARG  55  28.803 -24.164 -18.830
  410    HB3  ARG  55           HB3      ARG  55  27.307 -24.899 -18.290
  411    HG2  ARG  55           HG2      ARG  55  27.760 -22.043 -19.204
  412    HG3  ARG  55           HG3      ARG  55  26.764 -23.280 -19.955
  413    HD2  ARG  55           HD2      ARG  55  26.173 -21.867 -17.311
  414    HD3  ARG  55           HD3      ARG  55  25.431 -21.536 -18.868
  415    HE   ARG  55           HE       ARG  55  25.090 -24.311 -18.210
  416   HH11  ARG  55          1HH1      ARG  55  23.819 -21.121 -17.297
  417   HH12  ARG  55          2HH1      ARG  55  22.295 -21.771 -16.794
  418   HH21  ARG  55          1HH2      ARG  55  23.083 -25.084 -17.531
  419   HH22  ARG  55          2HH2      ARG  55  21.869 -23.967 -16.995
  420    H    GLN  56           H        GLN  56  30.388 -23.424 -15.397
  421    HA   GLN  56           HA       GLN  56  31.412 -26.082 -15.142
  422    HB2  GLN  56           HB2      GLN  56  32.713 -25.163 -13.275
  423    HB3  GLN  56           HB3      GLN  56  32.778 -24.102 -14.682
  424    HG2  GLN  56           HG2      GLN  56  31.014 -22.650 -13.631
  425    HG3  GLN  56           HG3      GLN  56  31.032 -23.680 -12.198
  426   HE21  GLN  56          1HE2      GLN  56  31.498 -20.880 -12.068
  427   HE22  GLN  56          2HE2      GLN  56  33.192 -20.648 -11.643
  428    H    MET  57           H        MET  57  31.404 -27.438 -13.242
  429    HA   MET  57           HA       MET  57  28.803 -27.818 -12.054
  430    HB2  MET  57           HB2      MET  57  31.501 -29.033 -11.352
  431    HB3  MET  57           HB3      MET  57  29.959 -29.538 -10.657
  432    HG2  MET  57           HG2      MET  57  30.649 -29.663 -13.619
  433    HG3  MET  57           HG3      MET  57  30.701 -31.016 -12.496
  434    HE1  MET  57           HE1      MET  57  29.170 -31.078 -15.281
  435    HE2  MET  57           HE2      MET  57  29.250 -32.449 -14.150
  436    HE3  MET  57           HE3      MET  57  27.692 -31.922 -14.816
  437    H    LEU  58           H        LEU  58  28.000 -27.266 -10.105
  438    HA   LEU  58           HA       LEU  58  29.574 -25.625  -8.217
  439    HB2  LEU  58           HB2      LEU  58  28.848 -24.248 -10.193
  440    HB3  LEU  58           HB3      LEU  58  27.174 -24.598  -9.804
  441    HG   LEU  58           HG       LEU  58  28.083 -22.337  -9.252
  442   HD11  LEU  58          1HD1      LEU  58  25.987 -23.134  -8.248
  443   HD12  LEU  58          2HD1      LEU  58  26.869 -22.029  -7.188
  444   HD13  LEU  58          3HD1      LEU  58  26.890 -23.754  -6.853
  445   HD21  LEU  58          3HD2      LEU  58  30.280 -22.994  -8.365
  446   HD22  LEU  58          1HD2      LEU  58  29.495 -23.743  -6.955
  447   HD23  LEU  58          2HD2      LEU  58  29.376 -21.997  -7.201
  448    H    THR  59           H        THR  59  28.797 -25.645  -6.181
  449    HA   THR  59           HA       THR  59  26.153 -26.910  -5.570
  450    HB   THR  59           HB       THR  59  28.723 -27.279  -3.970
  451    HG1  THR  59           HG1      THR  59  28.849 -28.403  -5.895
  452   HG21  THR  59          1HG2      THR  59  25.975 -28.593  -3.758
  453   HG22  THR  59          2HG2      THR  59  26.760 -27.560  -2.533
  454   HG23  THR  59          3HG2      THR  59  27.430 -29.147  -2.912
  455    H    GLU  60           H        GLU  60  25.111 -26.082  -3.692
  456    HA   GLU  60           HA       GLU  60  25.226 -23.292  -3.382
  457    HB2  GLU  60           HB2      GLU  60  23.593 -23.562  -1.621
  458    HB3  GLU  60           HB3      GLU  60  23.239 -24.666  -2.947
  459    HG2  GLU  60           HG2      GLU  60  24.266 -26.547  -1.649
  460    HG3  GLU  60           HG3      GLU  60  24.561 -25.424  -0.303
  461    H    SER  61           H        SER  61  27.175 -25.653  -1.695
  462    HA   SER  61           HA       SER  61  27.859 -24.099   0.650
  463    HB2  SER  61           HB2      SER  61  29.728 -25.801   0.760
  464    HB3  SER  61           HB3      SER  61  28.088 -26.473   0.699
  465    HG   SER  61           HG       SER  61  29.590 -27.548  -0.734
  466    H    MET  62           H        MET  62  28.829 -23.865  -2.667
  467    HA   MET  62           HA       MET  62  31.403 -22.520  -2.100
  468    HB2  MET  62           HB2      MET  62  29.949 -22.986  -4.733
  469    HB3  MET  62           HB3      MET  62  31.614 -22.450  -4.528
  470    HG2  MET  62           HG2      MET  62  30.530 -25.158  -3.688
  471    HG3  MET  62           HG3      MET  62  31.485 -24.819  -5.133
  472    HE1  MET  62           HE1      MET  62  32.049 -27.073  -3.000
  473    HE2  MET  62           HE2      MET  62  33.046 -26.851  -4.453
  474    HE3  MET  62           HE3      MET  62  33.817 -26.997  -2.865
  475    H    LEU  63           H        LEU  63  28.182 -21.515  -2.154
  476    HA   LEU  63           HA       LEU  63  28.594 -18.879  -3.401
  477    HB2  LEU  63           HB2      LEU  63  26.218 -20.135  -1.979
  478    HB3  LEU  63           HB3      LEU  63  26.200 -18.574  -2.767
  479    HG   LEU  63           HG       LEU  63  26.611 -21.244  -4.169
  480   HD11  LEU  63          1HD1      LEU  63  24.286 -19.275  -4.140
  481   HD12  LEU  63          2HD1      LEU  63  24.309 -20.881  -3.361
  482   HD13  LEU  63          3HD1      LEU  63  24.386 -20.746  -5.127
  483   HD21  LEU  63          3HD2      LEU  63  27.848 -19.526  -5.381
  484   HD22  LEU  63          1HD2      LEU  63  26.465 -18.422  -5.313
  485   HD23  LEU  63          2HD2      LEU  63  26.369 -19.904  -6.275
  486    H    GLU  64           H        GLU  64  28.297 -16.894  -2.368
  487    HA   GLU  64           HA       GLU  64  27.868 -16.744   0.530
  488    HB2  GLU  64           HB2      GLU  64  30.290 -17.060   0.402
  489    HB3  GLU  64           HB3      GLU  64  30.447 -15.671  -0.676
  490    HG2  GLU  64           HG2      GLU  64  29.658 -14.161   1.101
  491    HG3  GLU  64           HG3      GLU  64  29.294 -15.538   2.144
  492    HA   PRO  65           HA       PRO  65  25.652 -13.223  -1.354
  493    HB2  PRO  65           HB2      PRO  65  25.082 -12.720   1.573
  494    HB3  PRO  65           HB3      PRO  65  23.966 -12.625   0.165
  495    HG2  PRO  65           HG2      PRO  65  23.916 -14.789   1.797
  496    HG3  PRO  65           HG3      PRO  65  23.842 -15.008   0.014
  497    HD2  PRO  65           HD2      PRO  65  26.247 -15.267   1.836
  498    HD3  PRO  65           HD3      PRO  65  25.708 -16.354   0.519
  499    H    VAL  66           H        VAL  66  26.331 -11.151  -1.759
  500    HA   VAL  66           HA       VAL  66  28.886 -10.347  -0.538
  501    HB   VAL  66           HB       VAL  66  27.410  -9.031  -2.836
  502   HG11  VAL  66          1HG1      VAL  66  29.676  -8.093  -3.342
  503   HG12  VAL  66          2HG1      VAL  66  29.024  -7.507  -1.806
  504   HG13  VAL  66          3HG1      VAL  66  30.274  -8.777  -1.821
  505   HG21  VAL  66          3HG2      VAL  66  29.682 -11.044  -2.866
  506   HG22  VAL  66          1HG2      VAL  66  28.010 -11.369  -3.399
  507   HG23  VAL  66          2HG2      VAL  66  28.999 -10.204  -4.282
  508    HA   PRO  67           HA       PRO  67  26.510  -7.386   2.015
  509    HB2  PRO  67           HB2      PRO  67  28.438  -6.722   3.812
  510    HB3  PRO  67           HB3      PRO  67  27.623  -8.311   3.830
  511    HG2  PRO  67           HG2      PRO  67  30.332  -7.598   2.667
  512    HG3  PRO  67           HG3      PRO  67  29.895  -8.997   3.704
  513    HD2  PRO  67           HD2      PRO  67  30.059  -9.167   0.945
  514    HD3  PRO  67           HD3      PRO  67  28.921 -10.138   1.916
  515    H    GLU  68           H        GLU  68  29.812  -6.599   0.785
  516    HA   GLU  68           HA       GLU  68  29.523  -3.802   1.120
  517    HB2  GLU  68           HB2      GLU  68  31.532  -3.586  -0.221
  518    HB3  GLU  68           HB3      GLU  68  31.686  -4.884   0.955
  519    HG2  GLU  68           HG2      GLU  68  31.258  -6.571  -0.838
  520    HG3  GLU  68           HG3      GLU  68  31.115  -5.274  -2.018
  521    H    LEU  69           H        LEU  69  28.252  -5.829  -1.425
  522    HA   LEU  69           HA       LEU  69  27.498  -3.463  -3.075
  523    HB2  LEU  69           HB2      LEU  69  27.091  -6.460  -3.411
  524    HB3  LEU  69           HB3      LEU  69  26.365  -5.252  -4.472
  525    HG   LEU  69           HG       LEU  69  29.368  -5.641  -4.068
  526   HD11  LEU  69          1HD1      LEU  69  27.552  -6.379  -6.418
  527   HD12  LEU  69          2HD1      LEU  69  28.265  -7.521  -5.260
  528   HD13  LEU  69          3HD1      LEU  69  29.316  -6.591  -6.339
  529   HD21  LEU  69          3HD2      LEU  69  29.557  -4.170  -6.090
  530   HD22  LEU  69          1HD2      LEU  69  28.932  -3.314  -4.675
  531   HD23  LEU  69          2HD2      LEU  69  27.816  -3.815  -5.971
  532    H    LYS  70           H        LYS  70  25.910  -5.961  -0.971
  533    HA   LYS  70           HA       LYS  70  23.288  -4.948  -1.496
  534    HB2  LYS  70           HB2      LYS  70  23.809  -7.203  -0.647
  535    HB3  LYS  70           HB3      LYS  70  24.262  -6.520   0.918
  536    HG2  LYS  70           HG2      LYS  70  21.994  -5.716   1.287
  537    HG3  LYS  70           HG3      LYS  70  21.524  -6.093  -0.383
  538    HD2  LYS  70           HD2      LYS  70  21.792  -8.498   0.054
  539    HD3  LYS  70           HD3      LYS  70  22.330  -8.157   1.717
  540    HE2  LYS  70           HE2      LYS  70  20.166  -7.056   2.198
  541    HE3  LYS  70           HE3      LYS  70  19.632  -7.328   0.530
  542    HZ1  LYS  70           HZ1      LYS  70  20.302  -9.517   2.418
  543    HZ2  LYS  70           HZ2      LYS  70  19.671  -9.678   0.906
  544    HZ3  LYS  70           HZ3      LYS  70  18.781  -9.006   2.105
  545    H    GLU  71           H        GLU  71  25.611  -4.018   1.052
  546    HA   GLU  71           HA       GLU  71  23.840  -2.150   2.371
  547    HB2  GLU  71           HB2      GLU  71  26.876  -2.370   2.300
  548    HB3  GLU  71           HB3      GLU  71  25.984  -1.194   3.278
  549    HG2  GLU  71           HG2      GLU  71  24.752  -3.065   4.386
  550    HG3  GLU  71           HG3      GLU  71  25.765  -4.226   3.525
  551    H    GLN  72           H        GLN  72  25.953  -1.853  -0.490
  552    HA   GLN  72           HA       GLN  72  25.561   1.056  -0.718
  553    HB2  GLN  72           HB2      GLN  72  26.696  -1.048  -2.599
  554    HB3  GLN  72           HB3      GLN  72  26.431   0.637  -3.068
  555    HG2  GLN  72           HG2      GLN  72  27.862   1.401  -1.168
  556    HG3  GLN  72           HG3      GLN  72  28.213  -0.286  -0.778
  557   HE21  GLN  72          1HE2      GLN  72  29.526  -1.533  -2.296
  558   HE22  GLN  72          2HE2      GLN  72  30.517  -0.694  -3.509
  559    H    ILE  73           H        ILE  73  24.047  -1.830  -2.204
  560    HA   ILE  73           HA       ILE  73  22.166  -0.494  -3.855
  561    HB   ILE  73           HB       ILE  73  22.114  -3.180  -2.426
  562   HG12  ILE  73          2HG1      ILE  73  22.278  -2.497  -5.391
  563   HG13  ILE  73          3HG1      ILE  73  23.699  -2.698  -4.378
  564   HG21  ILE  73          1HG2      ILE  73  19.771  -2.637  -2.600
  565   HG22  ILE  73          2HG2      ILE  73  19.978  -2.052  -4.270
  566   HG23  ILE  73          3HG2      ILE  73  20.148  -3.771  -3.873
  567   HD11  ILE  73          3HD1      ILE  73  22.992  -5.056  -3.872
  568   HD12  ILE  73          1HD1      ILE  73  21.682  -4.871  -5.069
  569   HD13  ILE  73          2HD1      ILE  73  23.361  -4.747  -5.574
  570    H    GLN  74           H        GLN  74  21.667  -1.558  -0.438
  571    HA   GLN  74           HA       GLN  74  19.017  -0.485  -0.362
  572    HB2  GLN  74           HB2      GLN  74  18.955  -1.066   1.920
  573    HB3  GLN  74           HB3      GLN  74  19.917  -2.288   1.108
  574    HG2  GLN  74           HG2      GLN  74  21.384  -2.005   2.777
  575    HG3  GLN  74           HG3      GLN  74  21.903  -0.557   1.933
  576   HE21  GLN  74          1HE2      GLN  74  19.733   1.280   2.619
  577   HE22  GLN  74          2HE2      GLN  74  19.757   1.440   4.367
  578    H    ALA  75           H        ALA  75  22.121   1.124   0.223
  579    HA   ALA  75           HA       ALA  75  20.951   3.555   1.336
  580    HB1  ALA  75           HB1      ALA  75  23.217   4.454   0.913
  581    HB2  ALA  75           HB2      ALA  75  23.297   2.888   1.758
  582    HB3  ALA  75           HB3      ALA  75  23.651   2.980   0.020
  583    H    TRP  76           H        TRP  76  22.054   2.540  -1.948
  584    HA   TRP  76           HA       TRP  76  21.369   4.981  -3.244
  585    HB2  TRP  76           HB2      TRP  76  22.894   3.294  -4.163
  586    HB3  TRP  76           HB3      TRP  76  21.565   2.150  -4.333
  587    HD1  TRP  76           HD1      TRP  76  22.937   5.381  -5.848
  588    HE1  TRP  76           HE1      TRP  76  21.893   5.780  -8.163
  589    HE3  TRP  76           HE3      TRP  76  19.522   1.562  -5.867
  590    HZ2  TRP  76           HZ2      TRP  76  19.770   4.671  -9.757
  591    HZ3  TRP  76           HZ3      TRP  76  18.015   1.262  -7.785
  592    HH2  TRP  76           HH2      TRP  76  18.090   2.808  -9.729
  593    H    MET  77           H        MET  77  19.400   1.987  -2.797
  594    HA   MET  77           HA       MET  77  17.061   2.925  -4.173
  595    HB2  MET  77           HB2      MET  77  17.386   0.948  -1.872
  596    HB3  MET  77           HB3      MET  77  15.859   1.258  -2.696
  597    HG2  MET  77           HG2      MET  77  16.872   0.599  -4.867
  598    HG3  MET  77           HG3      MET  77  18.398   0.275  -4.047
  599    HE1  MET  77           HE1      MET  77  14.571  -2.268  -3.854
  600    HE2  MET  77           HE2      MET  77  14.564  -0.560  -3.365
  601    HE3  MET  77           HE3      MET  77  14.932  -1.004  -5.046
  602    H    ARG  78           H        ARG  78  18.149   3.501  -0.800
  603    HA   ARG  78           HA       ARG  78  15.760   4.935  -0.005
  604    HB2  ARG  78           HB2      ARG  78  17.337   3.939   1.598
  605    HB3  ARG  78           HB3      ARG  78  18.585   5.089   1.124
  606    HG2  ARG  78           HG2      ARG  78  17.166   6.973   1.878
  607    HG3  ARG  78           HG3      ARG  78  15.877   5.845   2.309
  608    HD2  ARG  78           HD2      ARG  78  17.346   4.792   3.992
  609    HD3  ARG  78           HD3      ARG  78  18.677   5.876   3.531
  610    HE   ARG  78           HE       ARG  78  16.485   7.515   4.160
  611   HH11  ARG  78          1HH1      ARG  78  18.567   5.268   5.939
  612   HH12  ARG  78          2HH1      ARG  78  18.332   6.109   7.446
  613   HH21  ARG  78          1HH2      ARG  78  16.229   8.548   6.139
  614   HH22  ARG  78          2HH2      ARG  78  17.039   7.937   7.554
  615    H    GLU  79           H        GLU  79  18.920   6.055  -1.357
  616    HA   GLU  79           HA       GLU  79  18.271   8.832  -1.370
  617    HB2  GLU  79           HB2      GLU  79  20.148   7.211  -3.132
  618    HB3  GLU  79           HB3      GLU  79  19.988   8.962  -3.238
  619    HG2  GLU  79           HG2      GLU  79  20.607   9.188  -0.844
  620    HG3  GLU  79           HG3      GLU  79  20.827   7.441  -0.742
  621    H    LYS  80           H        LYS  80  17.542   6.329  -3.844
  622    HA   LYS  80           HA       LYS  80  16.407   8.115  -5.769
  623    HB2  LYS  80           HB2      LYS  80  16.026   5.153  -5.154
  624    HB3  LYS  80           HB3      LYS  80  15.225   5.927  -6.508
  625    HG2  LYS  80           HG2      LYS  80  18.247   5.781  -6.130
  626    HG3  LYS  80           HG3      LYS  80  17.285   4.713  -7.155
  627    HD2  LYS  80           HD2      LYS  80  17.631   7.717  -7.557
  628    HD3  LYS  80           HD3      LYS  80  18.460   6.449  -8.444
  629    HE2  LYS  80           HE2      LYS  80  16.296   5.582  -9.294
  630    HE3  LYS  80           HE3      LYS  80  15.442   6.851  -8.418
  631    HZ1  LYS  80           HZ1      LYS  80  17.433   7.323 -10.570
  632    HZ2  LYS  80           HZ2      LYS  80  16.609   8.499  -9.767
  633    HZ3  LYS  80           HZ3      LYS  80  15.805   7.458 -10.738
  634    H    GLN  81           H        GLN  81  15.089   7.112  -2.760
  635    HA   GLN  81           HA       GLN  81  12.316   8.010  -3.493
  636    HB2  GLN  81           HB2      GLN  81  13.482   6.541  -1.090
  637    HB3  GLN  81           HB3      GLN  81  11.805   7.092  -1.193
  638    HG2  GLN  81           HG2      GLN  81  11.336   5.641  -3.066
  639    HG3  GLN  81           HG3      GLN  81  13.034   5.194  -3.238
  640   HE21  GLN  81          1HE2      GLN  81  14.015   3.783  -1.646
  641   HE22  GLN  81          2HE2      GLN  81  13.001   2.796  -0.591
  642    H    SER  82           H        SER  82  15.095   8.796  -1.370
  643    HA   SER  82           HA       SER  82  13.758  10.921   0.050
  644    HB2  SER  82           HB2      SER  82  16.728  10.290  -0.295
  645    HB3  SER  82           HB3      SER  82  16.036  11.422   0.886
  646    HG   SER  82           HG       SER  82  15.571   8.596   0.730
  647    H    SER  83           H        SER  83  14.981  10.916  -3.149
  648    HA   SER  83           HA       SER  83  15.803  13.706  -3.319
  649    HB2  SER  83           HB2      SER  83  15.797  13.254  -5.747
  650    HB3  SER  83           HB3      SER  83  16.717  12.062  -4.819
  651    HG   SER  83           HG       SER  83  15.309  11.149  -6.468
  652    H    ASP  84           H        ASP  84  12.688  12.297  -3.086
  653    HA   ASP  84           HA       ASP  84  11.131  14.002  -4.777
  654    HB2  ASP  84           HB2      ASP  84  10.340  11.892  -3.797
  655    HB3  ASP  84           HB3      ASP  84  10.391  12.610  -2.179
  656    H    HIS  85           H        HIS  85  10.424  16.039  -4.585
  657    HA   HIS  85           HA       HIS  85  11.825  17.769  -2.741
  658    HB2  HIS  85           HB2      HIS  85   9.795  18.335  -4.939
  659    HB3  HIS  85           HB3      HIS  85  10.681  19.560  -4.048
  660    HD1  HIS  85           HD1      HIS  85  12.919  16.636  -4.962
  661    HD2  HIS  85           HD2      HIS  85  11.582  20.298  -6.556
  662    HE1  HIS  85           HE1      HIS  85  14.502  17.199  -6.860
  Start of MODEL   18
    1    H2   PRO   1           H2       PRO   1   1.499  -4.971   3.972
    2    H3   PRO   1           H3       PRO   1   0.398  -4.982   2.747
    3    HA   PRO   1           HA       PRO   1   1.328  -3.139   1.701
    4    HB2  PRO   1           HB2      PRO   1   3.219  -2.608   3.987
    5    HB3  PRO   1           HB3      PRO   1   2.418  -1.462   2.869
    6    HG2  PRO   1           HG2      PRO   1   1.500  -2.398   5.465
    7    HG3  PRO   1           HG3      PRO   1   0.639  -1.288   4.360
    8    HD2  PRO   1           HD2      PRO   1  -0.277  -3.821   4.966
    9    HD3  PRO   1           HD3      PRO   1  -0.605  -2.988   3.425
   10    H    GLY   2           H        GLY   2   3.677  -2.719   0.867
   11    HA2  GLY   2           HA2      GLY   2   5.856  -3.469   0.370
   12    HA3  GLY   2           HA3      GLY   2   5.499  -5.055   1.080
   13    H    SER   3           H        SER   3   2.976  -4.079  -0.976
   14    HA   SER   3           HA       SER   3   3.653  -6.089  -2.965
   15    HB2  SER   3           HB2      SER   3   1.411  -5.413  -3.889
   16    HB3  SER   3           HB3      SER   3   1.390  -5.973  -2.208
   17    HG   SER   3           HG       SER   3   0.137  -4.044  -2.551
   18    H    ALA   4           H        ALA   4   4.134  -2.681  -2.770
   19    HA   ALA   4           HA       ALA   4   4.678  -2.460  -5.708
   20    HB1  ALA   4           HB1      ALA   4   4.230  -0.047  -5.401
   21    HB2  ALA   4           HB2      ALA   4   2.831  -1.021  -4.914
   22    HB3  ALA   4           HB3      ALA   4   3.893  -0.308  -3.677
   23    H    GLU   5           H        GLU   5   6.446  -1.113  -6.334
   24    HA   GLU   5           HA       GLU   5   8.655  -0.640  -4.416
   25    HB2  GLU   5           HB2      GLU   5   8.921  -2.342  -6.940
   26    HB3  GLU   5           HB3      GLU   5  10.264  -1.725  -5.985
