*HEADER    REGULATORY PROTEIN                      12-DEC-94   1PFL    
*COMPND    PROFILIN I (NMR, 20 STRUCTURES)                             
*SOURCE    PROFILIN I: HUMAN (HOMO SAPIENS)                            
*SOURCE   2 EXPRESSION SYSTEM: (ESCHERICHIA COLI)                      
*SOURCE   3 STRAIN BL-21                                               
*SOURCE   4 PLASMID: PGPR-HUI (GENE IS UNDER CONTROL OF TRC PROMOTER)  
*SOURCE   5 THE PLASMID PGPR-HUI IS A DERIVATIVE OF PGTL-1             
*SOURCE   6 GENE: HUMAN PROFILIN CDNA                                  
*AUTHOR    W.J.METZLER,B.T.FARMER II,K.L.CONSTANTINE,M.S.FRIEDRICHS,   
*AUTHOR   2 T.LAVOIE,L.MUELLER                                         
*REVDAT   1   31-MAR-95 1PFL    0                                      


! NOE RESTRAINTS FOR HUMAN PROFILIN I
!
  assign (resid   2 and name HA* ) (resid   3 and name HN  ) 1.8 0.0 1.2 ! 82
  assign (resid   2 and name HA* ) (resid   4 and name HN  ) 1.8 0.0 2.7 ! 261
  assign (resid   3 and name HA  ) (resid   3 and name HB2 ) 2.2 0.0 0.5 
  assign (resid   3 and name HA  ) (resid   3 and name HD1 ) 2.2 0.0 2.1 ! 
  assign (resid   3 and name HN  ) (resid   4 and name HN  ) 1.8 0.0 2.1 ! 75
  assign (resid   3 and name HB1 ) (resid   4 and name HN  ) 1.8 0.0 1.5 ! 104
  assign (resid   3 and name HN  ) (resid   5 and name HN  ) 3.1 1.3 1.3 
  assign (resid   3 and name HN  ) (resid   6 and name HN  ) 3.4 1.6 1.6 
  assign (resid   3 and name HB* ) (resid   6 and name HN  ) 1.8 0.0 3.8 ! Peak   a
  assign (resid   3 and name HA  ) (resid   6 and name HD* ) 1.8 0.0 0.8 ! 873
  assign (resid   3 and name HA  ) (resid   6 and name HE* ) 1.8 0.0 1.4 ! 473
  assign (resid   3 and name HA  ) (resid  21 and name HD1*) 1.8 0.0 1.7 ! lm 
  assign (resid   3 and name HD1 ) (resid  21 and name HD1*) 1.8 0.0 2.7 ! a   
  assign (resid   3 and name HZ3 ) (resid  21 and name HD1*) 1.8 0.0 2.7 ! a  
  assign (resid   3 and name HE3 ) (resid  21 and name HD1*) 1.8 0.0 2.7 ! a   
  assign (resid   3 and name HZ3 ) (resid  21 and name HG2*) 1.8 0.0 2.7 ! a   
  assign (resid   3 and name HZ2 ) (resid  21 and name HG2*) 1.8 0.0 2.7 ! a   
  assign (resid   3 and name HE3 ) (resid  21 and name HG2*) 1.8 0.0 2.7 ! a   
  assign (resid   3 and name HE1 ) (resid  31 and name HA  ) 1.8 0.0 2.4 ! 1080
  assign (resid   3 and name HZ2 ) (resid  31 and name HZ3 ) 1.8 0.0 1.7 ! lm  
  assign (resid   3 and name HA  ) (resid  32 and name HB* ) 1.8 0.0 1.7 ! lm
  assign (resid   3 and name HB1 ) (resid  32 and name HB* ) 1.8 0.0 1.5 ! 1750,1071
  assign (resid   3 and name HB2 ) (resid  32 and name HB* ) 1.8 0.0 1.3 ! 2614,1073
  assign (resid   3 and name HE3 ) (resid 133 and name HB1 ) 1.8 0.0 2.8 !    
  assign (resid   3 and name HH2 ) (resid 134 and name HA  ) 1.8 0.0 2.2 ! lm
  assign (resid   3 and name HZ3 ) (resid 134 and name HD1*) 1.8 0.0 2.2 !    
  assign (resid   3 and name HZ3 ) (resid 134 and name HD2*) 1.8 0.0 2.2 !    
  assign (resid   3 and name HZ2 ) (resid 134 and name HD2*) 1.8 0.0 2.2 !    
  assign (resid   3 and name HH2 ) (resid 134 and name HD1*) 1.8 0.0 2.2 !    