   27    HG2  GLU   5           HG2      GLU   5   9.460  -3.009  -4.011
   28    HG3  GLU   5           HG3      GLU   5   8.160  -3.692  -5.006
   29    H    ILE   6           H        ILE   6  10.339   0.721  -5.333
   30    HA   ILE   6           HA       ILE   6   9.361   2.763  -7.214
   31    HB   ILE   6           HB       ILE   6  11.984   2.416  -5.719
   32   HG12  ILE   6          2HG1      ILE   6  11.311   4.585  -4.642
   33   HG13  ILE   6          3HG1      ILE   6   9.727   4.449  -5.401
   34   HG21  ILE   6          1HG2      ILE   6  12.546   3.539  -7.805
   35   HG22  ILE   6          2HG2      ILE   6  11.179   4.668  -7.616
   36   HG23  ILE   6          3HG2      ILE   6  12.564   4.731  -6.518
   37   HD11  ILE   6          3HD1      ILE   6   9.878   3.784  -2.970
   38   HD12  ILE   6          1HD1      ILE   6   9.181   2.537  -4.004
   39   HD13  ILE   6          2HD1      ILE   6  10.883   2.404  -3.454
   40    H    ASP   7           H        ASP   7  10.125   3.141  -9.293
   41    HA   ASP   7           HA       ASP   7  11.075   0.842 -10.812
   42    HB2  ASP   7           HB2      ASP   7  10.579   3.739 -11.576
   43    HB3  ASP   7           HB3      ASP   7  11.066   2.476 -12.702
   44    H    TYR   8           H        TYR   8  13.102   0.191 -10.528
   45    HA   TYR   8           HA       TYR   8  15.344   2.127 -10.295
   46    HB2  TYR   8           HB2      TYR   8  15.335  -0.877  -9.880
   47    HB3  TYR   8           HB3      TYR   8  16.625   0.246  -9.502
   48    HD1  TYR   8           HD1      TYR   8  15.574   2.419  -7.978
   49    HD2  TYR   8           HD2      TYR   8  14.440  -1.750  -7.905
   50    HE1  TYR   8           HE1      TYR   8  14.793   2.666  -5.631
   51    HE2  TYR   8           HE2      TYR   8  13.644  -1.485  -5.571
   52    HH   TYR   8           HH       TYR   8  13.326  -0.025  -3.802
   53    H    SER   9           H        SER   9  13.984   1.483 -12.933
   54    HA   SER   9           HA       SER   9  15.614  -0.104 -14.620
   55    HB2  SER   9           HB2      SER   9  14.089   2.414 -15.385
   56    HB3  SER   9           HB3      SER   9  14.543   1.075 -16.444
   57    HG   SER   9           HG       SER   9  12.349   0.938 -15.765
   58    H    ASP  10           H        ASP  10  16.358   2.984 -13.286
   59    HA   ASP  10           HA       ASP  10  18.516   3.631 -15.182
   60    HB2  ASP  10           HB2      ASP  10  18.531   5.769 -14.034
   61    HB3  ASP  10           HB3      ASP  10  16.883   5.360 -14.470
   62    H    ALA  11           H        ALA  11  18.351   1.577 -12.576
   63    HA   ALA  11           HA       ALA  11  20.538   2.302 -10.931
   64    HB1  ALA  11           HB1      ALA  11  19.462  -0.463 -11.671
   65    HB2  ALA  11           HB2      ALA  11  20.556  -0.134 -10.322
   66    HB3  ALA  11           HB3      ALA  11  18.927   0.552 -10.323
   67    HA   PRO  12           HA       PRO  12  24.073   1.580 -13.515
   68    HB2  PRO  12           HB2      PRO  12  26.066   1.103 -11.726
   69    HB3  PRO  12           HB3      PRO  12  25.270   2.707 -11.879
   70    HG2  PRO  12           HG2      PRO  12  24.630   0.484  -9.901
   71    HG3  PRO  12           HG3      PRO  12  24.944   2.227  -9.552
   72    HD2  PRO  12           HD2      PRO  12  22.415   1.265  -9.801
   73    HD3  PRO  12           HD3      PRO  12  22.850   2.870 -10.445
   74    H    ASP  13           H        ASP  13  25.459  -0.029 -14.335
   75    HA   ASP  13           HA       ASP  13  24.328  -2.609 -14.522
   76    HB2  ASP  13           HB2      ASP  13  25.674  -1.457 -16.250
   77    HB3  ASP  13           HB3      ASP  13  27.119  -1.676 -15.257
   78    H    GLU  14           H        GLU  14  26.787  -1.465 -12.290
   79    HA   GLU  14           HA       GLU  14  27.798  -4.057 -11.485
   80    HB2  GLU  14           HB2      GLU  14  28.917  -2.879  -9.723
   81    HB3  GLU  14           HB3      GLU  14  29.050  -1.969 -11.228
   82    HG2  GLU  14           HG2      GLU  14  27.131  -0.511 -10.413
   83    HG3  GLU  14           HG3      GLU  14  27.237  -1.339  -8.863
   84    H    PHE  15           H        PHE  15  24.812  -2.469 -10.767
   85    HA   PHE  15           HA       PHE  15  24.274  -4.178  -8.379
   86    HB2  PHE  15           HB2      PHE  15  22.751  -1.863  -9.627
   87    HB3  PHE  15           HB3      PHE  15  22.214  -2.777  -8.235
   88    HD1  PHE  15           HD1      PHE  15  25.562  -2.606  -7.394
   89    HD2  PHE  15           HD2      PHE  15  22.117  -0.053  -7.921
   90    HE1  PHE  15           HE1      PHE  15  26.523  -0.961  -5.821
   91    HE2  PHE  15           HE2      PHE  15  23.097   1.580  -6.336
   92    HZ   PHE  15           HZ       PHE  15  25.298   1.123  -5.278
   93    H    ARG  16           H        ARG  16  24.061  -4.564 -11.675
   94    HA   ARG  16           HA       ARG  16  21.372  -5.881 -11.620
   95    HB2  ARG  16           HB2      ARG  16  22.839  -4.377 -13.812
   96    HB3  ARG  16           HB3      ARG  16  21.337  -5.279 -14.067
   97    HG2  ARG  16           HG2      ARG  16  20.061  -3.811 -12.685
   98    HG3  ARG  16           HG3      ARG  16  21.485  -3.117 -11.939
   99    HD2  ARG  16           HD2      ARG  16  20.702  -1.479 -13.329
  100    HD3  ARG  16           HD3      ARG  16  22.119  -2.100 -14.163
  101    HE   ARG  16           HE       ARG  16  20.298  -3.497 -15.480
  102   HH11  ARG  16          1HH1      ARG  16  20.078  -0.078 -14.587
  103   HH12  ARG  16          2HH1      ARG  16  18.779   0.224 -15.715
  104   HH21  ARG  16          1HH2      ARG  16  18.933  -2.978 -17.119
  105   HH22  ARG  16          2HH2      ARG  16  18.203  -1.390 -17.196
  106    H    ASP  17           H        ASP  17  21.146  -7.914 -12.300
  107    HA   ASP  17           HA       ASP  17  23.513  -9.474 -13.073
  108    HB2  ASP  17           HB2      ASP  17  21.808 -10.325 -11.481
  109    HB3  ASP  17           HB3      ASP  17  20.665 -10.454 -12.832
  110    HA   PRO  18           HA       PRO  18  22.834  -8.688 -17.371
  111    HB2  PRO  18           HB2      PRO  18  24.313 -10.737 -18.549
  112    HB3  PRO  18           HB3      PRO  18  24.997  -9.246 -17.822
  113    HG2  PRO  18           HG2      PRO  18  24.703 -11.974 -16.569
  114    HG3  PRO  18           HG3      PRO  18  26.123 -10.874 -16.526
  115    HD2  PRO  18           HD2      PRO  18  24.401 -11.030 -14.456
  116    HD3  PRO  18           HD3      PRO  18  25.080  -9.454 -14.955
  117    H    LEU  19           H        LEU  19  21.745 -11.831 -16.088
  118    HA   LEU  19           HA       LEU  19  20.498 -12.626 -18.623
  119    HB2  LEU  19           HB2      LEU  19  21.290 -14.310 -17.105
  120    HB3  LEU  19           HB3      LEU  19  20.328 -13.673 -15.784
  121    HG   LEU  19           HG       LEU  19  18.260 -14.349 -16.957
  122   HD11  LEU  19          1HD1      LEU  19  18.413 -15.880 -18.931
  123   HD12  LEU  19          2HD1      LEU  19  20.160 -15.596 -19.003
  124   HD13  LEU  19          3HD1      LEU  19  19.019 -14.264 -19.318
  125   HD21  LEU  19          3HD2      LEU  19  20.317 -16.569 -16.598
  126   HD22  LEU  19          1HD2      LEU  19  18.560 -16.784 -16.639
  127   HD23  LEU  19          2HD2      LEU  19  19.303 -15.849 -15.327
  128    H    MET  20           H        MET  20  19.238 -11.294 -15.516
  129    HA   MET  20           HA       MET  20  16.562 -10.926 -16.766
  130    HB2  MET  20           HB2      MET  20  17.618 -10.666 -13.931
  131    HB3  MET  20           HB3      MET  20  16.005 -10.113 -14.406
  132    HG2  MET  20           HG2      MET  20  15.465 -12.364 -15.297
  133    HG3  MET  20           HG3      MET  20  17.031 -12.947 -14.764
  134    HE1  MET  20           HE1      MET  20  14.383 -10.547 -12.895
  135    HE2  MET  20           HE2      MET  20  13.457 -11.774 -13.788
  136    HE3  MET  20           HE3      MET  20  13.476 -11.785 -12.010
  137    H    ASP  21           H        ASP  21  19.326  -8.928 -16.128
  138    HA   ASP  21           HA       ASP  21  19.754  -6.740 -16.383
  139    HB2  ASP  21           HB2      ASP  21  19.131  -7.317 -18.684
  140    HB3  ASP  21           HB3      ASP  21  17.471  -6.822 -18.380
  141    H    THR  22           H        THR  22  18.663  -7.030 -14.093
  142    HA   THR  22           HA       THR  22  17.298  -4.515 -13.512
  143    HB   THR  22           HB       THR  22  15.434  -6.059 -14.115
  144    HG1  THR  22           HG1      THR  22  14.249  -5.388 -12.318
  145   HG21  THR  22          1HG2      THR  22  14.751  -7.813 -12.580
  146   HG22  THR  22          2HG2      THR  22  16.110  -7.477 -11.492
  147   HG23  THR  22          3HG2      THR  22  16.413  -8.152 -13.100
  148    H    LEU  23           H        LEU  23  17.057  -4.197 -11.151
  149    HA   LEU  23           HA       LEU  23  19.629  -4.544  -9.959
  150    HB2  LEU  23           HB2      LEU  23  17.765  -2.664  -9.735
  151    HB3  LEU  23           HB3      LEU  23  17.212  -3.637  -8.388
  152    HG   LEU  23           HG       LEU  23  19.929  -2.321  -8.762
  153   HD11  LEU  23          1HD1      LEU  23  17.704  -1.822  -6.736
  154   HD12  LEU  23          2HD1      LEU  23  18.064  -0.835  -8.164
  155   HD13  LEU  23          3HD1      LEU  23  19.246  -0.938  -6.848
  156   HD21  LEU  23          3HD2      LEU  23  19.003  -4.032  -6.419
  157   HD22  LEU  23          1HD2      LEU  23  20.445  -2.992  -6.419
  158   HD23  LEU  23          2HD2      LEU  23  20.359  -4.370  -7.504
  159    H    MET  24           H        MET  24  20.398  -6.265  -8.889
  160    HA   MET  24           HA       MET  24  18.759  -8.567  -8.363
  161    HB2  MET  24           HB2      MET  24  20.799  -9.595  -7.513
  162    HB3  MET  24           HB3      MET  24  21.015  -8.808  -9.075
  163    HG2  MET  24           HG2      MET  24  22.050  -6.856  -7.817
  164    HG3  MET  24           HG3      MET  24  21.998  -7.842  -6.364
  165    HE1  MET  24           HE1      MET  24  24.460  -6.488  -8.591
  166    HE2  MET  24           HE2      MET  24  24.507  -6.680  -6.829
  167    HE3  MET  24           HE3      MET  24  25.739  -7.465  -7.846
  168    H    THR  25           H        THR  25  19.943  -6.095  -6.163
  169    HA   THR  25           HA       THR  25  19.645  -5.542  -4.013
  170    HB   THR  25           HB       THR  25  17.645  -5.966  -2.804
  171    HG1  THR  25           HG1      THR  25  17.278  -7.998  -4.711
  172   HG21  THR  25          1HG2      THR  25  16.991  -5.554  -5.755
  173   HG22  THR  25          2HG2      THR  25  17.510  -4.300  -4.597
  174   HG23  THR  25          3HG2      THR  25  15.970  -5.124  -4.367
  175    H    ASP  26           H        ASP  26  19.603  -9.004  -4.494
  176    HA   ASP  26           HA       ASP  26  21.252  -9.341  -2.006
  177    HB2  ASP  26           HB2      ASP  26  19.294 -11.238  -3.329
  178    HB3  ASP  26           HB3      ASP  26  20.494 -11.735  -2.138
  179    HA   PRO  27           HA       PRO  27  24.101 -10.381  -5.497
  180    HB2  PRO  27           HB2      PRO  27  26.336  -9.208  -4.382
  181    HB3  PRO  27           HB3      PRO  27  25.180  -8.345  -5.407
  182    HG2  PRO  27           HG2      PRO  27  25.293  -8.395  -2.385
  183    HG3  PRO  27           HG3      PRO  27  25.069  -6.985  -3.469
  184    HD2  PRO  27           HD2      PRO  27  23.012  -8.222  -2.198
  185    HD3  PRO  27           HD3      PRO  27  22.817  -7.540  -3.847
  186    H    VAL  28           H        VAL  28  25.092 -12.306  -5.461
  187    HA   VAL  28           HA       VAL  28  26.134 -13.455  -2.892
  188    HB   VAL  28           HB       VAL  28  24.557 -14.887  -5.080
  189   HG11  VAL  28          1HG1      VAL  28  26.299 -16.396  -4.199
  190   HG12  VAL  28          2HG1      VAL  28  25.788 -16.017  -2.533
  191   HG13  VAL  28          3HG1      VAL  28  24.701 -16.877  -3.642
  192   HG21  VAL  28          3HG2      VAL  28  23.907 -14.328  -2.136
  193   HG22  VAL  28          1HG2      VAL  28  23.116 -13.584  -3.540
  194   HG23  VAL  28          2HG2      VAL  28  22.920 -15.313  -3.243
  195    H    ARG  29           H        ARG  29  28.053 -14.272  -2.956
  196    HA   ARG  29           HA       ARG  29  29.754 -13.875  -5.299
  197    HB2  ARG  29           HB2      ARG  29  30.207 -13.135  -2.878
  198    HB3  ARG  29           HB3      ARG  29  30.497 -14.837  -2.505
  199    HG2  ARG  29           HG2      ARG  29  32.337 -14.823  -4.215
  200    HG3  ARG  29           HG3      ARG  29  31.998 -13.125  -4.552
  201    HD2  ARG  29           HD2      ARG  29  33.911 -13.291  -3.052
  202    HD3  ARG  29           HD3      ARG  29  32.555 -12.555  -2.198
  203    HE   ARG  29           HE       ARG  29  32.582 -14.295  -0.682
  204   HH11  ARG  29          1HH1      ARG  29  34.176 -15.626  -3.575
  205   HH12  ARG  29          2HH1      ARG  29  34.760 -16.996  -2.681
  206   HH21  ARG  29          1HH2      ARG  29  33.253 -16.011   0.306
  207   HH22  ARG  29          2HH2      ARG  29  34.208 -17.263  -0.488
  208    H    LEU  30           H        LEU  30  30.815 -15.412  -6.388
  209    HA   LEU  30           HA       LEU  30  30.403 -18.315  -5.866
  210    HB2  LEU  30           HB2      LEU  30  31.502 -16.805  -8.291
  211    HB3  LEU  30           HB3      LEU  30  31.205 -18.521  -8.223
  212    HG   LEU  30           HG       LEU  30  29.138 -16.298  -8.199
  213   HD11  LEU  30          1HD1      LEU  30  30.051 -16.868 -10.388
  214   HD12  LEU  30          2HD1      LEU  30  28.386 -17.463 -10.258
  215   HD13  LEU  30          3HD1      LEU  30  29.736 -18.603 -10.096
  216   HD21  LEU  30          3HD2      LEU  30  28.286 -17.971  -6.649
  217   HD22  LEU  30          1HD2      LEU  30  28.670 -19.286  -7.783
  218   HD23  LEU  30          2HD2      LEU  30  27.406 -18.101  -8.167
  219    HA   PRO  31           HA       PRO  31  34.508 -18.909  -4.413
  220    HB2  PRO  31           HB2      PRO  31  35.393 -21.230  -5.635
  221    HB3  PRO  31           HB3      PRO  31  34.168 -21.177  -4.336
  222    HG2  PRO  31           HG2      PRO  31  33.705 -21.297  -7.329
  223    HG3  PRO  31           HG3      PRO  31  32.964 -22.310  -6.053
  224    HD2  PRO  31           HD2      PRO  31  31.674 -20.170  -7.053
  225    HD3  PRO  31           HD3      PRO  31  31.600 -20.487  -5.296
  226    H    SER  32           H        SER  32  34.130 -18.626  -7.935
  227    HA   SER  32           HA       SER  32  36.920 -18.145  -8.576
  228    HB2  SER  32           HB2      SER  32  35.919 -17.317 -10.693
  229    HB3  SER  32           HB3      SER  32  35.270 -18.897 -10.214
  230    HG   SER  32           HG       SER  32  33.582 -17.501 -10.860
  231    H    GLY  33           H        GLY  33  34.679 -16.260  -6.821
  232    HA2  GLY  33           HA2      GLY  33  34.985 -14.106  -5.930
  233    HA3  GLY  33           HA3      GLY  33  36.216 -13.735  -7.167
  234    H    THR  34           H        THR  34  33.709 -15.076  -8.862
  235    HA   THR  34           HA       THR  34  32.689 -12.562  -9.900
  236    HB   THR  34           HB       THR  34  31.824 -15.457 -10.319
  237    HG1  THR  34           HG1      THR  34  33.857 -15.051 -11.119
  238   HG21  THR  34          1HG2      THR  34  31.025 -12.956 -11.884
  239   HG22  THR  34          2HG2      THR  34  29.934 -14.032 -10.973
  240   HG23  THR  34          3HG2      THR  34  30.764 -14.630 -12.414
  241    H    VAL  35           H        VAL  35  30.632 -11.664  -9.624
  242    HA   VAL  35           HA       VAL  35  29.006 -12.656  -7.304
  243    HB   VAL  35           HB       VAL  35  29.317  -9.799  -8.290
  244   HG11  VAL  35          1HG1      VAL  35  27.036 -10.130  -7.437
  245   HG12  VAL  35          2HG1      VAL  35  27.675 -10.936  -5.983
  246   HG13  VAL  35          3HG1      VAL  35  27.972  -9.208  -6.281
  247   HG21  VAL  35          3HG2      VAL  35  30.331  -9.435  -6.021
  248   HG22  VAL  35          1HG2      VAL  35  30.262 -11.188  -5.733
  249   HG23  VAL  35          2HG2      VAL  35  31.296 -10.523  -7.025
  250    H    MET  36           H        MET  36  26.855 -12.833  -7.530
  251    HA   MET  36           HA       MET  36  25.479 -12.375 -10.121
  252    HB2  MET  36           HB2      MET  36  26.692 -14.651  -9.916
  253    HB3  MET  36           HB3      MET  36  25.505 -15.046  -8.676
  254    HG2  MET  36           HG2      MET  36  23.695 -14.854 -10.294
  255    HG3  MET  36           HG3      MET  36  24.794 -14.234 -11.524
  256    HE1  MET  36           HE1      MET  36  27.349 -15.987 -11.521
  257    HE2  MET  36           HE2      MET  36  26.856 -17.223 -12.680
  258    HE3  MET  36           HE3      MET  36  26.380 -15.529 -12.930
  259    H    ASP  37           H        ASP  37  23.140 -12.740  -9.932
  260    HA   ASP  37           HA       ASP  37  21.936 -11.800  -7.448
  261    HB2  ASP  37           HB2      ASP  37  20.958 -11.154  -9.546
  262    HB3  ASP  37           HB3      ASP  37  20.891 -12.829 -10.089
  263    H    ARG  38           H        ARG  38  21.028 -12.891  -5.849
  264    HA   ARG  38           HA       ARG  38  21.482 -15.547  -5.205
  265    HB2  ARG  38           HB2      ARG  38  20.806 -13.752  -3.641
  266    HB3  ARG  38           HB3      ARG  38  19.198 -13.705  -4.345
  267    HG2  ARG  38           HG2      ARG  38  18.766 -16.013  -3.602
  268    HG3  ARG  38           HG3      ARG  38  20.396 -16.146  -2.935
  269    HD2  ARG  38           HD2      ARG  38  18.295 -14.114  -2.055
  270    HD3  ARG  38           HD3      ARG  38  18.555 -15.687  -1.277
  271    HE   ARG  38           HE       ARG  38  21.055 -14.415  -1.330
  272   HH11  ARG  38          1HH1      ARG  38  17.915 -13.837   0.206
  273   HH12  ARG  38          2HH1      ARG  38  18.624 -12.969   1.538
  274   HH21  ARG  38          1HH2      ARG  38  21.899 -13.297   0.424
  275   HH22  ARG  38          2HH2      ARG  38  20.840 -12.694   1.665
  276    H    SER  39           H        SER  39  18.427 -14.266  -6.632
  277    HA   SER  39           HA       SER  39  17.069 -16.789  -6.512
  278    HB2  SER  39           HB2      SER  39  16.453 -14.358  -8.223
  279    HB3  SER  39           HB3      SER  39  15.356 -15.701  -7.869
  280    HG   SER  39           HG       SER  39  15.002 -13.896  -6.479
  281    H    ILE  40           H        ILE  40  18.865 -15.180  -9.169
  282    HA   ILE  40           HA       ILE  40  18.256 -17.167 -11.180
  283    HB   ILE  40           HB       ILE  40  20.464 -15.086 -10.919
  284   HG12  ILE  40          2HG1      ILE  40  18.038 -15.241 -12.772
  285   HG13  ILE  40          3HG1      ILE  40  18.025 -14.390 -11.229
  286   HG21  ILE  40          1HG2      ILE  40  21.376 -16.868 -12.327
  287   HG22  ILE  40          2HG2      ILE  40  19.880 -16.936 -13.284
  288   HG23  ILE  40          3HG2      ILE  40  20.942 -15.509 -13.341
  289   HD11  ILE  40          3HD1      ILE  40  19.966 -12.993 -12.080
  290   HD12  ILE  40          1HD1      ILE  40  19.639 -13.687 -13.682
  291   HD13  ILE  40          2HD1      ILE  40  18.412 -12.727 -12.842
  292    H    ILE  41           H        ILE  41  21.137 -16.906  -8.986
  293    HA   ILE  41           HA       ILE  41  22.258 -19.321 -10.070
  294    HB   ILE  41           HB       ILE  41  23.629 -17.658  -8.885
  295   HG12  ILE  41          2HG1      ILE  41  25.090 -19.176  -7.631
  296   HG13  ILE  41          3HG1      ILE  41  23.839 -20.423  -7.623
  297   HG21  ILE  41          1HG2      ILE  41  22.494 -18.769  -6.281
  298   HG22  ILE  41          2HG2      ILE  41  23.773 -17.551  -6.462
  299   HG23  ILE  41          3HG2      ILE  41  22.122 -17.174  -6.959
  300   HD11  ILE  41          3HD1      ILE  41  25.207 -19.309 -10.114
  301   HD12  ILE  41          1HD1      ILE  41  25.594 -20.845  -9.313
  302   HD13  ILE  41          2HD1      ILE  41  24.020 -20.635 -10.082
  303    H    LEU  42           H        LEU  42  20.155 -18.901  -7.145
  304    HA   LEU  42           HA       LEU  42  20.230 -21.722  -6.617
  305    HB2  LEU  42           HB2      LEU  42  18.706 -21.378  -4.901
  306    HB3  LEU  42           HB3      LEU  42  19.709 -19.939  -4.984
  307    HG   LEU  42           HG       LEU  42  17.710 -18.918  -6.342
  308   HD11  LEU  42          1HD1      LEU  42  15.490 -19.757  -5.615
  309   HD12  LEU  42          2HD1      LEU  42  16.265 -21.162  -4.862
  310   HD13  LEU  42          3HD1      LEU  42  16.300 -20.956  -6.617
  311   HD21  LEU  42          3HD2      LEU  42  17.463 -19.523  -3.362
  312   HD22  LEU  42          1HD2      LEU  42  16.686 -18.173  -4.227
  313   HD23  LEU  42          2HD2      LEU  42  18.447 -18.235  -4.073
  314    H    ARG  43           H        ARG  43  18.071 -19.822  -8.726
  315    HA   ARG  43           HA       ARG  43  16.263 -21.995  -9.251
  316    HB2  ARG  43           HB2      ARG  43  15.675 -19.688  -9.720
  317    HB3  ARG  43           HB3      ARG  43  16.973 -19.545 -10.908
  318    HG2  ARG  43           HG2      ARG  43  14.809 -19.790 -11.996
  319    HG3  ARG  43           HG3      ARG  43  15.845 -21.163 -12.384
  320    HD2  ARG  43           HD2      ARG  43  14.634 -22.547 -10.698
  321    HD3  ARG  43           HD3      ARG  43  13.619 -21.148 -10.302
  322    HE   ARG  43           HE       ARG  43  13.502 -21.624 -13.110
  323   HH11  ARG  43          1HH1      ARG  43  12.304 -23.110 -10.133
  324   HH12  ARG  43          2HH1      ARG  43  11.010 -23.938 -10.954
  325   HH21  ARG  43          1HH2      ARG  43  11.792 -22.692 -14.101
  326   HH22  ARG  43          2HH2      ARG  43  10.725 -23.690 -13.163
  327    H    HIS  44           H        HIS  44  19.348 -21.005 -10.850
  328    HA   HIS  44           HA       HIS  44  19.156 -23.079 -12.848
  329    HB2  HIS  44           HB2      HIS  44  20.692 -20.971 -12.777
  330    HB3  HIS  44           HB3      HIS  44  21.788 -21.988 -11.823
  331    HD1  HIS  44           HD1      HIS  44  23.218 -23.734 -13.310
  332    HD2  HIS  44           HD2      HIS  44  20.002 -21.876 -15.289
  333    HE1  HIS  44           HE1      HIS  44  23.364 -24.437 -15.753
  334    H    LEU  45           H        LEU  45  20.807 -23.001  -9.637
  335    HA   LEU  45           HA       LEU  45  21.792 -25.668  -9.628
  336    HB2  LEU  45           HB2      LEU  45  21.136 -23.566  -7.582
  337    HB3  LEU  45           HB3      LEU  45  21.325 -25.209  -7.003
  338    HG   LEU  45           HG       LEU  45  23.561 -25.395  -7.717
  339   HD11  LEU  45          1HD1      LEU  45  24.821 -23.644  -8.905
  340   HD12  LEU  45          2HD1      LEU  45  23.336 -22.711  -9.131
  341   HD13  LEU  45          3HD1      LEU  45  23.533 -24.292  -9.907
  342   HD21  LEU  45          3HD2      LEU  45  24.625 -23.566  -6.444
  343   HD22  LEU  45          1HD2      LEU  45  23.154 -24.145  -5.628
  344   HD23  LEU  45          2HD2      LEU  45  23.128 -22.618  -6.536
  345    H    LEU  46           H        LEU  46  18.544 -24.513  -8.707
  346    HA   LEU  46           HA       LEU  46  17.508 -26.982  -7.761
  347    HB2  LEU  46           HB2      LEU  46  16.509 -24.743  -7.428
  348    HB3  LEU  46           HB3      LEU  46  16.149 -24.633  -9.151
  349    HG   LEU  46           HG       LEU  46  14.545 -26.528  -8.938
  350   HD11  LEU  46          1HD1      LEU  46  13.832 -27.251  -6.654
  351   HD12  LEU  46          2HD1      LEU  46  15.180 -26.338  -5.953
  352   HD13  LEU  46          3HD1      LEU  46  15.499 -27.734  -7.004
  353   HD21  LEU  46          3HD2      LEU  46  14.098 -24.246  -6.971
  354   HD22  LEU  46          1HD2      LEU  46  12.828 -25.265  -7.693
  355   HD23  LEU  46          2HD2      LEU  46  13.792 -24.181  -8.719
  356    H    ASN  47           H        ASN  47  17.896 -25.806 -11.088
  357    HA   ASN  47           HA       ASN  47  16.462 -28.106 -12.261
  358    HB2  ASN  47           HB2      ASN  47  17.993 -25.742 -13.423
  359    HB3  ASN  47           HB3      ASN  47  17.453 -27.106 -14.410
  360   HD21  ASN  47          1HD2      ASN  47  16.280 -24.404 -12.357
  361   HD22  ASN  47          2HD2      ASN  47  14.648 -24.435 -13.024
  362    H    SER  48           H        SER  48  19.896 -27.017 -11.957
  363    HA   SER  48           HA       SER  48  20.800 -29.666 -11.395
  364    HB2  SER  48           HB2      SER  48  22.353 -29.973 -13.331
  365    HB3  SER  48           HB3      SER  48  20.652 -30.182 -13.726
  366    HG   SER  48           HG       SER  48  21.751 -28.905 -15.292
  367    HA   PRO  49           HA       PRO  49  23.718 -27.075  -9.468
  368    HB2  PRO  49           HB2      PRO  49  25.606 -28.779  -8.515
  369    HB3  PRO  49           HB3      PRO  49  23.896 -28.833  -7.989
  370    HG2  PRO  49           HG2      PRO  49  25.215 -30.532 -10.142
  371    HG3  PRO  49           HG3      PRO  49  24.223 -31.085  -8.754
  372    HD2  PRO  49           HD2      PRO  49  23.158 -30.704 -11.226
  373    HD3  PRO  49           HD3      PRO  49  22.239 -30.311  -9.746
  374    H    THR  50           H        THR  50  24.124 -26.021 -11.559
  375    HA   THR  50           HA       THR  50  27.011 -25.916 -12.144
  376    HB   THR  50           HB       THR  50  26.530 -25.663 -14.589
  377    HG1  THR  50           HG1      THR  50  24.043 -26.814 -13.869
  378   HG21  THR  50          1HG2      THR  50  26.356 -27.993 -15.182
  379   HG22  THR  50          2HG2      THR  50  25.810 -28.413 -13.546
  380   HG23  THR  50          3HG2      THR  50  27.461 -27.784 -13.814
  381    H    ASP  51           H        ASP  51  27.694 -24.001 -13.169
  382    HA   ASP  51           HA       ASP  51  26.403 -21.605 -12.278
  383    HB2  ASP  51           HB2      ASP  51  28.833 -21.894 -12.538
  384    HB3  ASP  51           HB3      ASP  51  28.647 -22.052 -14.283
  385    HA   PRO  52           HA       PRO  52  23.473 -21.217 -15.604
  386    HB2  PRO  52           HB2      PRO  52  22.863 -18.461 -15.437
  387    HB3  PRO  52           HB3      PRO  52  22.162 -19.776 -14.440
  388    HG2  PRO  52           HG2      PRO  52  24.428 -17.898 -13.799
  389    HG3  PRO  52           HG3      PRO  52  23.115 -18.482 -12.732
  390    HD2  PRO  52           HD2      PRO  52  25.623 -19.522 -12.630
  391    HD3  PRO  52           HD3      PRO  52  24.188 -20.560 -12.400
  392    H    PHE  53           H        PHE  53  26.389 -19.242 -15.761
  393    HA   PHE  53           HA       PHE  53  25.843 -18.612 -18.642
  394    HB2  PHE  53           HB2      PHE  53  27.766 -17.348 -16.660
  395    HB3  PHE  53           HB3      PHE  53  27.538 -16.861 -18.331
  396    HD1  PHE  53           HD1      PHE  53  25.429 -15.734 -19.056
  397    HD2  PHE  53           HD2      PHE  53  26.174 -16.724 -14.931
  398    HE1  PHE  53           HE1      PHE  53  23.636 -14.161 -18.356
  399    HE2  PHE  53           HE2      PHE  53  24.357 -15.154 -14.227
  400    HZ   PHE  53           HZ       PHE  53  23.122 -13.870 -15.934
  401    H    ASN  54           H        ASN  54  28.158 -20.155 -16.455
  402    HA   ASN  54           HA       ASN  54  30.090 -20.651 -18.659
  403    HB2  ASN  54           HB2      ASN  54  30.301 -20.948 -15.637
  404    HB3  ASN  54           HB3      ASN  54  31.599 -21.300 -16.778
  405   HD21  ASN  54          1HD2      ASN  54  29.628 -18.685 -15.355
  406   HD22  ASN  54          2HD2      ASN  54  30.730 -17.400 -15.831
  407    H    ARG  55           H        ARG  55  27.842 -22.403 -16.578
  408    HA   ARG  55           HA       ARG  55  27.112 -24.469 -16.447
  409    HB2  ARG  55           HB2      ARG  55  28.354 -24.942 -19.184
  410    HB3  ARG  55           HB3      ARG  55  27.064 -25.886 -18.439
  411    HG2  ARG  55           HG2      ARG  55  26.836 -22.932 -19.199
  412    HG3  ARG  55           HG3      ARG  55  26.236 -24.279 -20.156
  413    HD2  ARG  55           HD2      ARG  55  24.557 -24.848 -18.545
  414    HD3  ARG  55           HD3      ARG  55  25.306 -23.860 -17.296
  415    HE   ARG  55           HE       ARG  55  24.376 -21.947 -18.129
  416   HH11  ARG  55          1HH1      ARG  55  23.749 -24.481 -20.528
  417   HH12  ARG  55          2HH1      ARG  55  22.640 -23.473 -21.404
  418   HH21  ARG  55          1HH2      ARG  55  23.003 -20.734 -19.279
  419   HH22  ARG  55          2HH2      ARG  55  22.217 -21.365 -20.713
  420    H    GLN  56           H        GLN  56  30.049 -23.915 -15.704
  421    HA   GLN  56           HA       GLN  56  31.107 -26.632 -15.316
  422    HB2  GLN  56           HB2      GLN  56  32.733 -25.572 -13.869
  423    HB3  GLN  56           HB3      GLN  56  32.639 -24.696 -15.388
  424    HG2  GLN  56           HG2      GLN  56  31.279 -22.914 -14.302
  425    HG3  GLN  56           HG3      GLN  56  31.282 -23.819 -12.790
  426   HE21  GLN  56          1HE2      GLN  56  33.402 -24.124 -11.645
  427   HE22  GLN  56          2HE2      GLN  56  34.664 -22.934 -11.952
  428    H    MET  57           H        MET  57  31.241 -27.623 -13.155
  429    HA   MET  57           HA       MET  57  28.706 -27.755 -11.860
  430    HB2  MET  57           HB2      MET  57  30.489 -29.539 -12.096
  431    HB3  MET  57           HB3      MET  57  31.361 -28.780 -10.772
  432    HG2  MET  57           HG2      MET  57  28.473 -29.756 -10.629
  433    HG3  MET  57           HG3      MET  57  29.844 -30.767 -10.235
  434    HE1  MET  57           HE1      MET  57  31.330 -30.622  -8.173
  435    HE2  MET  57           HE2      MET  57  31.826 -28.939  -8.498
  436    HE3  MET  57           HE3      MET  57  31.208 -29.390  -6.900
  437    H    LEU  58           H        LEU  58  27.861 -26.884 -10.071
  438    HA   LEU  58           HA       LEU  58  29.371 -25.111  -8.269
  439    HB2  LEU  58           HB2      LEU  58  28.718 -23.901 -10.515
  440    HB3  LEU  58           HB3      LEU  58  27.076 -23.983  -9.929
  441    HG   LEU  58           HG       LEU  58  27.925 -21.820  -9.526
  442   HD11  LEU  58          1HD1      LEU  58  28.122 -23.148  -6.803
  443   HD12  LEU  58          2HD1      LEU  58  26.590 -22.725  -7.607
  444   HD13  LEU  58          3HD1      LEU  58  27.753 -21.467  -7.154
  445   HD21  LEU  58          3HD2      LEU  58  30.298 -23.013  -8.040
  446   HD22  LEU  58          1HD2      LEU  58  29.950 -21.296  -8.262
  447   HD23  LEU  58          2HD2      LEU  58  30.328 -22.313  -9.665
  448    H    THR  59           H        THR  59  28.553 -25.588  -6.251
  449    HA   THR  59           HA       THR  59  25.677 -26.361  -5.980
  450    HB   THR  59           HB       THR  59  26.496 -27.447  -3.787
  451    HG1  THR  59           HG1      THR  59  28.523 -27.246  -3.427
  452   HG21  THR  59          1HG2      THR  59  27.300 -28.600  -6.485
  453   HG22  THR  59          2HG2      THR  59  25.732 -28.761  -5.666
  454   HG23  THR  59          3HG2      THR  59  27.174 -29.518  -4.966
  455    H    GLU  60           H        GLU  60  24.648 -25.881  -4.006
  456    HA   GLU  60           HA       GLU  60  24.672 -23.159  -3.270
  457    HB2  GLU  60           HB2      GLU  60  23.082 -23.855  -1.529
  458    HB3  GLU  60           HB3      GLU  60  22.710 -24.543  -3.106
  459    HG2  GLU  60           HG2      GLU  60  23.723 -26.729  -2.404
  460    HG3  GLU  60           HG3      GLU  60  24.110 -26.030  -0.832
  461    H    SER  61           H        SER  61  26.619 -25.773  -1.961
  462    HA   SER  61           HA       SER  61  27.347 -24.500   0.541
  463    HB2  SER  61           HB2      SER  61  29.161 -26.225   0.488
  464    HB3  SER  61           HB3      SER  61  27.519 -26.864   0.358
  465    HG   SER  61           HG       SER  61  29.008 -27.826  -1.152
  466    H    MET  62           H        MET  62  28.307 -23.905  -2.734
  467    HA   MET  62           HA       MET  62  30.929 -22.726  -2.031
  468    HB2  MET  62           HB2      MET  62  29.479 -22.814  -4.703
  469    HB3  MET  62           HB3      MET  62  31.166 -22.396  -4.412
  470    HG2  MET  62           HG2      MET  62  31.639 -24.678  -3.622
  471    HG3  MET  62           HG3      MET  62  29.955 -25.127  -3.913
  472    HE1  MET  62           HE1      MET  62  32.551 -26.649  -5.047
  473    HE2  MET  62           HE2      MET  62  30.888 -27.199  -5.352
  474    HE3  MET  62           HE3      MET  62  32.022 -27.019  -6.707
  475    H    LEU  63           H        LEU  63  27.763 -21.620  -1.897
  476    HA   LEU  63           HA       LEU  63  28.207 -18.910  -2.978
  477    HB2  LEU  63           HB2      LEU  63  25.774 -20.190  -1.677
  478    HB3  LEU  63           HB3      LEU  63  25.811 -18.651  -2.531
  479    HG   LEU  63           HG       LEU  63  26.205 -21.425  -3.722
  480   HD11  LEU  63          1HD1      LEU  63  24.029 -19.323  -4.148
  481   HD12  LEU  63          2HD1      LEU  63  23.871 -20.797  -3.154
  482   HD13  LEU  63          3HD1      LEU  63  24.110 -20.930  -4.904
  483   HD21  LEU  63          3HD2      LEU  63  26.233 -20.284  -5.945
  484   HD22  LEU  63          1HD2      LEU  63  27.662 -19.911  -4.975
  485   HD23  LEU  63          2HD2      LEU  63  26.349 -18.718  -5.113
  486    H    GLU  64           H        GLU  64  27.874 -17.002  -1.844
  487    HA   GLU  64           HA       GLU  64  27.519 -16.905   1.062
  488    HB2  GLU  64           HB2      GLU  64  29.909 -17.397   0.921
  489    HB3  GLU  64           HB3      GLU  64  30.137 -16.113  -0.265
  490    HG2  GLU  64           HG2      GLU  64  29.536 -14.410   1.458
  491    HG3  GLU  64           HG3      GLU  64  29.242 -15.701   2.630
  492    HA   PRO  65           HA       PRO  65  25.733 -13.167  -0.770
  493    HB2  PRO  65           HB2      PRO  65  24.693 -11.927   1.438
  494    HB3  PRO  65           HB3      PRO  65  23.988 -13.398   0.699
  495    HG2  PRO  65           HG2      PRO  65  25.879 -13.212   3.070
  496    HG3  PRO  65           HG3      PRO  65  24.353 -14.153   2.949
  497    HD2  PRO  65           HD2      PRO  65  26.790 -15.297   2.545
  498    HD3  PRO  65           HD3      PRO  65  25.355 -15.790   1.584
  499    H    VAL  66           H        VAL  66  26.356 -11.043  -1.136
  500    HA   VAL  66           HA       VAL  66  28.959 -10.253   0.047
  501    HB   VAL  66           HB       VAL  66  27.561  -9.101  -2.380
  502   HG11  VAL  66          1HG1      VAL  66  30.405  -8.766  -1.294
  503   HG12  VAL  66          2HG1      VAL  66  29.837  -8.170  -2.860
  504   HG13  VAL  66          3HG1      VAL  66  29.155  -7.503  -1.379
  505   HG21  VAL  66          3HG2      VAL  66  29.838 -11.098  -2.178
  506   HG22  VAL  66          1HG2      VAL  66  28.196 -11.455  -2.778
  507   HG23  VAL  66          2HG2      VAL  66  29.248 -10.349  -3.681
  508    HA   PRO  67           HA       PRO  67  26.522  -7.045   2.235
  509    HB2  PRO  67           HB2      PRO  67  28.278  -6.409   4.208
  510    HB3  PRO  67           HB3      PRO  67  27.404  -7.976   4.200
  511    HG2  PRO  67           HG2      PRO  67  30.232  -7.432   3.258
  512    HG3  PRO  67           HG3      PRO  67  29.649  -8.744   4.319
  513    HD2  PRO  67           HD2      PRO  67  30.028  -9.072   1.610
  514    HD3  PRO  67           HD3      PRO  67  28.756  -9.939   2.522
  515    H    GLU  68           H        GLU  68  29.924  -6.557   1.143
  516    HA   GLU  68           HA       GLU  68  29.855  -3.721   1.381
  517    HB2  GLU  68           HB2      GLU  68  31.865  -3.711   0.037
  518    HB3  GLU  68           HB3      GLU  68  31.926  -4.951   1.286
  519    HG2  GLU  68           HG2      GLU  68  31.410  -6.694  -0.420
  520    HG3  GLU  68           HG3      GLU  68  31.331  -5.439  -1.667
  521    H    LEU  69           H        LEU  69  28.495  -5.745  -1.109
  522    HA   LEU  69           HA       LEU  69  27.935  -3.410  -2.870
  523    HB2  LEU  69           HB2      LEU  69  27.394  -6.396  -3.130
  524    HB3  LEU  69           HB3      LEU  69  26.796  -5.204  -4.272
  525    HG   LEU  69           HG       LEU  69  29.749  -5.694  -3.681
  526   HD11  LEU  69          1HD1      LEU  69  29.798  -6.754  -5.894
  527   HD12  LEU  69          2HD1      LEU  69  28.050  -6.491  -6.093
  528   HD13  LEU  69          3HD1      LEU  69  28.654  -7.579  -4.825
  529   HD21  LEU  69          3HD2      LEU  69  30.114  -4.327  -5.756
  530   HD22  LEU  69          1HD2      LEU  69  29.439  -3.378  -4.438
  531   HD23  LEU  69          2HD2      LEU  69  28.388  -3.913  -5.767
  532    H    LYS  70           H        LYS  70  26.149  -5.770  -0.777
  533    HA   LYS  70           HA       LYS  70  23.601  -4.631  -1.394
  534    HB2  LYS  70           HB2      LYS  70  23.984  -6.883  -0.430
  535    HB3  LYS  70           HB3      LYS  70  24.439  -6.152   1.119
  536    HG2  LYS  70           HG2      LYS  70  22.221  -5.200   1.385
  537    HG3  LYS  70           HG3      LYS  70  21.772  -5.631  -0.279
  538    HD2  LYS  70           HD2      LYS  70  21.905  -8.035   0.310
  539    HD3  LYS  70           HD3      LYS  70  22.377  -7.600   1.975
  540    HE2  LYS  70           HE2      LYS  70  20.247  -6.361   2.257
  541    HE3  LYS  70           HE3      LYS  70  19.794  -6.742   0.592
  542    HZ1  LYS  70           HZ1      LYS  70  18.752  -8.230   2.189
  543    HZ2  LYS  70           HZ2      LYS  70  20.205  -8.767   2.719
  544    HZ3  LYS  70           HZ3      LYS  70  19.713  -9.066   1.166
  545    H    GLU  71           H        GLU  71  25.960  -3.719   1.095
  546    HA   GLU  71           HA       GLU  71  24.397  -1.748   2.436
  547    HB2  GLU  71           HB2      GLU  71  26.480  -2.760   3.286
  548    HB3  GLU  71           HB3      GLU  71  27.410  -1.884   2.059
  549    HG2  GLU  71           HG2      GLU  71  26.725   0.272   3.058
  550    HG3  GLU  71           HG3      GLU  71  25.682  -0.578   4.206
  551    H    GLN  72           H        GLN  72  26.335  -1.608  -0.542
  552    HA   GLN  72           HA       GLN  72  26.002   1.296  -0.898
  553    HB2  GLN  72           HB2      GLN  72  27.028  -0.906  -2.731
  554    HB3  GLN  72           HB3      GLN  72  26.837   0.779  -3.233
  555    HG2  GLN  72           HG2      GLN  72  28.344   1.518  -1.413
  556    HG3  GLN  72           HG3      GLN  72  28.558  -0.151  -0.885
  557   HE21  GLN  72          1HE2      GLN  72  29.879  -1.572  -2.168
  558   HE22  GLN  72          2HE2      GLN  72  30.901  -0.937  -3.476
  559    H    ILE  73           H        ILE  73  24.401  -1.630  -2.200
  560    HA   ILE  73           HA       ILE  73  22.537  -0.290  -3.900
  561    HB   ILE  73           HB       ILE  73  22.485  -2.965  -2.454
  562   HG12  ILE  73          2HG1      ILE  73  22.663  -2.342  -5.422
  563   HG13  ILE  73          3HG1      ILE  73  24.096  -2.487  -4.407
  564   HG21  ILE  73          1HG2      ILE  73  20.375  -1.843  -4.339
  565   HG22  ILE  73          2HG2      ILE  73  20.534  -3.567  -3.931
  566   HG23  ILE  73          3HG2      ILE  73  20.154  -2.408  -2.663
  567   HD11  ILE  73          3HD1      ILE  73  23.436  -4.837  -3.835
  568   HD12  ILE  73          1HD1      ILE  73  22.095  -4.713  -4.997
  569   HD13  ILE  73          2HD1      ILE  73  23.771  -4.574  -5.555
  570    H    GLN  74           H        GLN  74  22.102  -1.229  -0.435
  571    HA   GLN  74           HA       GLN  74  19.464  -0.107  -0.325
  572    HB2  GLN  74           HB2      GLN  74  19.533  -0.465   2.048
  573    HB3  GLN  74           HB3      GLN  74  20.275  -1.825   1.217
  574    HG2  GLN  74           HG2      GLN  74  21.730  -1.509   3.012
  575    HG3  GLN  74           HG3      GLN  74  22.528  -0.683   1.698
  576   HE21  GLN  74          1HE2      GLN  74  23.612   1.019   2.631
  577   HE22  GLN  74          2HE2      GLN  74  22.910   2.115   3.827
  578    H    ALA  75           H        ALA  75  22.621   1.434   0.188
  579    HA   ALA  75           HA       ALA  75  21.585   3.920   1.221
  580    HB1  ALA  75           HB1      ALA  75  24.141   3.287  -0.326
  581    HB2  ALA  75           HB2      ALA  75  23.815   4.781   0.578
  582    HB3  ALA  75           HB3      ALA  75  23.966   3.231   1.445
  583    H    TRP  76           H        TRP  76  22.244   2.750  -2.113
  584    HA   TRP  76           HA       TRP  76  21.445   5.196  -3.425
  585    HB2  TRP  76           HB2      TRP  76  22.887   3.442  -4.421
  586    HB3  TRP  76           HB3      TRP  76  21.521   2.335  -4.451