  assign (resid   4 and name HN  ) (resid   4 and name HB* ) 1.8 0.0 1.3 ! 105
  assign (resid   4 and name HB* ) (resid   4 and name HD2*) 1.8 0.0 2.4 ! 1112
  assign (resid   4 and name HA  ) (resid   5 and name HN  ) 1.8 0.0 1.5 
  assign (resid   4 and name HB* ) (resid   5 and name HN  ) 1.8 0.0 2.3 ! 113
  assign (resid   4 and name HN  ) (resid   5 and name HN  ) 1.8 0.0 1.6 ! 108
  assign (resid   4 and name HN  ) (resid   6 and name HN  ) 1.8 0.0 3.4 ! 99
  assign (resid   4 and name HA  ) (resid   7 and name HN  ) 1.8 0.0 2.4 ! 127
  assign (resid   4 and name HA  ) (resid   7 and name HB  ) 1.8 0.0 1.1 ! 791,1198
  assign (resid   4 and name HA  ) (resid   7 and name HG1*) 1.8 0.0 1.2 ! 792,985
  assign (resid   4 and name HA  ) (resid   7 and name HG2*) 1.8 0.0 2.2 ! 390
  assign (resid   4 and name HA  ) (resid   7 and name HD1*) 1.8 0.0 2.5 ! 391,986
  assign (resid   4 and name HB* ) (resid   7 and name HG2*) 1.8 0.0 3.2 ! lm 
  assign (resid   4 and name HN  ) (resid  32 and name HB* ) 1.8 0.0 2.8 ! 106
  assign (resid   4 and name HA  ) (resid  32 and name HB* ) 1.8 0.0 1.6 ! 3057
  assign (resid   5 and name HN  ) (resid   5 and name HB* ) 1.8 0.0 1.1 ! 114
  assign (resid   5 and name HN  ) (resid   6 and name HN  ) 1.8 0.0 1.2 ! 109
  assign (resid   5 and name HB* ) (resid   6 and name HN  ) 1.8 0.0 1.9 ! 123
  assign (resid   5 and name HN  ) (resid   7 and name HN  ) 3.0 1.2 1.2 
  assign (resid   5 and name HA  ) (resid   8 and name HB1 ) 1.8 0.0 1.6 ! 2147,824
  assign (resid   5 and name HA  ) (resid   8 and name HB2 ) 1.8 0.0 0.9 ! 823
  assign (resid   5 and name HA  ) (resid   8 and name HN  ) 2.7 0.9 0.9 ! 146
  assign (resid   5 and name HB* ) (resid   8 and name HB2 ) 1.8 0.0 1.7 ! lm
  assign (resid   5 and name HA  ) (resid   9 and name HN  ) 1.8 0.0 3.2 
  assign (resid   6 and name HN  ) (resid   6 and name HB* ) 1.8 0.0 1.2 ! 122
  assign (resid   6 and name HA  ) (resid   6 and name HB* ) 2.2 0.0 0.3 
  assign (resid   6 and name HA  ) (resid   6 and name HD* ) 1.8 0.0 1.0 ! 64 a,605
  assign (resid   6 and name HN  ) (resid   7 and name HN  ) 2.3 0.5 0.5 
  assign (resid   6 and name HA  ) (resid   7 and name HN  ) 1.8 0.0 1.5 
  assign (resid   6 and name HB* ) (resid   7 and name HN  ) 1.8 0.0 2.3 ! 129
  assign (resid   6 and name HD* ) (resid   7 and name HN  ) 1.8 0.0 2.2 ! 126
  assign (resid   6 and name HN  ) (resid   8 and name HN  ) 1.8 0.0 3.5 ! 118
  assign (resid   6 and name HA  ) (resid   9 and name HN  ) 2.8 1.0 1.0 
  assign (resid   6 and name HA  ) (resid   9 and name HB* ) 1.8 0.0 1.1 ! 1885,728
  assign (resid   6 and name HN  ) (resid   9 and name HD2*) 1.8 0.0 7.0 ! 742
  assign (resid   6 and name HN  ) (resid  21 and name HD1*) 1.8 0.0 2.2 ! 124
  assign (resid   6 and name HB* ) (resid  21 and name HD1*) 1.8 0.0 1.9 ! 1659,1247
  assign (resid   6 and name HD* ) (resid  21 and name HD1*) 1.8 0.0 2.5 ! 3828
  assign (resid   6 and name HE* ) (resid  21 and name HD1*) 1.8 0.0 2.7 ! a
  assign (resid   6 and name HB* ) (resid  32 and name HB* ) 1.8 0.0 2.5 ! lm
  assign (resid   6 and name HA  ) (resid 130 and name HG* ) 1.8 0.0 2.7 ! lm
  assign (resid   6 and name HA  ) (resid 130 and name HE* ) 1.8 0.0 2.7 ! lm
  assign (resid   6 and name HB* ) (resid 130 and name HE* ) 1.8 0.0 2.7 ! lm
  assign (resid   6 and name HD* ) (resid 130 and name HE* ) 1.8 0.0 2.7 ! 131a
  assign (resid   6 and name HD* ) (resid 134 and name HD* ) 1.8 0.0 2.7 ! 873