  587    HD1  TRP  76           HD1      TRP  76  22.751   5.608  -6.032
  588    HE1  TRP  76           HE1      TRP  76  21.594   5.987  -8.294
  589    HE3  TRP  76           HE3      TRP  76  19.454   1.687  -5.902
  590    HZ2  TRP  76           HZ2      TRP  76  19.461   4.763  -9.826
  591    HZ3  TRP  76           HZ3      TRP  76  17.862   1.339  -7.749
  592    HH2  TRP  76           HH2      TRP  76  17.853   2.857  -9.724
  593    H    MET  77           H        MET  77  19.646   2.166  -2.668
  594    HA   MET  77           HA       MET  77  17.118   2.925  -3.725
  595    HB2  MET  77           HB2      MET  77  17.856   1.166  -1.354
  596    HB3  MET  77           HB3      MET  77  16.207   1.344  -1.966
  597    HG2  MET  77           HG2      MET  77  16.797   0.396  -4.113
  598    HG3  MET  77           HG3      MET  77  18.508   0.425  -3.712
  599    HE1  MET  77           HE1      MET  77  15.095  -1.380  -3.242
  600    HE2  MET  77           HE2      MET  77  15.420  -2.537  -1.933
  601    HE3  MET  77           HE3      MET  77  15.342  -0.798  -1.585
  602    H    ARG  78           H        ARG  78  18.579   3.740  -0.530
  603    HA   ARG  78           HA       ARG  78  16.323   5.000   0.615
  604    HB2  ARG  78           HB2      ARG  78  18.535   4.398   1.691
  605    HB3  ARG  78           HB3      ARG  78  19.214   5.869   0.980
  606    HG2  ARG  78           HG2      ARG  78  17.404   7.179   2.200
  607    HG3  ARG  78           HG3      ARG  78  16.948   5.680   3.005
  608    HD2  ARG  78           HD2      ARG  78  19.672   7.046   3.141
  609    HD3  ARG  78           HD3      ARG  78  18.423   7.047   4.407
  610    HE   ARG  78           HE       ARG  78  19.022   4.347   3.796
  611   HH11  ARG  78          1HH1      ARG  78  20.590   7.089   5.396
  612   HH12  ARG  78          2HH1      ARG  78  21.603   6.062   6.367
  613   HH21  ARG  78          1HH2      ARG  78  20.408   3.074   5.018
  614   HH22  ARG  78          2HH2      ARG  78  21.479   3.815   6.169
  615    H    GLU  79           H        GLU  79  18.850   6.440  -1.499
  616    HA   GLU  79           HA       GLU  79  17.693   9.081  -1.515
  617    HB2  GLU  79           HB2      GLU  79  19.574   7.714  -3.486
  618    HB3  GLU  79           HB3      GLU  79  19.127   9.422  -3.537
  619    HG2  GLU  79           HG2      GLU  79  20.022   9.691  -1.201
  620    HG3  GLU  79           HG3      GLU  79  20.605   8.024  -1.270
  621    H    LYS  80           H        LYS  80  17.229   6.250  -3.670
  622    HA   LYS  80           HA       LYS  80  15.449   7.557  -5.522
  623    HB2  LYS  80           HB2      LYS  80  15.909   4.656  -4.725
  624    HB3  LYS  80           HB3      LYS  80  14.827   5.108  -6.033
  625    HG2  LYS  80           HG2      LYS  80  17.806   5.785  -5.976
  626    HG3  LYS  80           HG3      LYS  80  17.122   4.361  -6.734
  627    HD2  LYS  80           HD2      LYS  80  16.424   7.219  -7.530
  628    HD3  LYS  80           HD3      LYS  80  17.623   6.209  -8.334
  629    HE2  LYS  80           HE2      LYS  80  15.895   4.533  -8.878
  630    HE3  LYS  80           HE3      LYS  80  14.656   5.521  -8.066
  631    HZ1  LYS  80           HZ1      LYS  80  14.680   5.848 -10.457
  632    HZ2  LYS  80           HZ2      LYS  80  16.232   6.325 -10.440
  633    HZ3  LYS  80           HZ3      LYS  80  15.086   7.260  -9.713
  634    H    GLN  81           H        GLN  81  14.840   5.886  -2.463
  635    HA   GLN  81           HA       GLN  81  11.958   5.910  -2.610
  636    HB2  GLN  81           HB2      GLN  81  13.313   4.398  -1.171
  637    HB3  GLN  81           HB3      GLN  81  13.890   5.791  -0.257
  638    HG2  GLN  81           HG2      GLN  81  11.402   6.246   0.325
  639    HG3  GLN  81           HG3      GLN  81  11.078   4.643  -0.340
  640   HE21  GLN  81          1HE2      GLN  81  13.085   6.405   2.108
  641   HE22  GLN  81          2HE2      GLN  81  13.160   5.059   3.232
  642    H    SER  82           H        SER  82  14.287   8.052  -0.854
  643    HA   SER  82           HA       SER  82  12.430  10.339  -0.850
  644    HB2  SER  82           HB2      SER  82  12.035  10.294   1.577
  645    HB3  SER  82           HB3      SER  82  11.333   8.895   0.769
  646    HG   SER  82           HG       SER  82  12.507   8.453   2.767
  647    H    SER  83           H        SER  83  15.523   9.007   0.106
  648    HA   SER  83           HA       SER  83  17.503   9.901   0.738
  649    HB2  SER  83           HB2      SER  83  16.394  12.691   0.263
  650    HB3  SER  83           HB3      SER  83  18.077  12.230   0.484
  651    HG   SER  83           HG       SER  83  16.372  11.449  -1.675
  652    H    ASP  84           H        ASP  84  14.754  10.092   2.498
  653    HA   ASP  84           HA       ASP  84  15.452  11.795   4.685
  654    HB2  ASP  84           HB2      ASP  84  13.157  11.005   4.190
  655    HB3  ASP  84           HB3      ASP  84  13.628   9.367   4.650
  656    H    HIS  85           H        HIS  85  16.720  11.560   6.418
  657    HA   HIS  85           HA       HIS  85  18.479   9.195   6.594
  658    HB2  HIS  85           HB2      HIS  85  18.578  12.008   7.748
  659    HB3  HIS  85           HB3      HIS  85  19.683  10.732   8.230
  660    HD1  HIS  85           HD1      HIS  85  18.735  11.433   4.506
  661    HD2  HIS  85           HD2      HIS  85  21.905  11.668   7.279
  662    HE1  HIS  85           HE1      HIS  85  20.797  12.032   3.173
  Start of MODEL   19
    1    H2   PRO   1           H2       PRO   1   6.278  -4.923  -5.806
    2    H3   PRO   1           H3       PRO   1   5.900  -4.212  -4.367
    3    HA   PRO   1           HA       PRO   1   7.046  -2.244  -4.885
    4    HB2  PRO   1           HB2      PRO   1   8.096  -3.586  -7.391
    5    HB3  PRO   1           HB3      PRO   1   8.787  -2.206  -6.496
    6    HG2  PRO   1           HG2      PRO   1   9.435  -4.950  -6.099
    7    HG3  PRO   1           HG3      PRO   1   9.770  -3.644  -4.919
    8    HD2  PRO   1           HD2      PRO   1   7.989  -5.783  -4.487
    9    HD3  PRO   1           HD3      PRO   1   8.062  -4.277  -3.560
   10    H    GLY   2           H        GLY   2   6.719  -0.618  -6.653
   11    HA2  GLY   2           HA2      GLY   2   5.482   0.249  -8.507
   12    HA3  GLY   2           HA3      GLY   2   4.342  -1.112  -8.416
   13    H    SER   3           H        SER   3   5.253   0.391  -5.406
   14    HA   SER   3           HA       SER   3   2.550   1.709  -5.197
   15    HB2  SER   3           HB2      SER   3   3.034  -0.282  -3.725
   16    HB3  SER   3           HB3      SER   3   4.339   0.656  -2.986
   17    HG   SER   3           HG       SER   3   2.337   0.775  -1.817
   18    H    ALA   4           H        ALA   4   5.994   1.992  -4.245
   19    HA   ALA   4           HA       ALA   4   5.854   4.953  -4.408
   20    HB1  ALA   4           HB1      ALA   4   6.822   5.192  -2.134
   21    HB2  ALA   4           HB2      ALA   4   5.255   4.369  -2.063
   22    HB3  ALA   4           HB3      ALA   4   6.756   3.436  -1.916
   23    H    GLU   5           H        GLU   5   7.437   2.217  -5.276
   24    HA   GLU   5           HA       GLU   5  10.203   2.910  -4.871
   25    HB2  GLU   5           HB2      GLU   5   8.891   0.775  -6.615
   26    HB3  GLU   5           HB3      GLU   5  10.598   0.905  -6.242
   27    HG2  GLU   5           HG2      GLU   5   9.793  -0.756  -4.782
   28    HG3  GLU   5           HG3      GLU   5  10.041   0.671  -3.797
   29    H    ILE   6           H        ILE   6  11.771   3.241  -6.539
   30    HA   ILE   6           HA       ILE   6  10.851   4.880  -8.837
   31    HB   ILE   6           HB       ILE   6  13.652   4.333  -7.835
   32   HG12  ILE   6          2HG1      ILE   6  12.493   5.503  -6.062
   33   HG13  ILE   6          3HG1      ILE   6  13.650   6.555  -6.836
   34   HG21  ILE   6          1HG2      ILE   6  14.235   6.454  -9.088
   35   HG22  ILE   6          2HG2      ILE   6  13.857   5.071 -10.104
   36   HG23  ILE   6          3HG2      ILE   6  12.642   6.348  -9.866
   37   HD11  ILE   6          3HD1      ILE   6  11.809   7.684  -8.082
   38   HD12  ILE   6          1HD1      ILE   6  10.633   6.600  -7.306
   39   HD13  ILE   6          2HD1      ILE   6  11.554   7.757  -6.332
   40    H    ASP   7           H        ASP   7  11.682   4.474 -10.987
   41    HA   ASP   7           HA       ASP   7  11.905   1.644 -11.750
   42    HB2  ASP   7           HB2      ASP   7  10.652   3.246 -13.128
   43    HB3  ASP   7           HB3      ASP   7  12.096   4.229 -13.360
   44    H    TYR   8           H        TYR   8  13.758   1.013 -10.586
   45    HA   TYR   8           HA       TYR   8  16.235   2.438 -10.698
   46    HB2  TYR   8           HB2      TYR   8  15.734  -0.400  -9.742
   47    HB3  TYR   8           HB3      TYR   8  17.131   0.574  -9.421
   48    HD1  TYR   8           HD2      TYR   8  16.755   2.911  -8.243
   49    HD2  TYR   8           HD1      TYR   8  14.010  -0.406  -8.101
   50    HE1  TYR   8           HE2      TYR   8  15.805   3.797  -6.127
   51    HE2  TYR   8           HE1      TYR   8  13.031   0.485  -5.995
   52    HH   TYR   8           HH       TYR   8  14.251   3.500  -4.457
   53    H    SER   9           H        SER   9  15.156   1.203 -13.381
   54    HA   SER   9           HA       SER   9  17.289  -0.409 -14.448
   55    HB2  SER   9           HB2      SER   9  15.394   1.522 -15.835
   56    HB3  SER   9           HB3      SER   9  16.400   0.303 -16.643
   57    HG   SER   9           HG       SER   9  14.190  -0.375 -16.236
   58    H    ASP  10           H        ASP  10  17.380   2.828 -13.404
   59    HA   ASP  10           HA       ASP  10  19.577   3.772 -15.088
   60    HB2  ASP  10           HB2      ASP  10  17.837   5.217 -14.007
   61    HB3  ASP  10           HB3      ASP  10  18.480   4.763 -12.424
   62    H    ALA  11           H        ALA  11  19.445   1.482 -12.560
   63    HA   ALA  11           HA       ALA  11  21.734   2.091 -11.022
   64    HB1  ALA  11           HB1      ALA  11  21.567  -0.312 -10.323
   65    HB2  ALA  11           HB2      ALA  11  20.010   0.522 -10.307
   66    HB3  ALA  11           HB3      ALA  11  20.407  -0.590 -11.630
   67    HA   PRO  12           HA       PRO  12  25.190   0.809 -13.561
   68    HB2  PRO  12           HB2      PRO  12  27.072   0.160 -11.709
   69    HB3  PRO  12           HB3      PRO  12  26.508   1.843 -11.938
   70    HG2  PRO  12           HG2      PRO  12  25.531  -0.182  -9.885
   71    HG3  PRO  12           HG3      PRO  12  26.091   1.501  -9.598
   72    HD2  PRO  12           HD2      PRO  12  23.451   0.875  -9.852
   73    HD3  PRO  12           HD3      PRO  12  24.114   2.399 -10.535
   74    H    ASP  13           H        ASP  13  26.353  -1.048 -14.248
   75    HA   ASP  13           HA       ASP  13  24.849  -3.435 -14.313
   76    HB2  ASP  13           HB2      ASP  13  27.771  -2.934 -14.978
   77    HB3  ASP  13           HB3      ASP  13  26.876  -4.375 -15.438
   78    H    GLU  14           H        GLU  14  27.328  -2.513 -12.011
   79    HA   GLU  14           HA       GLU  14  27.910  -5.181 -11.037
   80    HB2  GLU  14           HB2      GLU  14  29.179  -4.094  -9.319
   81    HB3  GLU  14           HB3      GLU  14  29.494  -3.321 -10.863
   82    HG2  GLU  14           HG2      GLU  14  27.887  -1.479 -10.226
   83    HG3  GLU  14           HG3      GLU  14  27.736  -2.221  -8.630
   84    H    PHE  15           H        PHE  15  25.272  -3.005 -10.428
   85    HA   PHE  15           HA       PHE  15  24.385  -4.485  -7.992
   86    HB2  PHE  15           HB2      PHE  15  23.347  -1.990  -9.401
   87    HB3  PHE  15           HB3      PHE  15  22.584  -2.740  -8.001
   88    HD1  PHE  15           HD2      PHE  15  25.861  -3.164  -7.015
   89    HD2  PHE  15           HD1      PHE  15  22.992  -0.025  -7.768
   90    HE1  PHE  15           HE2      PHE  15  27.009  -1.721  -5.399
   91    HE2  PHE  15           HE1      PHE  15  24.181   1.426  -6.153
   92    HZ   PHE  15           HZ       PHE  15  26.198   0.586  -4.957
   93    H    ARG  16           H        ARG  16  24.205  -5.050 -11.250
   94    HA   ARG  16           HA       ARG  16  21.339  -5.896 -11.204
   95    HB2  ARG  16           HB2      ARG  16  23.083  -4.867 -13.471
   96    HB3  ARG  16           HB3      ARG  16  21.444  -5.505 -13.688
   97    HG2  ARG  16           HG2      ARG  16  20.467  -3.728 -12.388
   98    HG3  ARG  16           HG3      ARG  16  22.021  -3.189 -11.785
   99    HD2  ARG  16           HD2      ARG  16  21.403  -1.624 -13.359
  100    HD3  ARG  16           HD3      ARG  16  22.690  -2.560 -14.116
  101    HE   ARG  16           HE       ARG  16  20.402  -3.799 -15.031
  102   HH11  ARG  16          1HH1      ARG  16  21.473  -0.411 -15.044
  103   HH12  ARG  16          2HH1      ARG  16  20.295   0.029 -16.254
  104   HH21  ARG  16          1HH2      ARG  16  19.056  -3.175 -16.710
  105   HH22  ARG  16          2HH2      ARG  16  19.135  -1.547 -17.342
  106    H    ASP  17           H        ASP  17  20.730  -7.819 -12.045
  107    HA   ASP  17           HA       ASP  17  22.837  -9.877 -12.384
  108    HB2  ASP  17           HB2      ASP  17  21.080 -10.366 -10.815
  109    HB3  ASP  17           HB3      ASP  17  19.846 -10.103 -12.045
  110    HA   PRO  18           HA       PRO  18  22.605  -9.541 -16.797
  111    HB2  PRO  18           HB2      PRO  18  23.168 -12.467 -17.052
  112    HB3  PRO  18           HB3      PRO  18  24.079 -11.068 -17.688
  113    HG2  PRO  18           HG2      PRO  18  24.938 -12.532 -15.537
  114    HG3  PRO  18           HG3      PRO  18  25.222 -10.762 -15.679
  115    HD2  PRO  18           HD2      PRO  18  23.170 -12.222 -14.040
  116    HD3  PRO  18           HD3      PRO  18  24.133 -10.767 -13.654
  117    H    LEU  19           H        LEU  19  20.828 -12.331 -15.412
  118    HA   LEU  19           HA       LEU  19  19.145 -12.649 -17.829
  119    HB2  LEU  19           HB2      LEU  19  19.820 -14.647 -16.597
  120    HB3  LEU  19           HB3      LEU  19  19.140 -14.012 -15.100
  121    HG   LEU  19           HG       LEU  19  16.852 -14.174 -16.120
  122   HD11  LEU  19          1HD1      LEU  19  17.433 -14.010 -18.527
  123   HD12  LEU  19          2HD1      LEU  19  16.575 -15.523 -18.198
  124   HD13  LEU  19          3HD1      LEU  19  18.338 -15.538 -18.423
  125   HD21  LEU  19          3HD2      LEU  19  17.720 -15.962 -14.712
  126   HD22  LEU  19          1HD2      LEU  19  18.505 -16.736 -16.113
  127   HD23  LEU  19          2HD2      LEU  19  16.730 -16.641 -16.009
  128    H    MET  20           H        MET  20  18.830 -11.422 -14.481
  129    HA   MET  20           HA       MET  20  16.033 -10.787 -14.680
  130    HB2  MET  20           HB2      MET  20  17.751 -10.946 -12.622
  131    HB3  MET  20           HB3      MET  20  17.864  -9.197 -12.889
  132    HG2  MET  20           HG2      MET  20  15.273  -9.248 -12.863
  133    HG3  MET  20           HG3      MET  20  15.431 -10.880 -12.222
  134    HE1  MET  20           HE1      MET  20  17.069 -10.358  -8.749
  135    HE2  MET  20           HE2      MET  20  16.445 -11.499  -9.954
  136    HE3  MET  20           HE3      MET  20  17.972 -10.650 -10.254
  137    H    ASP  21           H        ASP  21  18.901  -9.042 -15.620
  138    HA   ASP  21           HA       ASP  21  19.325  -7.286 -16.933
  139    HB2  ASP  21           HB2      ASP  21  17.379  -8.159 -18.276
  140    HB3  ASP  21           HB3      ASP  21  16.353  -6.961 -17.471
  141    H    THR  22           H        THR  22  18.093  -7.079 -14.032
  142    HA   THR  22           HA       THR  22  18.244  -4.152 -13.727
  143    HB   THR  22           HB       THR  22  15.903  -4.738 -14.462
  144    HG1  THR  22           HG1      THR  22  15.087  -3.263 -13.015
  145   HG21  THR  22          1HG2      THR  22  15.641  -6.825 -13.087
  146   HG22  THR  22          2HG2      THR  22  14.344  -5.639 -12.864
  147   HG23  THR  22          3HG2      THR  22  15.602  -5.823 -11.621
  148    H    LEU  23           H        LEU  23  17.469  -3.704 -11.326
  149    HA   LEU  23           HA       LEU  23  19.752  -4.459  -9.860
  150    HB2  LEU  23           HB2      LEU  23  18.056  -2.376  -9.818
  151    HB3  LEU  23           HB3      LEU  23  17.359  -3.250  -8.463
  152    HG   LEU  23           HG       LEU  23  20.239  -2.306  -8.785
  153   HD11  LEU  23          1HD1      LEU  23  18.001  -1.316  -6.997
  154   HD12  LEU  23          2HD1      LEU  23  18.745  -0.489  -8.384
  155   HD13  LEU  23          3HD1      LEU  23  19.696  -0.771  -6.923
  156   HD21  LEU  23          3HD2      LEU  23  20.189  -4.372  -7.357
  157   HD22  LEU  23          1HD2      LEU  23  18.965  -3.599  -6.324
  158   HD23  LEU  23          2HD2      LEU  23  20.613  -2.952  -6.455
  159    H    MET  24           H        MET  24  20.196  -6.276  -8.776
  160    HA   MET  24           HA       MET  24  18.191  -8.308  -8.399
  161    HB2  MET  24           HB2      MET  24  20.072  -9.629  -7.417
  162    HB3  MET  24           HB3      MET  24  20.345  -8.989  -9.044
  163    HG2  MET  24           HG2      MET  24  21.712  -7.159  -8.019
  164    HG3  MET  24           HG3      MET  24  21.542  -7.948  -6.447
  165    HE1  MET  24           HE1      MET  24  24.242  -7.245  -7.182
  166    HE2  MET  24           HE2      MET  24  25.235  -8.323  -8.184
  167    HE3  MET  24           HE3      MET  24  24.054  -7.253  -8.948
  168    H    THR  25           H        THR  25  19.644  -6.099  -6.089
  169    HA   THR  25           HA       THR  25  19.313  -5.573  -3.937
  170    HB   THR  25           HB       THR  25  17.226  -5.775  -2.840
  171    HG1  THR  25           HG1      THR  25  16.723  -7.748  -4.773
  172   HG21  THR  25          1HG2      THR  25  16.725  -5.268  -5.807
  173   HG22  THR  25          2HG2      THR  25  17.386  -4.102  -4.630
  174   HG23  THR  25          3HG2      THR  25  15.738  -4.711  -4.439
  175    H    ASP  26           H        ASP  26  19.181  -8.974  -4.581
  176    HA   ASP  26           HA       ASP  26  20.546  -9.454  -1.957
  177    HB2  ASP  26           HB2      ASP  26  18.251 -10.919  -3.217
  178    HB3  ASP  26           HB3      ASP  26  19.509 -11.869  -2.428
  179    HA   PRO  27           HA       PRO  27  23.379 -10.611  -5.388
  180    HB2  PRO  27           HB2      PRO  27  25.639  -9.405  -4.426
  181    HB3  PRO  27           HB3      PRO  27  24.385  -8.533  -5.341
  182    HG2  PRO  27           HG2      PRO  27  24.724  -8.666  -2.335
  183    HG3  PRO  27           HG3      PRO  27  24.466  -7.219  -3.363
  184    HD2  PRO  27           HD2      PRO  27  22.424  -8.451  -2.060
  185    HD3  PRO  27           HD3      PRO  27  22.195  -7.757  -3.697
  186    H    VAL  28           H        VAL  28  24.406 -12.485  -5.405
  187    HA   VAL  28           HA       VAL  28  25.772 -13.554  -2.967
  188    HB   VAL  28           HB       VAL  28  24.249 -15.130  -5.083
  189   HG11  VAL  28          1HG1      VAL  28  26.277 -16.385  -4.459
  190   HG12  VAL  28          2HG1      VAL  28  25.848 -16.215  -2.734
  191   HG13  VAL  28          3HG1      VAL  28  24.814 -17.146  -3.834
  192   HG21  VAL  28          3HG2      VAL  28  23.827 -14.817  -2.069
  193   HG22  VAL  28          1HG2      VAL  28  22.804 -14.112  -3.326
  194   HG23  VAL  28          2HG2      VAL  28  22.885 -15.873  -3.132
  195    H    ARG  29           H        ARG  29  27.766 -14.004  -3.167
  196    HA   ARG  29           HA       ARG  29  29.272 -13.467  -5.634
  197    HB2  ARG  29           HB2      ARG  29  29.790 -12.365  -3.513
  198    HB3  ARG  29           HB3      ARG  29  30.043 -13.924  -2.721
  199    HG2  ARG  29           HG2      ARG  29  32.001 -14.351  -4.125
  200    HG3  ARG  29           HG3      ARG  29  31.715 -12.826  -5.009
  201    HD2  ARG  29           HD2      ARG  29  32.033 -11.531  -2.949
  202    HD3  ARG  29           HD3      ARG  29  32.140 -12.992  -1.988
  203    HE   ARG  29           HE       ARG  29  34.140 -12.071  -4.025
  204   HH11  ARG  29          1HH1      ARG  29  33.549 -13.988  -1.057
  205   HH12  ARG  29          2HH1      ARG  29  35.232 -14.434  -0.958
  206   HH21  ARG  29          1HH2      ARG  29  36.268 -12.698  -3.766
  207   HH22  ARG  29          2HH2      ARG  29  36.724 -13.702  -2.425
  208    H    LEU  30           H        LEU  30  30.348 -14.893  -6.735
  209    HA   LEU  30           HA       LEU  30  30.079 -17.814  -6.256
  210    HB2  LEU  30           HB2      LEU  30  30.744 -16.009  -8.619
  211    HB3  LEU  30           HB3      LEU  30  31.052 -17.702  -8.723
  212    HG   LEU  30           HG       LEU  30  28.936 -16.913  -9.780
  213   HD11  LEU  30          1HD1      LEU  30  28.679 -19.089  -7.677
  214   HD12  LEU  30          2HD1      LEU  30  29.300 -19.245  -9.339
  215   HD13  LEU  30          3HD1      LEU  30  27.598 -18.865  -9.069
  216   HD21  LEU  30          3HD2      LEU  30  26.904 -16.586  -8.481
  217   HD22  LEU  30          1HD2      LEU  30  28.101 -15.363  -8.019
  218   HD23  LEU  30          2HD2      LEU  30  27.786 -16.766  -6.964
  219    HA   PRO  31           HA       PRO  31  34.376 -18.422  -5.280
  220    HB2  PRO  31           HB2      PRO  31  35.146 -20.631  -6.736
  221    HB3  PRO  31           HB3      PRO  31  34.048 -20.695  -5.322
  222    HG2  PRO  31           HG2      PRO  31  33.294 -20.570  -8.269
  223    HG3  PRO  31           HG3      PRO  31  32.715 -21.731  -7.036
  224    HD2  PRO  31           HD2      PRO  31  31.262 -19.558  -7.666
  225    HD3  PRO  31           HD3      PRO  31  31.406 -20.041  -5.952
  226    H    SER  32           H        SER  32  33.576 -18.106  -8.738
  227    HA   SER  32           HA       SER  32  36.220 -17.368  -9.637
  228    HB2  SER  32           HB2      SER  32  33.509 -16.683 -10.836
  229    HB3  SER  32           HB3      SER  32  35.063 -16.713 -11.679
  230    HG   SER  32           HG       SER  32  35.140 -18.977 -11.341
  231    H    GLY  33           H        GLY  33  34.183 -15.657  -7.577
  232    HA2  GLY  33           HA2      GLY  33  34.438 -13.502  -6.708
  233    HA3  GLY  33           HA3      GLY  33  35.490 -13.049  -8.079
  234    H    THR  34           H        THR  34  33.044 -14.343  -9.669
  235    HA   THR  34           HA       THR  34  31.687 -11.964 -10.442
  236    HB   THR  34           HB       THR  34  30.575 -14.776 -10.793
  237    HG1  THR  34           HG1      THR  34  31.964 -14.902 -12.606
  238   HG21  THR  34          1HG2      THR  34  30.626 -12.313 -12.613
  239   HG22  THR  34          2HG2      THR  34  29.214 -12.931 -11.744
  240   HG23  THR  34          3HG2      THR  34  29.938 -13.895 -13.030
  241    H    VAL  35           H        VAL  35  29.487 -11.316 -10.051
  242    HA   VAL  35           HA       VAL  35  28.184 -12.517  -7.640
  243    HB   VAL  35           HB       VAL  35  28.311  -9.554  -8.287
  244   HG11  VAL  35          1HG1      VAL  35  27.071 -10.983  -5.889
  245   HG12  VAL  35          2HG1      VAL  35  27.165  -9.231  -6.150
  246   HG13  VAL  35          3HG1      VAL  35  26.152 -10.215  -7.200
  247   HG21  VAL  35          3HG2      VAL  35  29.606 -11.130  -6.005
  248   HG22  VAL  35          1HG2      VAL  35  30.464 -10.346  -7.345
  249   HG23  VAL  35          2HG2      VAL  35  29.595  -9.365  -6.164
  250    H    MET  36           H        MET  36  26.141 -13.036  -7.860
  251    HA   MET  36           HA       MET  36  24.415 -11.931 -10.018
  252    HB2  MET  36           HB2      MET  36  24.880 -14.911  -9.475
  253    HB3  MET  36           HB3      MET  36  23.596 -14.261 -10.482
  254    HG2  MET  36           HG2      MET  36  25.007 -14.524 -12.193
  255    HG3  MET  36           HG3      MET  36  25.712 -13.025 -11.652
  256    HE1  MET  36           HE1      MET  36  25.860 -16.890 -10.658
  257    HE2  MET  36           HE2      MET  36  26.093 -16.712 -12.408
  258    HE3  MET  36           HE3      MET  36  27.417 -17.291 -11.404
  259    H    ASP  37           H        ASP  37  22.090 -12.769  -9.697
  260    HA   ASP  37           HA       ASP  37  21.211 -11.990  -7.052
  261    HB2  ASP  37           HB2      ASP  37  19.872 -11.410  -8.985
  262    HB3  ASP  37           HB3      ASP  37  19.793 -13.100  -9.488
  263    H    ARG  38           H        ARG  38  20.590 -13.127  -5.352
  264    HA   ARG  38           HA       ARG  38  21.236 -15.720  -4.710
  265    HB2  ARG  38           HB2      ARG  38  20.510 -13.877  -3.175
  266    HB3  ARG  38           HB3      ARG  38  18.841 -14.120  -3.682
  267    HG2  ARG  38           HG2      ARG  38  19.101 -16.551  -2.856
  268    HG3  ARG  38           HG3      ARG  38  20.627 -16.042  -2.134
  269    HD2  ARG  38           HD2      ARG  38  17.861 -14.904  -1.557
  270    HD3  ARG  38           HD3      ARG  38  18.729 -16.028  -0.526
  271    HE   ARG  38           HE       ARG  38  19.116 -13.139  -0.753
  272   HH11  ARG  38          1HH1      ARG  38  20.702 -16.099   0.373
  273   HH12  ARG  38          2HH1      ARG  38  21.672 -15.225   1.524
  274   HH21  ARG  38          1HH2      ARG  38  20.371 -12.105   0.647
  275   HH22  ARG  38          2HH2      ARG  38  21.542 -12.960   1.641
  276    H    SER  39           H        SER  39  17.966 -14.705  -5.888
  277    HA   SER  39           HA       SER  39  16.894 -17.382  -5.645
  278    HB2  SER  39           HB2      SER  39  15.813 -14.997  -7.189
  279    HB3  SER  39           HB3      SER  39  14.930 -16.472  -6.790
  280    HG   SER  39           HG       SER  39  14.511 -14.773  -5.278
  281    H    ILE  40           H        ILE  40  18.200 -15.502  -8.413
  282    HA   ILE  40           HA       ILE  40  17.596 -17.550 -10.368
  283    HB   ILE  40           HB       ILE  40  19.593 -15.262 -10.439
  284   HG12  ILE  40          2HG1      ILE  40  16.817 -15.646 -11.710
  285   HG13  ILE  40          3HG1      ILE  40  17.071 -14.753 -10.230
  286   HG21  ILE  40          1HG2      ILE  40  18.647 -17.038 -12.720
  287   HG22  ILE  40          2HG2      ILE  40  19.631 -15.571 -12.889
  288   HG23  ILE  40          3HG2      ILE  40  20.295 -16.967 -12.053
  289   HD11  ILE  40          3HD1      ILE  40  18.487 -13.115 -11.450
  290   HD12  ILE  40          1HD1      ILE  40  18.067 -13.948 -12.970
  291   HD13  ILE  40          2HD1      ILE  40  16.803 -13.195 -12.003
  292    H    ILE  41           H        ILE  41  20.610 -16.991  -8.463
  293    HA   ILE  41           HA       ILE  41  21.965 -19.198  -9.727
  294    HB   ILE  41           HB       ILE  41  23.171 -17.413  -8.567
  295   HG12  ILE  41          2HG1      ILE  41  24.911 -18.735  -7.501
  296   HG13  ILE  41          3HG1      ILE  41  23.836 -20.132  -7.365
  297   HG21  ILE  41          1HG2      ILE  41  21.794 -17.173  -6.524
  298   HG22  ILE  41          2HG2      ILE  41  22.360 -18.735  -5.935
  299   HG23  ILE  41          3HG2      ILE  41  23.498 -17.397  -6.141
  300   HD11  ILE  41          3HD1      ILE  41  23.836 -20.396  -9.798
  301   HD12  ILE  41          1HD1      ILE  41  24.771 -18.879  -9.986
  302   HD13  ILE  41          2HD1      ILE  41  25.490 -20.303  -9.222
  303    H    LEU  42           H        LEU  42  20.062 -19.163  -6.646
  304    HA   LEU  42           HA       LEU  42  20.467 -21.982  -6.283
  305    HB2  LEU  42           HB2      LEU  42  19.074 -21.880  -4.442
  306    HB3  LEU  42           HB3      LEU  42  19.922 -20.360  -4.504
  307    HG   LEU  42           HG       LEU  42  17.737 -19.423  -5.592
  308   HD11  LEU  42          1HD1      LEU  42  15.672 -20.524  -4.762
  309   HD12  LEU  42          2HD1      LEU  42  16.626 -21.893  -4.158
  310   HD13  LEU  42          3HD1      LEU  42  16.492 -21.584  -5.899
  311   HD21  LEU  42          3HD2      LEU  42  16.847 -18.949  -3.340
  312   HD22  LEU  42          1HD2      LEU  42  18.609 -18.836  -3.339
  313   HD23  LEU  42          2HD2      LEU  42  17.828 -20.270  -2.659
  314    H    ARG  43           H        ARG  43  17.915 -20.212  -8.065
  315    HA   ARG  43           HA       ARG  43  16.316 -22.529  -8.578
  316    HB2  ARG  43           HB2      ARG  43  15.510 -20.242  -8.792
  317    HB3  ARG  43           HB3      ARG  43  16.568 -19.937 -10.167
  318    HG2  ARG  43           HG2      ARG  43  14.566 -22.221 -10.222
  319    HG3  ARG  43           HG3      ARG  43  14.013 -20.565 -10.453
  320    HD2  ARG  43           HD2      ARG  43  15.348 -20.236 -12.403
  321    HD3  ARG  43           HD3      ARG  43  16.198 -21.762 -12.207
  322    HE   ARG  43           HE       ARG  43  13.590 -21.331 -13.373
  323   HH11  ARG  43          1HH1      ARG  43  15.545 -23.838 -11.763
  324   HH12  ARG  43          2HH1      ARG  43  14.591 -25.119 -12.465
  325   HH21  ARG  43          1HH2      ARG  43  12.453 -23.044 -14.239
  326   HH22  ARG  43          2HH2      ARG  43  12.891 -24.680 -13.846
  327    H    HIS  44           H        HIS  44  19.184 -21.198 -10.298
  328    HA   HIS  44           HA       HIS  44  18.998 -23.176 -12.420
  329    HB2  HIS  44           HB2      HIS  44  20.327 -20.931 -12.368
  330    HB3  HIS  44           HB3      HIS  44  21.597 -21.873 -11.581
  331    HD1  HIS  44           HD1      HIS  44  20.005 -21.228 -14.949
  332    HD2  HIS  44           HD2      HIS  44  22.500 -24.096 -13.144
  333    HE1  HIS  44           HE1      HIS  44  21.013 -22.588 -16.843
  334    H    LEU  45           H        LEU  45  20.860 -23.095  -9.319
  335    HA   LEU  45           HA       LEU  45  22.129 -25.607  -9.588
  336    HB2  LEU  45           HB2      LEU  45  21.502 -23.747  -7.348
  337    HB3  LEU  45           HB3      LEU  45  21.731 -25.424  -6.893
  338    HG   LEU  45           HG       LEU  45  23.911 -25.483  -8.077
  339   HD11  LEU  45          1HD1      LEU  45  23.563 -23.603  -9.694
  340   HD12  LEU  45          2HD1      LEU  45  25.047 -23.411  -8.751
  341   HD13  LEU  45          3HD1      LEU  45  23.604 -22.459  -8.339
  342   HD21  LEU  45          3HD2      LEU  45  23.808 -25.091  -5.677
  343   HD22  LEU  45          1HD2      LEU  45  23.596 -23.350  -5.935
  344   HD23  LEU  45          2HD2      LEU  45  25.130 -24.133  -6.369
  345    H    LEU  46           H        LEU  46  18.840 -24.942  -8.436
  346    HA   LEU  46           HA       LEU  46  18.170 -27.661  -7.741
  347    HB2  LEU  46           HB2      LEU  46  16.541 -25.212  -8.525
  348    HB3  LEU  46           HB3      LEU  46  15.779 -26.741  -8.099
  349    HG   LEU  46           HG       LEU  46  17.663 -25.270  -6.212
  350   HD11  LEU  46          1HD1      LEU  46  15.617 -24.483  -5.058
  351   HD12  LEU  46          2HD1      LEU  46  14.609 -25.225  -6.318
  352   HD13  LEU  46          3HD1      LEU  46  15.688 -23.875  -6.726
  353   HD21  LEU  46          3HD2      LEU  46  16.578 -26.695  -4.485
  354   HD22  LEU  46          1HD2      LEU  46  17.427 -27.663  -5.691
  355   HD23  LEU  46          2HD2      LEU  46  15.650 -27.528  -5.749
  356    H    ASN  47           H        ASN  47  18.428 -26.154 -10.897
  357    HA   ASN  47           HA       ASN  47  17.024 -28.389 -12.235
  358    HB2  ASN  47           HB2      ASN  47  16.915 -25.961 -13.013
  359    HB3  ASN  47           HB3      ASN  47  18.604 -26.108 -13.494
  360   HD21  ASN  47          1HD2      ASN  47  19.097 -28.032 -15.091
  361   HD22  ASN  47          2HD2      ASN  47  17.838 -28.345 -16.267
  362    H    SER  48           H        SER  48  20.338 -26.980 -12.098
  363    HA   SER  48           HA       SER  48  21.615 -29.634 -12.493
  364    HB2  SER  48           HB2      SER  48  22.130 -27.246 -14.311
  365    HB3  SER  48           HB3      SER  48  22.985 -28.788 -14.347
  366    HG   SER  48           HG       SER  48  21.391 -28.704 -15.974
  367    HA   PRO  49           HA       PRO  49  24.334 -27.463  -9.647
  368    HB2  PRO  49           HB2      PRO  49  26.324 -29.260  -9.280
  369    HB3  PRO  49           HB3      PRO  49  24.640 -29.607  -8.803
  370    HG2  PRO  49           HG2      PRO  49  26.015 -30.416 -11.404
  371    HG3  PRO  49           HG3      PRO  49  25.142 -31.468 -10.243
  372    HD2  PRO  49           HD2      PRO  49  23.922 -30.406 -12.452
  373    HD3  PRO  49           HD3      PRO  49  23.040 -30.614 -10.903
  374    H    THR  50           H        THR  50  24.455 -26.010 -11.721
  375    HA   THR  50           HA       THR  50  27.295 -25.554 -12.411
  376    HB   THR  50           HB       THR  50  26.489 -25.046 -14.790
  377    HG1  THR  50           HG1      THR  50  24.670 -26.156 -15.453
  378   HG21  THR  50          1HG2      THR  50  26.833 -27.294 -15.572
  379   HG22  THR  50          2HG2      THR  50  26.471 -27.974 -13.964
  380   HG23  THR  50          3HG2      THR  50  27.926 -26.985 -14.232
  381    H    ASP  51           H        ASP  51  27.791 -23.561 -13.200
  382    HA   ASP  51           HA       ASP  51  26.455 -21.288 -12.061
  383    HB2  ASP  51           HB2      ASP  51  28.866 -21.550 -12.417
  384    HB3  ASP  51           HB3      ASP  51  28.631 -21.580 -14.162
  385    HA   PRO  52           HA       PRO  52  23.335 -20.949 -15.209
  386    HB2  PRO  52           HB2      PRO  52  22.433 -18.336 -14.836
  387    HB3  PRO  52           HB3      PRO  52  22.025 -19.712 -13.773
  388    HG2  PRO  52           HG2      PRO  52  24.198 -17.649 -13.390
  389    HG3  PRO  52           HG3      PRO  52  23.009 -18.239 -12.185
  390    HD2  PRO  52           HD2      PRO  52  25.540 -19.235 -12.275
  391    HD3  PRO  52           HD3      PRO  52  24.153 -20.338 -12.006
  392    H    PHE  53           H        PHE  53  26.089 -18.771 -15.332
  393    HA   PHE  53           HA       PHE  53  25.420 -18.028 -18.172
  394    HB2  PHE  53           HB2      PHE  53  27.014 -16.477 -16.102
  395    HB3  PHE  53           HB3      PHE  53  26.646 -15.963 -17.748
  396    HD1  PHE  53           HD1      PHE  53  24.031 -15.988 -18.374
  397    HD2  PHE  53           HD2      PHE  53  25.625 -15.665 -14.382
  398    HE1  PHE  53           HE1      PHE  53  21.875 -15.060 -17.597
  399    HE2  PHE  53           HE2      PHE  53  23.435 -14.759 -13.597
  400    HZ   PHE  53           HZ       PHE  53  21.583 -14.445 -15.184
  401    H    ASN  54           H        ASN  54  28.029 -19.117 -15.970
  402    HA   ASN  54           HA       ASN  54  29.942 -19.237 -18.245
  403    HB2  ASN  54           HB2      ASN  54  30.574 -18.216 -16.069
  404    HB3  ASN  54           HB3      ASN  54  30.317 -19.772 -15.276
  405   HD21  ASN  54          1HD2      ASN  54  32.287 -18.137 -17.818
  406   HD22  ASN  54          2HD2      ASN  54  33.652 -19.226 -17.648
  407    H    ARG  55           H        ARG  55  27.986 -21.401 -16.284
  408    HA   ARG  55           HA       ARG  55  27.499 -23.535 -16.323
  409    HB2  ARG  55           HB2      ARG  55  28.469 -23.338 -19.195
  410    HB3  ARG  55           HB3      ARG  55  27.768 -24.805 -18.524
  411    HG2  ARG  55           HG2      ARG  55  26.012 -23.737 -19.607
  412    HG3  ARG  55           HG3      ARG  55  25.714 -23.558 -17.887
  413    HD2  ARG  55           HD2      ARG  55  26.505 -21.210 -17.982
  414    HD3  ARG  55           HD3      ARG  55  26.859 -21.373 -19.706
  415    HE   ARG  55           HE       ARG  55  24.312 -20.890 -18.395
  416   HH11  ARG  55          1HH1      ARG  55  25.630 -22.263 -21.386
  417   HH12  ARG  55          2HH1      ARG  55  24.167 -21.922 -22.267
  418   HH21  ARG  55          1HH2      ARG  55  22.522 -20.479 -19.571
  419   HH22  ARG  55          2HH2      ARG  55  22.419 -20.928 -21.253
  420    H    GLN  56           H        GLN  56  30.339 -22.741 -15.587
  421    HA   GLN  56           HA       GLN  56  31.808 -25.234 -15.388
  422    HB2  GLN  56           HB2      GLN  56  32.940 -24.114 -13.515
  423    HB3  GLN  56           HB3      GLN  56  32.878 -23.080 -14.939
  424    HG2  GLN  56           HG2      GLN  56  30.946 -21.843 -13.938
  425    HG3  GLN  56           HG3      GLN  56  31.040 -22.847 -12.495
  426   HE21  GLN  56          1HE2      GLN  56  31.189 -19.994 -12.394
  427   HE22  GLN  56          2HE2      GLN  56  32.832 -19.608 -11.870
  428    H    MET  57           H        MET  57  31.908 -26.611 -13.522
  429    HA   MET  57           HA       MET  57  29.474 -27.427 -12.283
  430    HB2  MET  57           HB2      MET  57  31.480 -28.854 -12.576
  431    HB3  MET  57           HB3      MET  57  32.366 -27.846 -11.422
  432    HG2  MET  57           HG2      MET  57  31.638 -29.833 -10.293
  433    HG3  MET  57           HG3      MET  57  30.729 -28.478  -9.643
  434    HE1  MET  57           HE1      MET  57  28.115 -31.271  -9.225
  435    HE2  MET  57           HE2      MET  57  29.856 -31.270  -8.888
  436    HE3  MET  57           HE3      MET  57  28.868 -29.840  -8.504
  437    H    LEU  58           H        LEU  58  28.452 -26.797 -10.451
  438    HA   LEU  58           HA       LEU  58  29.714 -24.927  -8.557
  439    HB2  LEU  58           HB2      LEU  58  28.601 -23.812 -10.745
  440    HB3  LEU  58           HB3      LEU  58  27.123 -24.030  -9.838
  441    HG   LEU  58           HG       LEU  58  27.906 -21.812  -9.531
  442   HD11  LEU  58          1HD1      LEU  58  27.017 -22.846  -7.454
  443   HD12  LEU  58          2HD1      LEU  58  28.222 -21.584  -7.133
  444   HD13  LEU  58          3HD1      LEU  58  28.675 -23.287  -6.986
  445   HD21  LEU  58          3HD2      LEU  58  30.607 -22.931  -8.661
  446   HD22  LEU  58          1HD2      LEU  58  30.131 -21.234  -8.629
  447   HD23  LEU  58          2HD2      LEU  58  30.245 -22.080 -10.178
  448    H    THR  59           H        THR  59  29.286 -25.691  -6.655
  449    HA   THR  59           HA       THR  59  26.699 -27.056  -6.037
  450    HB   THR  59           HB       THR  59  29.331 -27.159  -4.499
  451    HG1  THR  59           HG1      THR  59  29.540 -29.192  -5.517
  452   HG21  THR  59          1HG2      THR  59  26.818 -28.896  -4.414
  453   HG22  THR  59          2HG2      THR  59  27.428 -27.845  -3.116
  454   HG23  THR  59          3HG2      THR  59  28.342 -29.274  -3.583
  455    H    GLU  60           H        GLU  60  25.602 -26.484  -4.099
  456    HA   GLU  60           HA       GLU  60  25.362 -23.727  -3.588
  457    HB2  GLU  60           HB2      GLU  60  23.855 -24.340  -1.783
  458    HB3  GLU  60           HB3      GLU  60  23.563 -25.329  -3.215
  459    HG2  GLU  60           HG2      GLU  60  24.830 -27.209  -2.156
  460    HG3  GLU  60           HG3      GLU  60  25.096 -26.209  -0.730
  461    H    SER  61           H        SER  61  27.622 -25.944  -2.085
  462    HA   SER  61           HA       SER  61  28.247 -24.385   0.271
  463    HB2  SER  61           HB2      SER  61  30.240 -25.897   0.312
  464    HB3  SER  61           HB3      SER  61  28.683 -26.732   0.224
  465    HG   SER  61           HG       SER  61  30.274 -27.589  -1.243
  466    H    MET  62           H        MET  62  29.085 -23.969  -3.082
  467    HA   MET  62           HA       MET  62  31.570 -22.474  -2.586
  468    HB2  MET  62           HB2      MET  62  29.948 -22.775  -5.134
  469    HB3  MET  62           HB3      MET  62  31.610 -22.203  -4.991
  470    HG2  MET  62           HG2      MET  62  32.339 -24.417  -4.198
  471    HG3  MET  62           HG3      MET  62  30.683 -25.031  -4.306
  472    HE1  MET  62           HE1      MET  62  31.396 -27.066  -5.781
  473    HE2  MET  62           HE2      MET  62  32.422 -26.922  -7.219
  474    HE3  MET  62           HE3      MET  62  33.086 -26.526  -5.626
  475    H    LEU  63           H        LEU  63  28.258 -21.702  -2.477
  476    HA   LEU  63           HA       LEU  63  28.399 -18.940  -3.518
  477    HB2  LEU  63           HB2      LEU  63  26.183 -20.473  -2.104
  478    HB3  LEU  63           HB3      LEU  63  26.023 -18.918  -2.898
  479    HG   LEU  63           HG       LEU  63  26.624 -21.568  -4.259
  480   HD11  LEU  63          1HD1      LEU  63  24.407 -21.229  -5.271
  481   HD12  LEU  63          2HD1      LEU  63  24.200 -19.725  -4.358
  482   HD13  LEU  63          3HD1      LEU  63  24.288 -21.279  -3.505
  483   HD21  LEU  63          3HD2      LEU  63  26.342 -18.784  -5.470
  484   HD22  LEU  63          1HD2      LEU  63  26.384 -20.297  -6.390
  485   HD23  LEU  63          2HD2      LEU  63  27.809 -19.794  -5.487
  486    H    GLU  64           H        GLU  64  28.079 -17.081  -2.358
  487    HA   GLU  64           HA       GLU  64  28.025 -17.122   0.611
  488    HB2  GLU  64           HB2      GLU  64  30.393 -17.216   0.040
  489    HB3  GLU  64           HB3      GLU  64  30.205 -15.862  -1.081
  490    HG2  GLU  64           HG2      GLU  64  29.678 -14.360   0.819
  491    HG3  GLU  64           HG3      GLU  64  29.797 -15.724   1.939
  492    HA   PRO  65           HA       PRO  65  25.445 -13.608  -0.818
  493    HB2  PRO  65           HB2      PRO  65  24.288 -12.907   1.555
  494    HB3  PRO  65           HB3      PRO  65  23.760 -14.313   0.578
  495    HG2  PRO  65           HG2      PRO  65  25.603 -14.309   2.988
  496    HG3  PRO  65           HG3      PRO  65  24.231 -15.403   2.640
  497    HD2  PRO  65           HD2      PRO  65  26.825 -16.083   2.111
  498    HD3  PRO  65           HD3      PRO  65  25.473 -16.641   1.083
  499    H    VAL  66           H        VAL  66  26.155 -11.524  -1.044
  500    HA   VAL  66           HA       VAL  66  28.509 -10.780   0.622
  501    HB   VAL  66           HB       VAL  66  29.214 -11.129  -1.518
  502   HG11  VAL  66          1HG1      VAL  66  28.459 -10.030  -3.544
  503   HG12  VAL  66          2HG1      VAL  66  27.180 -11.017  -2.845
  504   HG13  VAL  66          3HG1      VAL  66  27.138  -9.237  -2.664
  505   HG21  VAL  66          3HG2      VAL  66  29.029  -8.107  -1.212
  506   HG22  VAL  66          1HG2      VAL  66  30.171  -9.167  -0.369
  507   HG23  VAL  66          2HG2      VAL  66  30.243  -9.023  -2.127
  508    HA   PRO  67           HA       PRO  67  25.572  -7.724   2.151
  509    HB2  PRO  67           HB2      PRO  67  26.785  -7.073   4.501
  510    HB3  PRO  67           HB3      PRO  67  26.001  -8.664   4.240
  511    HG2  PRO  67           HG2      PRO  67  28.939  -7.962   3.956
  512    HG3  PRO  67           HG3      PRO  67  28.216  -9.316   4.872
  513    HD2  PRO  67           HD2      PRO  67  29.166  -9.668   2.341
  514    HD3  PRO  67           HD3      PRO  67  27.689 -10.494   2.903
  515    H    GLU  68           H        GLU  68  29.075  -6.987   1.808
  516    HA   GLU  68           HA       GLU  68  28.790  -4.183   2.147
  517    HB2  GLU  68           HB2      GLU  68  30.959  -3.969   1.104
  518    HB3  GLU  68           HB3      GLU  68  30.934  -5.278   2.287
  519    HG2  GLU  68           HG2      GLU  68  30.778  -6.945   0.455
  520    HG3  GLU  68           HG3      GLU  68  30.775  -5.638  -0.746
  521    H    LEU  69           H        LEU  69  27.999  -6.158  -0.644
  522    HA   LEU  69           HA       LEU  69  27.520  -3.779  -2.355
  523    HB2  LEU  69           HB2      LEU  69  26.951  -6.745  -2.748
  524    HB3  LEU  69           HB3      LEU  69  26.559  -5.482  -3.914
  525    HG   LEU  69           HG       LEU  69  29.369  -6.208  -2.983
  526   HD11  LEU  69          1HD1      LEU  69  27.953  -6.627  -5.658
  527   HD12  LEU  69          2HD1      LEU  69  28.297  -7.892  -4.469
  528   HD13  LEU  69          3HD1      LEU  69  29.631  -7.051  -5.277
  529   HD21  LEU  69          3HD2      LEU  69  30.114  -4.708  -4.843
  530   HD22  LEU  69          1HD2      LEU  69  29.348  -3.827  -3.531
  531   HD23  LEU  69          2HD2      LEU  69  28.436  -4.140  -5.034
  532    H    LYS  70           H        LYS  70  25.520  -6.187  -0.533
  533    HA   LYS  70           HA       LYS  70  23.026  -5.072  -1.319
  534    HB2  LYS  70           HB2      LYS  70  23.382  -7.295  -0.269
  535    HB3  LYS  70           HB3      LYS  70  23.718  -6.512   1.280
  536    HG2  LYS  70           HG2      LYS  70  21.473  -5.586   1.395
  537    HG3  LYS  70           HG3      LYS  70  21.128  -6.078  -0.271
  538    HD2  LYS  70           HD2      LYS  70  21.264  -8.464   0.398
  539    HD3  LYS  70           HD3      LYS  70  21.612  -7.969   2.069
  540    HE2  LYS  70           HE2      LYS  70  19.446  -6.761   2.165
  541    HE3  LYS  70           HE3      LYS  70  19.111  -7.212   0.478
  542    HZ1  LYS  70           HZ1      LYS  70  19.090  -9.528   1.159
  543    HZ2  LYS  70           HZ2      LYS  70  18.000  -8.689   2.047
  544    HZ3  LYS  70           HZ3      LYS  70  19.422  -9.132   2.721
  545    H    GLU  71           H        GLU  71  25.125  -4.174   1.396
  546    HA   GLU  71           HA       GLU  71  23.389  -2.206   2.562
  547    HB2  GLU  71           HB2      GLU  71  25.293  -3.343   3.679
  548    HB3  GLU  71           HB3      GLU  71  26.430  -2.408   2.692
  549    HG2  GLU  71           HG2      GLU  71  25.606  -0.324   3.702
  550    HG3  GLU  71           HG3      GLU  71  24.348  -1.199   4.570
  551    H    GLN  72           H        GLN  72  25.814  -2.024  -0.047
  552    HA   GLN  72           HA       GLN  72  25.617   0.902  -0.321
  553    HB2  GLN  72           HB2      GLN  72  26.868  -1.282  -2.023
  554    HB3  GLN  72           HB3      GLN  72  26.820   0.405  -2.540
  555    HG2  GLN  72           HG2      GLN  72  28.075  -0.510   0.085
  556    HG3  GLN  72           HG3      GLN  72  28.962  -0.285  -1.427
  557   HE21  GLN  72          1HE2      GLN  72  29.951   1.123   0.636
  558   HE22  GLN  72          2HE2      GLN  72  29.506   2.810   0.488
  559    H    ILE  73           H        ILE  73  24.141  -1.910  -1.961
  560    HA   ILE  73           HA       ILE  73  22.612  -0.511  -3.913
  561    HB   ILE  73           HB       ILE  73  22.293  -3.162  -2.470
  562   HG12  ILE  73          2HG1      ILE  73  22.703  -2.489  -5.404
  563   HG13  ILE  73          3HG1      ILE  73  24.023  -2.759  -4.287
  564   HG21  ILE  73          1HG2      ILE  73  20.408  -3.683  -4.069
  565   HG22  ILE  73          2HG2      ILE  73  19.991  -2.559  -2.801
  566   HG23  ILE  73          3HG2      ILE  73  20.313  -1.946  -4.443
  567   HD11  ILE  73          3HD1      ILE  73  23.162  -5.077  -3.844
  568   HD12  ILE  73          1HD1      ILE  73  21.957  -4.839  -5.133
  569   HD13  ILE  73          2HD1      ILE  73  23.673  -4.791  -5.513
  570    H    GLN  74           H        GLN  74  21.551  -1.427  -0.576
  571    HA   GLN  74           HA       GLN  74  19.024  -0.145  -0.898
  572    HB2  GLN  74           HB2      GLN  74  18.689  -0.531   1.465
  573    HB3  GLN  74           HB3      GLN  74  19.426  -1.928   0.704
  574    HG2  GLN  74           HG2      GLN  74  20.666  -1.823   2.653
  575    HG3  GLN  74           HG3      GLN  74  21.691  -0.979   1.543
  576   HE21  GLN  74          1HE2      GLN  74  22.724   0.636   2.721
  577   HE22  GLN  74          2HE2      GLN  74  21.911   1.674   3.891
  578    H    ALA  75           H        ALA  75  22.126   1.195   0.182
  579    HA   ALA  75           HA       ALA  75  21.075   3.746   1.047
  580    HB1  ALA  75           HB1      ALA  75  23.452   4.443   0.876
  581    HB2  ALA  75           HB2      ALA  75  23.299   2.910   1.746
  582    HB3  ALA  75           HB3      ALA  75  23.850   2.924   0.057
  583    H    TRP  76           H        TRP  76  22.382   2.552  -2.088
  584    HA   TRP  76           HA       TRP  76  22.087   5.036  -3.491
  585    HB2  TRP  76           HB2      TRP  76  23.562   3.205  -4.197
  586    HB3  TRP  76           HB3      TRP  76  22.163   2.174  -4.510
  587    HD1  TRP  76           HD1      TRP  76  24.062   5.166  -5.926
  588    HE1  TRP  76           HE1      TRP  76  23.301   5.648  -8.325
  589    HE3  TRP  76           HE3      TRP  76  20.167   1.868  -6.197
  590    HZ2  TRP  76           HZ2      TRP  76  21.202   4.761 -10.117
  591    HZ3  TRP  76           HZ3      TRP  76  18.782   1.734  -8.243
  592    HH2  TRP  76           HH2      TRP  76  19.265   3.195 -10.205
  593    H    MET  77           H        MET  77  19.870   2.219  -3.161
  594    HA   MET  77           HA       MET  77  17.755   3.244  -4.802
  595    HB2  MET  77           HB2      MET  77  17.730   1.369  -2.399
  596    HB3  MET  77           HB3      MET  77  16.304   1.714  -3.386
  597    HG2  MET  77           HG2      MET  77  17.374   0.815  -5.378
  598    HG3  MET  77           HG3      MET  77  18.894   0.616  -4.530
  599    HE1  MET  77           HE1      MET  77  15.155  -2.038  -4.097
  600    HE2  MET  77           HE2      MET  77  15.096  -0.296  -3.782
  601    HE3  MET  77           HE3      MET  77  15.479  -0.898  -5.411
  602    H    ARG  78           H        ARG  78  18.364   3.671  -1.274
  603    HA   ARG  78           HA       ARG  78  16.131   5.355  -0.746
  604    HB2  ARG  78           HB2      ARG  78  17.465   4.276   0.988
  605    HB3  ARG  78           HB3      ARG  78  18.874   5.281   0.585
  606    HG2  ARG  78           HG2      ARG  78  17.609   7.314   1.243
  607    HG3  ARG  78           HG3      ARG  78  16.174   6.330   1.568
  608    HD2  ARG  78           HD2      ARG  78  17.393   5.155   3.371
  609    HD3  ARG  78           HD3      ARG  78  18.861   6.078   2.988
  610    HE   ARG  78           HE       ARG  78  16.674   7.861   3.496
  611   HH11  ARG  78          1HH1      ARG  78  18.937   5.788   5.255
  612   HH12  ARG  78          2HH1      ARG  78  18.820   6.740   6.703
  613   HH21  ARG  78          1HH2      ARG  78  16.562   9.046   5.410
  614   HH22  ARG  78          2HH2      ARG  78  17.505   8.562   6.789
  615    H    GLU  79           H        GLU  79  19.479   6.262  -1.739
  616    HA   GLU  79           HA       GLU  79  19.073   9.057  -1.771
  617    HB2  GLU  79           HB2      GLU  79  21.267   7.884  -1.879
  618    HB3  GLU  79           HB3      GLU  79  20.927   7.426  -3.553
  619    HG2  GLU  79           HG2      GLU  79  20.858   9.793  -4.215
  620    HG3  GLU  79           HG3      GLU  79  21.034  10.305  -2.529
  621    H    LYS  80           H        LYS  80  18.565   6.689  -4.457
  622    HA   LYS  80           HA       LYS  80  17.605   8.578  -6.409
  623    HB2  LYS  80           HB2      LYS  80  17.097   5.618  -5.929
  624    HB3  LYS  80           HB3      LYS  80  16.456   6.469  -7.323
  625    HG2  LYS  80           HG2      LYS  80  19.425   6.187  -6.675
  626    HG3  LYS  80           HG3      LYS  80  18.518   5.156  -7.777
  627    HD2  LYS  80           HD2      LYS  80  18.995   8.139  -8.136
  628    HD3  LYS  80           HD3      LYS  80  19.866   6.849  -8.943
  629    HE2  LYS  80           HE2      LYS  80  17.720   6.051  -9.963
  630    HE3  LYS  80           HE3      LYS  80  16.883   7.417  -9.211
  631    HZ1  LYS  80           HZ1      LYS  80  17.473   7.966 -11.465
  632    HZ2  LYS  80           HZ2      LYS  80  19.044   7.581 -11.235
  633    HZ3  LYS  80           HZ3      LYS  80  18.394   8.895 -10.485
  634    H    GLN  81           H        GLN  81  15.833   6.729  -3.894
  635    HA   GLN  81           HA       GLN  81  13.217   7.620  -4.743
  636    HB2  GLN  81           HB2      GLN  81  13.755   5.517  -3.504
  637    HB3  GLN  81           HB3      GLN  81  14.108   6.478  -2.064
  638    HG2  GLN  81           HG2      GLN  81  11.764   7.269  -2.022
  639    HG3  GLN  81           HG3      GLN  81  11.439   6.425  -3.543
  640   HE21  GLN  81          1HE2      GLN  81   9.966   4.785  -2.923
  641   HE22  GLN  81          2HE2      GLN  81  10.312   3.647  -1.620
  642    H    SER  82           H        SER  82  15.561   8.979  -2.416
  643    HA   SER  82           HA       SER  82  13.716  10.796  -1.153
  644    HB2  SER  82           HB2      SER  82  16.751  10.874  -1.345
  645    HB3  SER  82           HB3      SER  82  15.755  11.855  -0.255
  646    HG   SER  82           HG       SER  82  16.045   9.006  -0.278
  647    H    SER  83           H        SER  83  14.995  11.036  -4.313
  648    HA   SER  83           HA       SER  83  15.496  13.853  -4.509
  649    HB2  SER  83           HB2      SER  83  14.641  11.864  -6.651
  650    HB3  SER  83           HB3      SER  83  15.375  13.447  -6.935
  651    HG   SER  83           HG       SER  83  17.281  12.694  -5.920
  652    H    ASP  84           H        ASP  84  12.442  12.340  -4.112
  653    HA   ASP  84           HA       ASP  84  10.891  14.183  -5.762
  654    HB2  ASP  84           HB2      ASP  84   9.047  12.967  -5.185
  655    HB3  ASP  84           HB3      ASP  84  10.309  11.746  -5.157
  656    H    HIS  85           H        HIS  85  12.301  14.561  -2.688
  657    HA   HIS  85           HA       HIS  85  10.203  16.123  -1.423
  658    HB2  HIS  85           HB2      HIS  85  11.817  14.679  -0.197
  659    HB3  HIS  85           HB3      HIS  85  13.122  15.780  -0.646
  660    HD1  HIS  85           HD1      HIS  85   9.847  15.769   1.439
  661    HD2  HIS  85           HD2      HIS  85  13.423  17.919   0.902
  662    HE1  HIS  85           HE1      HIS  85   9.931  17.493   3.309
  Start of MODEL   20
    1    H2   PRO   1           H2       PRO   1  -2.138  10.170   1.393
    2    H3   PRO   1           H3       PRO   1  -2.435   8.588   1.709
    3    HA   PRO   1           HA       PRO   1  -1.971   7.923  -0.483
    4    HB2  PRO   1           HB2      PRO   1  -1.758  10.792  -1.382
    5    HB3  PRO   1           HB3      PRO   1  -2.286   9.348  -2.301
    6    HG2  PRO   1           HG2      PRO   1  -3.916  11.211  -0.813
    7    HG3  PRO   1           HG3      PRO   1  -4.488   9.704  -1.572
    8    HD2  PRO   1           HD2      PRO   1  -4.466  10.112   1.170
    9    HD3  PRO   1           HD3      PRO   1  -4.355   8.516   0.380
   10    H    GLY   2           H        GLY   2   0.079   8.374  -1.944
   11    HA2  GLY   2           HA2      GLY   2   2.337   8.963  -2.162
   12    HA3  GLY   2           HA3      GLY   2   2.366   9.578  -0.486
   13    H    SER   3           H        SER   3   0.952   6.467  -0.787
   14    HA   SER   3           HA       SER   3   3.120   5.269   0.728
   15    HB2  SER   3           HB2      SER   3   1.471   3.350   0.858
   16    HB3  SER   3           HB3      SER   3   0.852   4.911   1.432
   17    HG   SER   3           HG       SER   3  -0.624   3.764   0.032
   18    H    ALA   4           H        ALA   4   2.569   5.409  -2.616
   19    HA   ALA   4           HA       ALA   4   3.386   2.772  -3.420
   20    HB1  ALA   4           HB1      ALA   4   3.632   3.808  -5.646
   21    HB2  ALA   4           HB2      ALA   4   2.109   4.315  -4.879
   22    HB3  ALA   4           HB3      ALA   4   3.506   5.425  -4.929
   23    H    GLU   5           H        GLU   5   5.315   2.074  -4.401
   24    HA   GLU   5           HA       GLU   5   7.771   3.059  -3.111
   25    HB2  GLU   5           HB2      GLU   5   8.814   1.058  -4.002
   26    HB3  GLU   5           HB3      GLU   5   7.370   0.675  -3.101
   27    HG2  GLU   5           HG2      GLU   5   7.293   0.882  -6.143
   28    HG3  GLU   5           HG3      GLU   5   7.872  -0.563  -5.335
   29    H    ILE   6           H        ILE   6   9.779   3.190  -4.394
   30    HA   ILE   6           HA       ILE   6   9.473   4.875  -6.811
   31    HB   ILE   6           HB       ILE   6  11.957   4.022  -5.287
   32   HG12  ILE   6          2HG1      ILE   6  10.579   5.409  -3.816
   33   HG13  ILE   6          3HG1      ILE   6  12.033   6.242  -4.306
   34   HG21  ILE   6          1HG2      ILE   6  11.565   6.022  -7.541
   35   HG22  ILE   6          2HG2      ILE   6  12.985   6.027  -6.468
   36   HG23  ILE   6          3HG2      ILE   6  12.654   4.616  -7.471
   37   HD11  ILE   6          3HD1      ILE   6  10.111   7.755  -4.262
   38   HD12  ILE   6          1HD1      ILE   6  10.749   7.619  -5.911
   39   HD13  ILE   6          2HD1      ILE   6   9.253   6.756  -5.448
   40    H    ASP   7           H        ASP   7  10.228   4.328  -8.856
   41    HA   ASP   7           HA       ASP   7  10.505   1.457  -9.476
   42    HB2  ASP   7           HB2      ASP   7   9.119   2.973 -10.862
   43    HB3  ASP   7           HB3      ASP   7  10.569   3.893 -11.301
   44    H    TYR   8           H        TYR   8  12.399   0.426  -9.656
   45    HA   TYR   8           HA       TYR   8  14.926   2.006  -9.719
   46    HB2  TYR   8           HB2      TYR   8  14.516  -0.836  -8.725
   47    HB3  TYR   8           HB3      TYR   8  15.956   0.151  -8.621
   48    HD1  TYR   8           HD2      TYR   8  15.655   2.521  -7.420
   49    HD2  TYR   8           HD1      TYR   8  13.145  -0.929  -6.787
   50    HE1  TYR   8           HE2      TYR   8  15.026   3.389  -5.176
   51    HE2  TYR   8           HE1      TYR   8  12.503  -0.045  -4.546
   52    HH   TYR   8           HH       TYR   8  13.836   3.036  -3.257
   53    H    SER   9           H        SER   9  13.279   0.875 -12.186
   54    HA   SER   9           HA       SER   9  15.216  -0.839 -13.527
   55    HB2  SER   9           HB2      SER   9  13.079   1.016 -14.646
   56    HB3  SER   9           HB3      SER   9  14.029  -0.125 -15.600
   57    HG   SER   9           HG       SER   9  11.928  -0.948 -14.914
   58    H    ASP  10           H        ASP  10  15.321   2.450 -12.653
   59    HA   ASP  10           HA       ASP  10  17.201   3.433 -14.644
   60    HB2  ASP  10           HB2      ASP  10  15.565   4.806 -13.342
   61    HB3  ASP  10           HB3      ASP  10  16.445   4.422 -11.859
   62    H    ALA  11           H        ALA  11  17.656   1.151 -12.145
   63    HA   ALA  11           HA       ALA  11  19.949   2.052 -10.842
   64    HB1  ALA  11           HB1      ALA  11  18.582   0.179 -10.058
   65    HB2  ALA  11           HB2      ALA  11  19.085  -0.803 -11.456
   66    HB3  ALA  11           HB3      ALA  11  20.271  -0.333 -10.212
   67    HA   PRO  12           HA       PRO  12  23.251   1.700 -13.804
   68    HB2  PRO  12           HB2      PRO  12  25.454   1.660 -12.164
   69    HB3  PRO  12           HB3      PRO  12  24.438   3.114 -12.395
   70    HG2  PRO  12           HG2      PRO  12  24.246   1.056 -10.163
   71    HG3  PRO  12           HG3      PRO  12  24.358   2.840  -9.997
   72    HD2  PRO  12           HD2      PRO  12  21.968   1.555  -9.930
   73    HD3  PRO  12           HD3      PRO  12  22.124   3.121 -10.781
   74    H    ASP  13           H        ASP  13  24.784   0.197 -14.638
   75    HA   ASP  13           HA       ASP  13  23.827  -2.416 -14.598
   76    HB2  ASP  13           HB2      ASP  13  25.004  -1.245 -16.445
   77    HB3  ASP  13           HB3      ASP  13  26.528  -1.413 -15.570
   78    H    GLU  14           H        GLU  14  26.334  -1.116 -12.557
   79    HA   GLU  14           HA       GLU  14  27.532  -3.620 -11.760
   80    HB2  GLU  14           HB2      GLU  14  28.603  -2.328 -10.012
   81    HB3  GLU  14           HB3      GLU  14  28.674  -1.469 -11.561
   82    HG2  GLU  14           HG2      GLU  14  26.704  -0.068 -10.798
   83    HG3  GLU  14           HG3      GLU  14  26.818  -0.856  -9.217
   84    H    PHE  15           H        PHE  15  24.534  -2.132 -10.875
   85    HA   PHE  15           HA       PHE  15  24.124  -3.959  -8.544
   86    HB2  PHE  15           HB2      PHE  15  22.522  -1.590  -9.571
   87    HB3  PHE  15           HB3      PHE  15  22.133  -2.543  -8.144
   88    HD1  PHE  15           HD1      PHE  15  25.333  -2.626  -7.325
   89    HD2  PHE  15           HD2      PHE  15  22.339   0.376  -8.107
   90    HE1  PHE  15           HE1      PHE  15  26.556  -1.040  -5.892
   91    HE2  PHE  15           HE2      PHE  15  23.599   1.981  -6.692
   92    HZ   PHE  15           HZ       PHE  15  25.696   1.276  -5.574
   93    H    ARG  16           H        ARG  16  23.518  -3.899 -11.898
   94    HA   ARG  16           HA       ARG  16  20.890  -5.169 -11.750
   95    HB2  ARG  16           HB2      ARG  16  22.670  -4.616 -14.129
   96    HB3  ARG  16           HB3      ARG  16  21.024  -5.271 -14.217
   97    HG2  ARG  16           HG2      ARG  16  20.093  -3.209 -13.234
   98    HG3  ARG  16           HG3      ARG  16  21.719  -2.574 -13.003
   99    HD2  ARG  16           HD2      ARG  16  21.295  -1.518 -14.949
  100    HD3  ARG  16           HD3      ARG  16  21.933  -3.001 -15.629
  101    HE   ARG  16           HE       ARG  16  19.784  -3.641 -16.355
  102   HH11  ARG  16          1HH2      ARG  16  19.575  -0.557 -14.588
  103   HH12  ARG  16          2HH2      ARG  16  17.954  -0.263 -15.163
  104   HH21  ARG  16          1HH1      ARG  16  17.740  -3.258 -16.941
  105   HH22  ARG  16          2HH1      ARG  16  16.914  -1.777 -16.492
  106    H    ASP  17           H        ASP  17  20.386  -7.269 -12.266
  107    HA   ASP  17           HA       ASP  17  22.551  -9.282 -12.408
  108    HB2  ASP  17           HB2      ASP  17  20.583 -10.866 -12.835
  109    HB3  ASP  17           HB3      ASP  17  20.841 -10.194 -11.234
  110    HA   PRO  18           HA       PRO  18  22.738  -9.106 -16.834
  111    HB2  PRO  18           HB2      PRO  18  24.078 -11.411 -17.447
  112    HB3  PRO  18           HB3      PRO  18  24.831 -10.060 -16.550
  113    HG2  PRO  18           HG2      PRO  18  23.591 -12.571 -15.389
  114    HG3  PRO  18           HG3      PRO  18  25.184 -11.854 -15.027
  115    HD2  PRO  18           HD2      PRO  18  22.976 -11.418 -13.469
  116    HD3  PRO  18           HD3      PRO  18  24.209 -10.151 -13.731
  117    H    LEU  19           H        LEU  19  21.164 -11.965 -15.378
  118    HA   LEU  19           HA       LEU  19  20.146 -12.955 -17.913
  119    HB2  LEU  19           HB2      LEU  19  20.819 -14.262 -15.798
  120    HB3  LEU  19           HB3      LEU  19  19.305 -13.746 -15.088
  121    HG   LEU  19           HG       LEU  19  19.367 -16.053 -15.945
  122   HD11  LEU  19          1HD1      LEU  19  17.275 -14.419 -17.417
  123   HD12  LEU  19          2HD1      LEU  19  17.206 -14.877 -15.699
  124   HD13  LEU  19          3HD1      LEU  19  17.197 -16.122 -16.960
  125   HD21  LEU  19          3HD2      LEU  19  20.765 -15.677 -17.959
  126   HD22  LEU  19          1HD2      LEU  19  19.388 -14.875 -18.754
  127   HD23  LEU  19          2HD2      LEU  19  19.288 -16.583 -18.299
  128    H    MET  20           H        MET  20  18.672 -11.370 -15.078
  129    HA   MET  20           HA       MET  20  16.059 -11.157 -16.446
  130    HB2  MET  20           HB2      MET  20  17.016 -10.829 -13.580
  131    HB3  MET  20           HB3      MET  20  15.417 -10.313 -14.072
  132    HG2  MET  20           HG2      MET  20  16.569 -13.117 -14.358
  133    HG3  MET  20           HG3      MET  20  15.465 -12.602 -13.103
  134    HE1  MET  20           HE1      MET  20  12.073 -12.164 -14.917
  135    HE2  MET  20           HE2      MET  20  12.973 -12.049 -13.393
  136    HE3  MET  20           HE3      MET  20  13.241 -10.858 -14.693
  137    H    ASP  21           H        ASP  21  18.725  -9.062 -15.853
  138    HA   ASP  21           HA       ASP  21  19.156  -6.923 -16.251
  139    HB2  ASP  21           HB2      ASP  21  18.413  -7.579 -18.508
  140    HB3  ASP  21           HB3      ASP  21  16.787  -6.994 -18.145
  141    H    THR  22           H        THR  22  18.050  -7.180 -13.881
  142    HA   THR  22           HA       THR  22  16.857  -4.520 -13.423
  143    HB   THR  22           HB       THR  22  14.943  -6.076 -13.740
  144    HG1  THR  22           HG1      THR  22  13.891  -5.288 -11.910
  145   HG21  THR  22          1HG2      THR  22  15.846  -7.333 -11.114
  146   HG22  THR  22          2HG2      THR  22  15.909  -8.131 -12.699
  147   HG23  THR  22          3HG2      THR  22  14.351  -7.670 -12.001
  148    H    LEU  23           H        LEU  23  16.631  -4.229 -10.912
  149    HA   LEU  23           HA       LEU  23  19.283  -4.407  -9.822
  150    HB2  LEU  23           HB2      LEU  23  17.121  -2.832  -9.299
  151    HB3  LEU  23           HB3      LEU  23  16.933  -3.978  -7.978
  152    HG   LEU  23           HG       LEU  23  19.307  -2.176  -8.556
  153   HD11  LEU  23          1HD1      LEU  23  17.354  -1.083  -7.534
  154   HD12  LEU  23          2HD1      LEU  23  18.730  -1.110  -6.427
  155   HD13  LEU  23          3HD1      LEU  23  17.391  -2.258  -6.202
  156   HD21  LEU  23          3HD2      LEU  23  20.192  -4.288  -7.587
  157   HD22  LEU  23          1HD2      LEU  23  19.026  -4.145  -6.242
  158   HD23  LEU  23          2HD2      LEU  23  20.329  -2.957  -6.456
  159    H    MET  24           H        MET  24  20.246  -6.186  -8.926
  160    HA   MET  24           HA       MET  24  18.763  -8.609  -8.467
  161    HB2  MET  24           HB2      MET  24  20.865  -9.575  -7.702
  162    HB3  MET  24           HB3      MET  24  21.016  -8.727  -9.244
  163    HG2  MET  24           HG2      MET  24  22.019  -6.787  -7.968
  164    HG3  MET  24           HG3      MET  24  22.007  -7.806  -6.522
  165    HE1  MET  24           HE1      MET  24  24.403  -6.261  -8.486
  166    HE2  MET  24           HE2      MET  24  24.515  -6.693  -6.767
  167    HE3  MET  24           HE3      MET  24  25.726  -7.302  -7.911
  168    H    THR  25           H        THR  25  20.092  -6.227  -6.230
  169    HA   THR  25           HA       THR  25  19.656  -5.652  -4.072
  170    HB   THR  25           HB       THR  25  17.341  -7.604  -4.050
  171    HG1  THR  25           HG1      THR  25  16.151  -5.899  -4.922
  172   HG21  THR  25          1HG2      THR  25  17.837  -4.913  -2.680
  173   HG22  THR  25          2HG2      THR  25  17.872  -6.503  -1.872
  174   HG23  THR  25          3HG2      THR  25  16.356  -5.888  -2.559
  175    H    ASP  26           H        ASP  26  19.602  -9.127  -4.597
  176    HA   ASP  26           HA       ASP  26  21.167  -9.589  -2.077
  177    HB2  ASP  26           HB2      ASP  26  19.214 -11.348  -3.598
  178    HB3  ASP  26           HB3      ASP  26  20.312 -11.950  -2.350
  179    HA   PRO  27           HA       PRO  27  24.092 -10.567  -5.545
  180    HB2  PRO  27           HB2      PRO  27  26.297  -9.301  -4.517
  181    HB3  PRO  27           HB3      PRO  27  25.060  -8.478  -5.499
  182    HG2  PRO  27           HG2      PRO  27  25.294  -8.520  -2.488
  183    HG3  PRO  27           HG3      PRO  27  24.978  -7.116  -3.568
  184    HD2  PRO  27           HD2      PRO  27  22.998  -8.439  -2.250
  185    HD3  PRO  27           HD3      PRO  27  22.755  -7.725  -3.879
  186    H    VAL  28           H        VAL  28  25.194 -12.441  -5.474
  187    HA   VAL  28           HA       VAL  28  26.254 -13.518  -2.892
  188    HB   VAL  28           HB       VAL  28  24.565 -14.962  -4.989
  189   HG11  VAL  28          1HG1      VAL  28  25.904 -16.120  -2.516
  190   HG12  VAL  28          2HG1      VAL  28  24.754 -16.949  -3.584
  191   HG13  VAL  28          3HG1      VAL  28  26.333 -16.489  -4.205
  192   HG21  VAL  28          3HG2      VAL  28  24.060 -14.419  -2.021
  193   HG22  VAL  28          1HG2      VAL  28  23.220 -13.637  -3.370
  194   HG23  VAL  28          2HG2      VAL  28  23.026 -15.384  -3.093
  195    H    ARG  29           H        ARG  29  28.232 -14.238  -3.003
  196    HA   ARG  29           HA       ARG  29  29.722 -14.107  -5.514
  197    HB2  ARG  29           HB2      ARG  29  30.352 -13.005  -3.345
  198    HB3  ARG  29           HB3      ARG  29  30.744 -14.585  -2.688
  199    HG2  ARG  29           HG2      ARG  29  32.578 -14.858  -4.216
  200    HG3  ARG  29           HG3      ARG  29  31.994 -13.542  -5.257
  201    HD2  ARG  29           HD2      ARG  29  33.897 -12.745  -4.022
  202    HD3  ARG  29           HD3      ARG  29  32.444 -11.900  -3.447
  203    HE   ARG  29           HE       ARG  29  32.719 -14.027  -1.688
  204   HH11  ARG  29          1HH1      ARG  29  34.876 -11.364  -2.619
  205   HH12  ARG  29          2HH1      ARG  29  35.625 -11.324  -1.052
  206   HH21  ARG  29          1HH2      ARG  29  33.669 -13.878   0.297
  207   HH22  ARG  29          2HH2      ARG  29  34.974 -12.746   0.575
  208    H    LEU  30           H        LEU  30  30.664 -15.723  -6.536
  209    HA   LEU  30           HA       LEU  30  30.182 -18.556  -5.798
  210    HB2  LEU  30           HB2      LEU  30  31.291 -17.156  -8.297
  211    HB3  LEU  30           HB3      LEU  30  31.151 -18.882  -8.128
  212    HG   LEU  30           HG       LEU  30  29.341 -18.454  -9.376
  213   HD11  LEU  30          1HD1      LEU  30  28.611 -19.644  -7.306
  214   HD12  LEU  30          2HD1      LEU  30  27.320 -18.784  -8.134
  215   HD13  LEU  30          3HD1      LEU  30  28.032 -18.094  -6.664
  216   HD21  LEU  30          3HD2      LEU  30  28.631 -15.943  -7.820
  217   HD22  LEU  30          1HD2      LEU  30  27.811 -16.587  -9.257
  218   HD23  LEU  30          2HD2      LEU  30  29.475 -15.999  -9.382
  219    HA   PRO  31           HA       PRO  31  34.298 -19.335  -4.353
  220    HB2  PRO  31           HB2      PRO  31  35.042 -21.724  -5.526
  221    HB3  PRO  31           HB3      PRO  31  33.850 -21.580  -4.198
  222    HG2  PRO  31           HG2      PRO  31  33.292 -21.746  -7.171
  223    HG3  PRO  31           HG3      PRO  31  32.542 -22.685  -5.842
  224    HD2  PRO  31           HD2      PRO  31  31.292 -20.526  -6.842
  225    HD3  PRO  31           HD3      PRO  31  31.315 -20.785  -5.085
  226    H    SER  32           H        SER  32  33.840 -19.145  -7.861
  227    HA   SER  32           HA       SER  32  36.615 -18.819  -8.631
  228    HB2  SER  32           HB2      SER  32  35.533 -17.961 -10.718
  229    HB3  SER  32           HB3      SER  32  34.906 -19.534 -10.209
  230    HG   SER  32           HG       SER  32  33.215 -18.097 -10.777
  231    H    GLY  33           H        GLY  33  34.556 -16.775  -6.824
  232    HA2  GLY  33           HA2      GLY  33  34.988 -14.641  -5.985
  233    HA3  GLY  33           HA3      GLY  33  36.243 -14.376  -7.228
  234    H    THR  34           H        THR  34  33.773 -15.478  -9.021
  235    HA   THR  34           HA       THR  34  32.789 -12.930  -9.981
  236    HB   THR  34           HB       THR  34  31.830 -15.783 -10.447
  237    HG1  THR  34           HG1      THR  34  33.125 -15.600 -12.279
  238   HG21  THR  34          1HG2      THR  34  30.056 -14.268 -11.167
  239   HG22  THR  34          2HG2      THR  34  30.892 -14.880 -12.582
  240   HG23  THR  34          3HG2      THR  34  31.223 -13.231 -12.015
  241    H    VAL  35           H        VAL  35  30.672 -12.066  -9.772
  242    HA   VAL  35           HA       VAL  35  29.080 -13.066  -7.433
  243    HB   VAL  35           HB       VAL  35  29.286 -10.190  -8.424
  244   HG11  VAL  35          1HG1      VAL  35  27.729 -11.405  -6.082
  245   HG12  VAL  35          2HG1      VAL  35  27.934  -9.675  -6.386
  246   HG13  VAL  35          3HG1      VAL  35  27.031 -10.651  -7.529
  247   HG21  VAL  35          3HG2      VAL  35  30.318 -11.506  -5.866
  248   HG22  VAL  35          1HG2      VAL  35  31.311 -10.852  -7.176
  249   HG23  VAL  35          2HG2      VAL  35  30.326  -9.757  -6.208
  250    H    MET  36           H        MET  36  26.996 -13.435  -7.680
  251    HA   MET  36           HA       MET  36  25.530 -12.688 -10.159
  252    HB2  MET  36           HB2      MET  36  26.434 -15.041 -10.312
  253    HB3  MET  36           HB3      MET  36  25.515 -15.455  -8.870
  254    HG2  MET  36           HG2      MET  36  24.492 -16.202 -10.995
  255    HG3  MET  36           HG3      MET  36  23.432 -15.222 -10.001
  256    HE1  MET  36           HE1      MET  36  25.935 -15.232 -12.938
  257    HE2  MET  36           HE2      MET  36  25.545 -13.778 -13.873
  258    HE3  MET  36           HE3      MET  36  26.335 -13.624 -12.299
  259    H    ASP  37           H        ASP  37  23.165 -13.038  -9.855
  260    HA   ASP  37           HA       ASP  37  22.155 -11.999  -7.300
  261    HB2  ASP  37           HB2      ASP  37  21.081 -11.249  -9.290
  262    HB3  ASP  37           HB3      ASP  37  20.934 -12.882  -9.915
  263    H    ARG  38           H        ARG  38  21.268 -13.098  -5.686
  264    HA   ARG  38           HA       ARG  38  21.549 -15.793  -5.092
  265    HB2  ARG  38           HB2      ARG  38  20.936 -14.061  -3.477
  266    HB3  ARG  38           HB3      ARG  38  19.364 -13.842  -4.248
  267    HG2  ARG  38           HG2      ARG  38  18.732 -16.171  -3.647
  268    HG3  ARG  38           HG3      ARG  38  20.336 -16.411  -2.903
  269    HD2  ARG  38           HD2      ARG  38  19.789 -14.623  -1.255
  270    HD3  ARG  38           HD3      ARG  38  18.235 -14.366  -2.074
  271    HE   ARG  38           HE       ARG  38  17.357 -16.220  -1.071
  272   HH11  ARG  38          1HH1      ARG  38  20.855 -16.416  -0.564
  273   HH12  ARG  38          2HH1      ARG  38  20.709 -17.734   0.554
  274   HH21  ARG  38          1HH2      ARG  38  17.244 -17.934   0.365
  275   HH22  ARG  38          2HH2      ARG  38  18.693 -18.582   1.070
  276    H    SER  39           H        SER  39  18.564 -14.300  -6.504
  277    HA   SER  39           HA       SER  39  17.122 -16.775  -6.402
  278    HB2  SER  39           HB2      SER  39  16.515 -14.282  -8.032
  279    HB3  SER  39           HB3      SER  39  15.404 -15.617  -7.698
  280    HG   SER  39           HG       SER  39  15.112 -13.868  -6.220
  281    H    ILE  40           H        ILE  40  18.817 -15.110  -9.092
  282    HA   ILE  40           HA       ILE  40  18.245 -17.056 -11.120
  283    HB   ILE  40           HB       ILE  40  20.456 -15.022 -10.774
  284   HG12  ILE  40          2HG1      ILE  40  18.256 -15.113 -12.882
  285   HG13  ILE  40          3HG1      ILE  40  17.901 -14.471 -11.290
  286   HG21  ILE  40          1HG2      ILE  40  19.996 -16.868 -13.148
  287   HG22  ILE  40          2HG2      ILE  40  21.007 -15.415 -13.205
  288   HG23  ILE  40          3HG2      ILE  40  21.466 -16.740 -12.151
  289   HD11  ILE  40          3HD1      ILE  40  18.490 -12.730 -12.991
  290   HD12  ILE  40          1HD1      ILE  40  19.450 -12.675 -11.521
  291   HD13  ILE  40          2HD1      ILE  40  20.155 -13.354 -13.000
  292    H    ILE  41           H        ILE  41  21.085 -16.943  -8.849
  293    HA   ILE  41           HA       ILE  41  22.163 -19.338 -10.024
  294    HB   ILE  41           HB       ILE  41  23.594 -17.761  -8.808
  295   HG12  ILE  41          2HG1      ILE  41  24.995 -19.379  -7.628
  296   HG13  ILE  41          3HG1      ILE  41  23.704 -20.578  -7.633
  297   HG21  ILE  41          1HG2      ILE  41  23.784 -17.774  -6.375
  298   HG22  ILE  41          2HG2      ILE  41  22.179 -17.255  -6.853
  299   HG23  ILE  41          3HG2      ILE  41  22.420 -18.901  -6.234
  300   HD11  ILE  41          3HD1      ILE  41  25.000 -19.415 -10.132
  301   HD12  ILE  41          1HD1      ILE  41  25.459 -20.951  -9.376
  302   HD13  ILE  41          2HD1      ILE  41  23.840 -20.764 -10.073
  303    H    LEU  42           H        LEU  42  20.049 -18.974  -7.118
  304    HA   LEU  42           HA       LEU  42  20.094 -21.813  -6.651
  305    HB2  LEU  42           HB2      LEU  42  18.586 -21.477  -4.923
  306    HB3  LEU  42           HB3      LEU  42  19.642 -20.081  -4.959
  307    HG   LEU  42           HG       LEU  42  17.692 -18.913  -6.267
  308   HD11  LEU  42          1HD1      LEU  42  16.200 -20.874  -6.610
  309   HD12  LEU  42          2HD1      LEU  42  15.433 -19.688  -5.550
  310   HD13  LEU  42          3HD1      LEU  42  16.157 -21.156  -4.858
  311   HD21  LEU  42          3HD2      LEU  42  18.500 -18.390  -3.965
  312   HD22  LEU  42          1HD2      LEU  42  17.391 -19.609  -3.313
  313   HD23  LEU  42          2HD2      LEU  42  16.747 -18.165  -4.121
  314    H    ARG  43           H        ARG  43  17.995 -19.818  -8.715
  315    HA   ARG  43           HA       ARG  43  16.179 -21.941  -9.383
  316    HB2  ARG  43           HB2      ARG  43  15.719 -19.560  -9.712
  317    HB3  ARG  43           HB3      ARG  43  16.952 -19.449 -10.962
  318    HG2  ARG  43           HG2      ARG  43  14.507 -21.281 -11.108
  319    HG3  ARG  43           HG3      ARG  43  14.483 -19.607 -11.638
  320    HD2  ARG  43           HD2      ARG  43  16.174 -21.816 -12.853
  321    HD3  ARG  43           HD3      ARG  43  14.716 -21.115 -13.531
  322    HE   ARG  43           HE       ARG  43  16.253 -18.908 -13.239
  323   HH11  ARG  43          1HH1      ARG  43  17.006 -22.017 -14.794
  324   HH12  ARG  43          2HH1      ARG  43  17.986 -21.241 -16.007
  325   HH21  ARG  43          1HH2      ARG  43  17.629 -18.029 -14.768
  326   HH22  ARG  43          2HH2      ARG  43  18.383 -19.043 -15.963
  327    H    HIS  44           H        HIS  44  19.233 -20.788 -10.978
  328    HA   HIS  44           HA       HIS  44  19.147 -22.785 -13.031
  329    HB2  HIS  44           HB2      HIS  44  20.565 -20.680 -13.000
  330    HB3  HIS  44           HB3      HIS  44  21.657 -21.508 -11.876
  331    HD1  HIS  44           HD1      HIS  44  23.282 -23.391 -13.041
  332    HD2  HIS  44           HD2      HIS  44  20.281 -21.737 -15.499
  333    HE1  HIS  44           HE1      HIS  44  23.720 -24.240 -15.390
  334    H    LEU  45           H        LEU  45  20.627 -22.892  -9.747
  335    HA   LEU  45           HA       LEU  45  21.761 -25.493  -9.928
  336    HB2  LEU  45           HB2      LEU  45  20.669 -23.869  -7.617
  337    HB3  LEU  45           HB3      LEU  45  21.369 -25.470  -7.386
  338    HG   LEU  45           HG       LEU  45  22.891 -23.171  -8.703
  339   HD11  LEU  45          1HD1      LEU  45  24.065 -22.948  -6.554
  340   HD12  LEU  45          2HD1      LEU  45  23.030 -24.190  -5.833
  341   HD13  LEU  45          3HD1      LEU  45  22.338 -22.631  -6.338
  342   HD21  LEU  45          3HD2      LEU  45  23.774 -25.885  -7.622
  343   HD22  LEU  45          1HD2      LEU  45  24.859 -24.584  -8.178
  344   HD23  LEU  45          2HD2      LEU  45  23.787 -25.366  -9.324
  345    H    LEU  46           H        LEU  46  18.388 -24.576  -9.326
  346    HA   LEU  46           HA       LEU  46  17.443 -27.239  -8.789
  347    HB2  LEU  46           HB2      LEU  46  16.353 -24.578  -8.945
  348    HB3  LEU  46           HB3      LEU  46  15.445 -25.530 -10.097
  349    HG   LEU  46           HG       LEU  46  14.352 -25.455  -7.944
  350   HD11  LEU  46          1HD1      LEU  46  13.940 -27.812  -7.553
  351   HD12  LEU  46          2HD1      LEU  46  15.441 -28.270  -8.380
  352   HD13  LEU  46          3HD1      LEU  46  14.110 -27.541  -9.297
  353   HD21  LEU  46          3HD2      LEU  46  16.778 -26.831  -6.714
  354   HD22  LEU  46          1HD2      LEU  46  15.251 -26.412  -5.899
  355   HD23  LEU  46          2HD2      LEU  46  16.326 -25.123  -6.500
  356    H    ASN  47           H        ASN  47  18.249 -25.624 -11.813
  357    HA   ASN  47           HA       ASN  47  16.946 -27.697 -13.467
  358    HB2  ASN  47           HB2      ASN  47  18.757 -25.393 -14.276
  359    HB3  ASN  47           HB3      ASN  47  17.862 -26.451 -15.362
  360   HD21  ASN  47          1HD2      ASN  47  15.306 -26.571 -14.441
  361   HD22  ASN  47          2HD2      ASN  47  14.626 -24.953 -14.367
  362    H    SER  48           H        SER  48  20.309 -26.639 -12.728
  363    HA   SER  48           HA       SER  48  21.367 -29.369 -13.256
  364    HB2  SER  48           HB2      SER  48  22.273 -26.875 -14.743
  365    HB3  SER  48           HB3      SER  48  23.159 -28.406 -14.711
  366    HG   SER  48           HG       SER  48  21.849 -28.212 -16.593
  367    HA   PRO  49           HA       PRO  49  23.915 -27.941  -9.869
  368    HB2  PRO  49           HB2      PRO  49  25.737 -29.923  -9.612
  369    HB3  PRO  49           HB3      PRO  49  23.992 -30.230  -9.419
  370    HG2  PRO  49           HG2      PRO  49  25.649 -30.639 -11.940
  371    HG3  PRO  49           HG3      PRO  49  24.570 -31.824 -11.124
  372    HD2  PRO  49           HD2      PRO  49  23.713 -30.275 -13.210
  373    HD3  PRO  49           HD3      PRO  49  22.630 -30.713 -11.856
  374    H    THR  50           H        THR  50  24.364 -26.263 -11.859
  375    HA   THR  50           HA       THR  50  27.278 -25.849 -12.034
  376    HB   THR  50           HB       THR  50  27.032 -25.364 -14.510
  377    HG1  THR  50           HG1      THR  50  25.274 -26.400 -15.542
  378   HG21  THR  50          1HG2      THR  50  27.283 -27.625 -15.269
  379   HG22  THR  50          2HG2      THR  50  26.481 -28.280 -13.820
  380   HG23  THR  50          3HG2      THR  50  28.067 -27.480 -13.687
  381    H    ASP  51           H        ASP  51  27.880 -23.801 -12.893
  382    HA   ASP  51           HA       ASP  51  26.243 -21.582 -11.971
  383    HB2  ASP  51           HB2      ASP  51  28.678 -21.604 -11.764
  384    HB3  ASP  51           HB3      ASP  51  28.857 -21.672 -13.523
  385    HA   PRO  52           HA       PRO  52  23.931 -21.131 -15.751
  386    HB2  PRO  52           HB2      PRO  52  23.209 -18.414 -15.611
  387    HB3  PRO  52           HB3      PRO  52  22.400 -19.761 -14.783
  388    HG2  PRO  52           HG2      PRO  52  24.463 -17.868 -13.686
  389    HG3  PRO  52           HG3      PRO  52  22.995 -18.502 -12.889
  390    HD2  PRO  52           HD2      PRO  52  25.457 -19.509 -12.383
  391    HD3  PRO  52           HD3      PRO  52  24.032 -20.587 -12.458
  392    H    PHE  53           H        PHE  53  26.674 -18.889 -15.326
  393    HA   PHE  53           HA       PHE  53  26.649 -18.332 -18.273
  394    HB2  PHE  53           HB2      PHE  53  27.704 -16.738 -15.920
  395    HB3  PHE  53           HB3      PHE  53  28.014 -16.339 -17.602
  396    HD1  PHE  53           HD2      PHE  53  26.196 -15.616 -19.125
  397    HD2  PHE  53           HD1      PHE  53  25.488 -16.329 -14.937
  398    HE1  PHE  53           HE2      PHE  53  24.054 -14.387 -19.280
  399    HE2  PHE  53           HE1      PHE  53  23.314 -15.131 -15.096
  400    HZ   PHE  53           HZ       PHE  53  22.606 -14.156 -17.278
  401    H    ASN  54           H        ASN  54  28.617 -19.644 -15.678
  402    HA   ASN  54           HA       ASN  54  31.008 -19.841 -17.461
  403    HB2  ASN  54           HB2      ASN  54  30.636 -20.373 -14.485
  404    HB3  ASN  54           HB3      ASN  54  32.151 -20.507 -15.373
  405   HD21  ASN  54          1HD2      ASN  54  29.674 -18.198 -14.233
  406   HD22  ASN  54          2HD2      ASN  54  30.724 -16.779 -14.376
  407    H    ARG  55           H        ARG  55  28.526 -21.869 -15.971
  408    HA   ARG  55           HA       ARG  55  28.020 -24.028 -16.008
  409    HB2  ARG  55           HB2      ARG  55  29.337 -23.799 -18.716
  410    HB3  ARG  55           HB3      ARG  55  28.678 -25.320 -18.140
  411    HG2  ARG  55           HG2      ARG  55  26.953 -24.385 -19.405
  412    HG3  ARG  55           HG3      ARG  55  26.483 -24.257 -17.721
  413    HD2  ARG  55           HD2      ARG  55  25.807 -22.276 -18.870
  414    HD3  ARG  55           HD3      ARG  55  27.097 -21.828 -17.752
  415    HE   ARG  55           HE       ARG  55  28.491 -22.283 -20.051
  416   HH11  ARG  55          1HH1      ARG  55  25.639 -20.255 -19.482
  417   HH12  ARG  55          2HH1      ARG  55  25.947 -19.303 -20.916
  418   HH21  ARG  55          1HH2      ARG  55  28.853 -20.958 -21.820
  419   HH22  ARG  55          2HH2      ARG  55  27.758 -19.654 -22.163
  420    H    GLN  56           H        GLN  56  30.607 -23.283 -14.722
  421    HA   GLN  56           HA       GLN  56  32.062 -25.838 -14.531
  422    HB2  GLN  56           HB2      GLN  56  33.124 -24.851 -12.593
  423    HB3  GLN  56           HB3      GLN  56  33.216 -23.728 -13.944
  424    HG2  GLN  56           HG2      GLN  56  31.666 -22.227 -12.953
  425    HG3  GLN  56           HG3      GLN  56  30.998 -23.441 -11.876
  426   HE21  GLN  56          1HE2      GLN  56  32.210 -24.099  -9.958
  427   HE22  GLN  56          2HE2      GLN  56  33.502 -23.059  -9.361
  428    H    MET  57           H        MET  57  32.028 -27.115 -12.513
  429    HA   MET  57           HA       MET  57  29.465 -27.874 -11.506
  430    HB2  MET  57           HB2      MET  57  31.455 -29.307 -11.447
  431    HB3  MET  57           HB3      MET  57  32.267 -28.190 -10.355
  432    HG2  MET  57           HG2      MET  57  31.400 -30.159  -9.177
  433    HG3  MET  57           HG3      MET  57  30.746 -28.665  -8.563
  434    HE1  MET  57           HE1      MET  57  28.310 -31.678 -11.133
  435    HE2  MET  57           HE2      MET  57  29.459 -30.571 -11.886
  436    HE3  MET  57           HE3      MET  57  30.043 -31.834 -10.771
  437    H    LEU  58           H        LEU  58  28.263 -27.210  -9.793
  438    HA   LEU  58           HA       LEU  58  29.202 -25.177  -7.904
  439    HB2  LEU  58           HB2      LEU  58  28.335 -24.252 -10.303
  440    HB3  LEU  58           HB3      LEU  58  26.781 -24.428  -9.533
  441    HG   LEU  58           HG       LEU  58  27.528 -22.170  -9.389
  442   HD11  LEU  58          1HD1      LEU  58  27.976 -23.238  -6.587
  443   HD12  LEU  58          2HD1      LEU  58  26.370 -23.066  -7.337
  444   HD13  LEU  58          3HD1      LEU  58  27.394 -21.649  -7.064
  445   HD21  LEU  58          3HD2      LEU  58  29.583 -21.437  -8.310
  446   HD22  LEU  58          1HD2      LEU  58  29.948 -22.546  -9.641
  447   HD23  LEU  58          2HD2      LEU  58  30.049 -23.110  -7.964
  448    H    THR  59           H        THR  59  27.972 -25.087  -6.058
  449    HA   THR  59           HA       THR  59  25.464 -26.648  -5.758
  450    HB   THR  59           HB       THR  59  27.914 -27.069  -3.986
  451    HG1  THR  59           HG1      THR  59  26.778 -28.698  -6.018
  452   HG21  THR  59          1HG2      THR  59  26.609 -29.090  -3.208
  453   HG22  THR  59          2HG2      THR  59  25.204 -28.464  -4.088
  454   HG23  THR  59          3HG2      THR  59  25.901 -27.557  -2.720
  455    H    GLU  60           H        GLU  60  24.272 -26.004  -3.868
  456    HA   GLU  60           HA       GLU  60  24.266 -23.266  -3.244
  457    HB2  GLU  60           HB2      GLU  60  23.167 -25.610  -1.642
  458    HB3  GLU  60           HB3      GLU  60  22.803 -23.914  -1.317
  459    HG2  GLU  60           HG2      GLU  60  21.822 -23.680  -3.587
  460    HG3  GLU  60           HG3      GLU  60  22.119 -25.404  -3.884
  461    H    SER  61           H        SER  61  25.970 -25.905  -1.550
  462    HA   SER  61           HA       SER  61  26.794 -24.517   0.781
  463    HB2  SER  61           HB2      SER  61  28.295 -26.719  -0.702
  464    HB3  SER  61           HB3      SER  61  28.387 -26.320   1.022
  465    HG   SER  61           HG       SER  61  27.017 -28.127   0.638
  466    H    MET  62           H        MET  62  27.898 -24.027  -2.478
  467    HA   MET  62           HA       MET  62  30.572 -23.021  -1.699
  468    HB2  MET  62           HB2      MET  62  29.206 -22.991  -4.421
  469    HB3  MET  62           HB3      MET  62  30.909 -22.711  -4.073
  470    HG2  MET  62           HG2      MET  62  31.139 -25.050  -3.254
  471    HG3  MET  62           HG3      MET  62  29.444 -25.337  -3.690
  472    HE1  MET  62           HE1      MET  62  31.333 -27.407  -6.403
  473    HE2  MET  62           HE2      MET  62  31.754 -27.198  -4.693
  474    HE3  MET  62           HE3      MET  62  30.058 -27.435  -5.170
  475    H    LEU  63           H        LEU  63  27.445 -21.736  -1.770
  476    HA   LEU  63           HA       LEU  63  28.070 -19.098  -2.903
  477    HB2  LEU  63           HB2      LEU  63  25.581 -20.170  -1.521
  478    HB3  LEU  63           HB3      LEU  63  25.692 -18.677  -2.433
  479    HG   LEU  63           HG       LEU  63  25.926 -21.509  -3.546
  480   HD11  LEU  63          1HD1      LEU  63  23.847 -19.329  -3.974
  481   HD12  LEU  63          2HD1      LEU  63  23.646 -20.783  -2.964
  482   HD13  LEU  63          3HD1      LEU  63  23.845 -20.938  -4.725
  483   HD21  LEU  63          3HD2      LEU  63  27.442 -20.117  -4.875
  484   HD22  LEU  63          1HD2      LEU  63  26.197 -18.847  -5.005
  485   HD23  LEU  63          2HD2      LEU  63  25.971 -20.424  -5.795
  486    H    GLU  64           H        GLU  64  27.889 -17.100  -1.882
  487    HA   GLU  64           HA       GLU  64  27.729 -16.894   1.050
  488    HB2  GLU  64           HB2      GLU  64  30.077 -17.467   0.697
  489    HB3  GLU  64           HB3      GLU  64  30.239 -16.205  -0.531
  490    HG2  GLU  64           HG2      GLU  64  29.845 -14.471   1.192
  491    HG3  GLU  64           HG3      GLU  64  29.624 -15.724   2.416
  492    HA   PRO  65           HA       PRO  65  25.802 -13.224  -0.767
  493    HB2  PRO  65           HB2      PRO  65  24.849 -11.974   1.467
  494    HB3  PRO  65           HB3      PRO  65  24.136 -13.474   0.796
  495    HG2  PRO  65           HG2      PRO  65  26.153 -13.243   3.062
  496    HG3  PRO  65           HG3      PRO  65  24.619 -14.178   3.033
  497    HD2  PRO  65           HD2      PRO  65  27.020 -15.325   2.505
  498    HD3  PRO  65           HD3      PRO  65  25.547 -15.824   1.618
  499    H    VAL  66           H        VAL  66  26.494 -11.192  -1.298
  500    HA   VAL  66           HA       VAL  66  29.086 -10.318  -0.203
  501    HB   VAL  66           HB       VAL  66  27.530  -9.146  -2.527
  502   HG11  VAL  66          1HG1      VAL  66  30.419  -8.755  -1.603
  503   HG12  VAL  66          2HG1      VAL  66  29.745  -8.153  -3.123
  504   HG13  VAL  66          3HG1      VAL  66  29.139  -7.523  -1.588
  505   HG21  VAL  66          3HG2      VAL  66  29.883 -11.060  -2.498
  506   HG22  VAL  66          1HG2      VAL  66  28.217 -11.489  -2.973
  507   HG23  VAL  66          2HG2      VAL  66  29.150 -10.328  -3.939
  508    HA   PRO  67           HA       PRO  67  26.807  -7.132   2.142
  509    HB2  PRO  67           HB2      PRO  67  28.796  -6.365   3.869
  510    HB3  PRO  67           HB3      PRO  67  27.988  -7.962   4.005
  511    HG2  PRO  67           HG2      PRO  67  30.647  -7.309   2.694
  512    HG3  PRO  67           HG3      PRO  67  30.271  -8.629   3.840
  513    HD2  PRO  67           HD2      PRO  67  30.314  -8.986   1.089
  514    HD3  PRO  67           HD3      PRO  67  29.236  -9.901   2.167
  515    H    GLU  68           H        GLU  68  30.070  -6.430   0.717
  516    HA   GLU  68           HA       GLU  68  29.772  -3.622   0.978
  517    HB2  GLU  68           HB2      GLU  68  31.637  -3.414  -0.540
  518    HB3  GLU  68           HB3      GLU  68  31.924  -4.634   0.694
  519    HG2  GLU  68           HG2      GLU  68  31.423  -6.429  -0.972
  520    HG3  GLU  68           HG3      GLU  68  31.170  -5.199  -2.216
  521    H    LEU  69           H        LEU  69  28.630  -5.777  -1.581
  522    HA   LEU  69           HA       LEU  69  27.706  -3.566  -3.293
  523    HB2  LEU  69           HB2      LEU  69  27.280  -6.574  -3.363
  524    HB3  LEU  69           HB3      LEU  69  26.559  -5.455  -4.530
  525    HG   LEU  69           HG       LEU  69  29.554  -5.838  -4.121
  526   HD11  LEU  69          1HD1      LEU  69  28.444  -7.829  -5.082
  527   HD12  LEU  69          2HD1      LEU  69  29.448  -7.008  -6.293
  528   HD13  LEU  69          3HD1      LEU  69  27.686  -6.813  -6.318
  529   HD21  LEU  69          3HD2      LEU  69  29.106  -3.574  -4.962
  530   HD22  LEU  69          1HD2      LEU  69  27.991  -4.217  -6.179
  531   HD23  LEU  69          2HD2      LEU  69  29.735  -4.580  -6.264
  532    H    LYS  70           H        LYS  70  26.117  -5.886  -1.007
  533    HA   LYS  70           HA       LYS  70  23.495  -4.834  -1.401
  534    HB2  LYS  70           HB2      LYS  70  23.897  -6.967  -0.352
  535    HB3  LYS  70           HB3      LYS  70  24.732  -6.202   1.016
  536    HG2  LYS  70           HG2      LYS  70  22.688  -5.104   1.742
  537    HG3  LYS  70           HG3      LYS  70  21.821  -5.598   0.285
  538    HD2  LYS  70           HD2      LYS  70  22.929  -7.595   2.305
  539    HD3  LYS  70           HD3      LYS  70  21.309  -6.887   2.403
  540    HE2  LYS  70           HE2      LYS  70  20.815  -7.703   0.104
  541    HE3  LYS  70           HE3      LYS  70  22.372  -8.540   0.077
  542    HZ1  LYS  70           HZ1      LYS  70  21.626  -9.906   1.910
  543    HZ2  LYS  70           HZ2      LYS  70  20.446  -9.937   0.765
  544    HZ3  LYS  70           HZ3      LYS  70  20.252  -9.034   2.104
  545    H    GLU  71           H        GLU  71  26.020  -3.818   0.902
  546    HA   GLU  71           HA       GLU  71  24.520  -1.783   2.225
  547    HB2  GLU  71           HB2      GLU  71  26.586  -2.840   3.069
  548    HB3  GLU  71           HB3      GLU  71  27.528  -2.009   1.811
  549    HG2  GLU  71           HG2      GLU  71  26.939   0.176   2.766
  550    HG3  GLU  71           HG3      GLU  71  25.830  -0.579   3.914
  551    H    GLN  72           H        GLN  72  26.463  -1.722  -0.761
  552    HA   GLN  72           HA       GLN  72  26.113   1.170  -1.184
  553    HB2  GLN  72           HB2      GLN  72  27.058  -1.109  -2.950
  554    HB3  GLN  72           HB3      GLN  72  26.824   0.515  -3.572
  555    HG2  GLN  72           HG2      GLN  72  28.635  -0.088  -1.199
  556    HG3  GLN  72           HG3      GLN  72  29.192  -0.029  -2.873
  557   HE21  GLN  72          1HE2      GLN  72  28.939   2.102  -4.058
  558   HE22  GLN  72          2HE2      GLN  72  28.918   3.574  -3.100
  559    H    ILE  73           H        ILE  73  24.388  -1.729  -2.393
  560    HA   ILE  73           HA       ILE  73  22.542  -0.365  -4.073
  561    HB   ILE  73           HB       ILE  73  22.495  -3.007  -2.604
  562   HG12  ILE  73          2HG1      ILE  73  22.498  -2.362  -5.583
  563   HG13  ILE  73          3HG1      ILE  73  23.969  -2.539  -4.639
  564   HG21  ILE  73          1HG2      ILE  73  20.439  -3.607  -3.917
  565   HG22  ILE  73          2HG2      ILE  73  20.125  -2.397  -2.685
  566   HG23  ILE  73          3HG2      ILE  73  20.279  -1.891  -4.385
  567   HD11  ILE  73          3HD1      ILE  73  23.570  -4.602  -5.795
  568   HD12  ILE  73          1HD1      ILE  73  23.323  -4.875  -4.063
  569   HD13  ILE  73          2HD1      ILE  73  21.923  -4.720  -5.158
  570    H    GLN  74           H        GLN  74  22.114  -1.265  -0.596
  571    HA   GLN  74           HA       GLN  74  19.522  -0.074  -0.456
  572    HB2  GLN  74           HB2      GLN  74  19.666  -0.394   1.935
  573    HB3  GLN  74           HB3      GLN  74  20.298  -1.793   1.094
  574    HG2  GLN  74           HG2      GLN  74  21.861  -1.560   2.786
  575    HG3  GLN  74           HG3      GLN  74  22.643  -0.735   1.467
  576   HE21  GLN  74          1HE2      GLN  74  23.844   0.924   2.409
  577   HE22  GLN  74          2HE2      GLN  74  23.217   1.989   3.663
  578    H    ALA  75           H        ALA  75  22.730   1.398  -0.019
  579    HA   ALA  75           HA       ALA  75  21.755   3.942   0.964
  580    HB1  ALA  75           HB1      ALA  75  24.004   4.721   0.312
  581    HB2  ALA  75           HB2      ALA  75  24.112   3.194   1.195
  582    HB3  ALA  75           HB3      ALA  75  24.294   3.207  -0.563
  583    H    TRP  76           H        TRP  76  22.464   2.701  -2.359
  584    HA   TRP  76           HA       TRP  76  21.724   5.127  -3.707
  585    HB2  TRP  76           HB2      TRP  76  23.127   3.398  -4.716
  586    HB3  TRP  76           HB3      TRP  76  21.815   2.233  -4.652
  587    HD1  TRP  76           HD1      TRP  76  22.972   5.346  -6.546
  588    HE1  TRP  76           HE1      TRP  76  21.595   5.648  -8.691
  589    HE3  TRP  76           HE3      TRP  76  19.556   1.589  -5.854
  590    HZ2  TRP  76           HZ2      TRP  76  19.244   4.467  -9.906
  591    HZ3  TRP  76           HZ3      TRP  76  17.751   1.221  -7.502
  592    HH2  TRP  76           HH2      TRP  76  17.566   2.666  -9.526
  593    H    MET  77           H        MET  77  19.780   2.171  -2.933
  594    HA   MET  77           HA       MET  77  17.329   3.062  -4.125
  595    HB2  MET  77           HB2      MET  77  17.860   1.258  -1.736
  596    HB3  MET  77           HB3      MET  77  16.257   1.517  -2.431
  597    HG2  MET  77           HG2      MET  77  16.978   0.590  -4.577
  598    HG3  MET  77           HG3      MET  77  18.634   0.451  -3.999
  599    HE1  MET  77           HE1      MET  77  15.185  -1.184  -4.290
  600    HE2  MET  77           HE2      MET  77  15.089  -2.270  -2.897
  601    HE3  MET  77           HE3      MET  77  15.026  -0.514  -2.648
  602    H    ARG  78           H        ARG  78  18.637   3.700  -0.837
  603    HA   ARG  78           HA       ARG  78  16.398   5.287   0.010
  604    HB2  ARG  78           HB2      ARG  78  18.096   4.184   1.472
  605    HB3  ARG  78           HB3      ARG  78  19.262   5.449   1.012
  606    HG2  ARG  78           HG2      ARG  78  17.694   7.161   1.920
  607    HG3  ARG  78           HG3      ARG  78  16.546   5.893   2.363
  608    HD2  ARG  78           HD2      ARG  78  19.366   6.226   3.480
  609    HD3  ARG  78           HD3      ARG  78  17.877   6.710   4.280
  610    HE   ARG  78           HE       ARG  78  17.275   4.453   4.636
  611   HH11  ARG  78          1HH1      ARG  78  20.518   4.609   3.176
  612   HH12  ARG  78          2HH1      ARG  78  20.783   2.903   3.509
  613   HH21  ARG  78          1HH2      ARG  78  17.807   2.287   5.051
  614   HH22  ARG  78          2HH2      ARG  78  19.359   1.688   4.512
  615    H    GLU  79           H        GLU  79  19.487   6.227  -1.600
  616    HA   GLU  79           HA       GLU  79  18.998   9.031  -1.618
  617    HB2  GLU  79           HB2      GLU  79  21.175   7.892  -2.048
  618    HB3  GLU  79           HB3      GLU  79  20.578   7.388  -3.634
  619    HG2  GLU  79           HG2      GLU  79  20.348   9.743  -4.320
  620    HG3  GLU  79           HG3      GLU  79  20.819  10.273  -2.694
  621    H    LYS  80           H        LYS  80  17.769   6.477  -3.804
  622    HA   LYS  80           HA       LYS  80  16.490   8.315  -5.659
  623    HB2  LYS  80           HB2      LYS  80  16.139   5.358  -5.024
  624    HB3  LYS  80           HB3      LYS  80  15.238   6.168  -6.282
  625    HG2  LYS  80           HG2      LYS  80  18.269   5.958  -6.230
  626    HG3  LYS  80           HG3      LYS  80  17.205   4.853  -7.088
  627    HD2  LYS  80           HD2      LYS  80  17.444   7.847  -7.666
  628    HD3  LYS  80           HD3      LYS  80  18.219   6.547  -8.571
  629    HE2  LYS  80           HE2      LYS  80  15.987   5.567  -9.105
  630    HE3  LYS  80           HE3      LYS  80  15.212   6.932  -8.284
  631    HZ1  LYS  80           HZ1      LYS  80  15.340   7.378 -10.630
  632    HZ2  LYS  80           HZ2      LYS  80  16.948   7.098 -10.694
  633    HZ3  LYS  80           HZ3      LYS  80  16.365   8.405  -9.882
  634    H    GLN  81           H        GLN  81  15.579   7.185  -2.491
  635    HA   GLN  81           HA       GLN  81  12.730   8.013  -2.793
  636    HB2  GLN  81           HB2      GLN  81  14.344   6.940  -0.439
  637    HB3  GLN  81           HB3      GLN  81  12.656   7.426  -0.347
  638    HG2  GLN  81           HG2      GLN  81  11.986   5.698  -1.900
  639    HG3  GLN  81           HG3      GLN  81  13.660   5.238  -2.215
  640   HE21  GLN  81          1HE2      GLN  81  11.096   5.282   0.323
  641   HE22  GLN  81          2HE2      GLN  81  11.842   4.000   1.284
  642    H    SER  82           H        SER  82  15.661   9.079  -0.952
  643    HA   SER  82           HA       SER  82  14.866  11.860  -0.898
  644    HB2  SER  82           HB2      SER  82  14.414  12.070   1.483
  645    HB3  SER  82           HB3      SER  82  13.229  11.024   0.705
  646    HG   SER  82           HG       SER  82  13.960  10.147   2.695
  647    H    SER  83           H        SER  83  16.331  11.904   1.870
  648    HA   SER  83           HA       SER  83  18.393  12.196   2.748
  649    HB2  SER  83           HB2      SER  83  19.453  10.427   0.513
  650    HB3  SER  83           HB3      SER  83  20.338  10.956   1.946
  651    HG   SER  83           HG       SER  83  17.902   9.473   2.016
  652    H    ASP  84           H        ASP  84  18.343  12.735  -0.755
  653    HA   ASP  84           HA       ASP  84  20.154  15.083  -0.511
  654    HB2  ASP  84           HB2      ASP  84  20.436  13.625  -2.453
  655    HB3  ASP  84           HB3      ASP  84  18.742  13.857  -2.910
  656    H    HIS  85           H        HIS  85  19.397  17.071  -0.165
  657    HA   HIS  85           HA       HIS  85  16.574  17.816  -0.706
  658    HB2  HIS  85           HB2      HIS  85  17.958  17.987   2.010
  659    HB3  HIS  85           HB3      HIS  85  16.410  18.735   1.607
  660    HD1  HIS  85           HD1      HIS  85  14.363  16.909   1.041
  661    HD2  HIS  85           HD2      HIS  85  17.901  15.487   2.825
  662    HE1  HIS  85           HE1      HIS  85  13.809  14.604   1.995