  assign (resid   6 and name HE* ) (resid 134 and name HD* ) 1.8 0.0 2.7 ! 874
  assign (resid   7 and name HN  ) (resid   7 and name HB  ) 1.8 0.0 1.5 ! 130
  assign (resid   7 and name HN  ) (resid   7 and name HG1*) 1.8 0.0 1.4 ! 131,133
  assign (resid   7 and name HN  ) (resid   7 and name HG2*) 1.8 0.0 2.4 ! 134
  assign (resid   7 and name HN  ) (resid   7 and name HD1*) 1.8 0.0 2.3 ! 135
  assign (resid   7 and name HA  ) (resid   7 and name HG2*) 1.8 0.0 0.6 ! 264
  assign (resid   7 and name HA  ) (resid   7 and name HD1*) 1.8 0.0 0.7 ! 124
  assign (resid   7 and name HB  ) (resid   7 and name HG1*) 1.8 0.0 1.2 ! 1242
  assign (resid   7 and name HB  ) (resid   7 and name HG2*) 1.8 0.0 0.7 ! 1244
  assign (resid   7 and name HB  ) (resid   7 and name HD1*) 1.8 0.0 1.3 ! 1245
  assign (resid   7 and name HG1*) (resid   7 and name HD1*) 1.8 0.0 0.9 ! 1268
  assign (resid   7 and name HG2*) (resid   7 and name HD1*) 1.8 0.0 0.2 ! 1417
  assign (resid   7 and name HN  ) (resid   8 and name HN  ) 1.8 0.0 1.3 ! 125
  assign (resid   7 and name HA  ) (resid   8 and name HN  ) 2.7 0.9 0.9 
  assign (resid   7 and name HB  ) (resid   8 and name HN  ) 1.8 0.0 1.3 ! 149
  assign (resid   7 and name HG2*) (resid   8 and name HN  ) 1.8 0.0 2.7 ! 153
  assign (resid   7 and name HG2*) (resid   8 and name HA  ) 1.8 0.0 1.9 ! 1158
  assign (resid   7 and name HN  ) (resid   9 and name HN  ) 3.0 1.2 1.2 
  assign (resid   7 and name HA  ) (resid  10 and name HN  ) 3.0 1.2 1.2 
  assign (resid   7 and name HA  ) (resid  10 and name HB* ) 1.8 0.0 2.2 !     
  assign (resid   7 and name HA  ) (resid  10 and name HD* ) 1.8 0.0 2.0 ! 1333
  assign (resid   7 and name HG2*) (resid  10 and name HD* ) 1.8 0.0 2.4 ! 4386
  assign (resid   7 and name HG1*) (resid  10 and name HD* ) 1.8 0.0 1.4 ! 2309
  assign (resid   7 and name HD1*) (resid  10 and name HD* ) 1.8 0.0 2.9 ! 4667
  assign (resid   7 and name HG2*) (resid  11 and name HN  ) 1.8 0.0 2.6 ! 171
  assign (resid   7 and name HG2*) (resid  11 and name HG* ) 1.8 0.0 2.2 ! 2094
  assign (resid   7 and name HA  ) (resid  19 and name HB* ) 1.8 0.0 2.3 ! 3524
  assign (resid   7 and name HB  ) (resid  19 and name HB* ) 1.8 0.0 3.4 ! 2022
  assign (resid   7 and name HG2*) (resid  19 and name HB* ) 1.8 0.0 2.1 ! 3688
  assign (resid   7 and name HD1*) (resid  19 and name HB* ) 1.8 0.0 1.9 ! 3317
  assign (resid   7 and name HD1*) (resid  20 and name HA  ) 1.8 0.0 2.4 ! 141
  assign (resid   7 and name HD1*) (resid  20 and name HB* ) 1.8 0.0 2.6 ! 3314
  assign (resid   7 and name HD1*) (resid  21 and name HN  ) 1.8 0.0 1.5 ! 246
  assign (resid   7 and name HD1*) (resid  21 and name HB  ) 1.8 0.0 3.2 ! 2709
  assign (resid   7 and name HD1*) (resid  21 and name HG1*) 1.8 0.0 2.0 ! 4610
  assign (resid   7 and name HD1*) (resid  21 and name HD1*) 1.8 0.0 2.1 ! 3327
  assign (resid   7 and name HN  ) (resid  32 and name HB* ) 1.8 0.0 3.6 ! 132
  assign (resid   7 and name HB  ) (resid  32 and name HB* ) 1.8 0.0 2.5 ! 3137
  assign (resid   7 and name HG1*) (resid  32 and name HA  ) 1.8 0.0 1.9 ! lm
  assign (resid   7 and name HG1*) (resid  32 and name HB* ) 1.8 0.0 1.9 ! 3440
  assign (resid   7 and name HG2*) (resid  32 and name HB* ) 1.8 0.0 2.1 ! 3010
  assign (resid   7 and name HD1*) (resid  32 and name HA  ) 1.8 0.0 2.2 ! lm
  assign (resid   7 and name HD1*) (resid  32 and name HB* ) 1.8 0.0 1.5 ! 4721
  assign (resid   7 and name HG2*) (resid  33 and name HA  ) 1.8 0.0 3.1 ! 75
  assign (resid   7 and name HD1*) (resid  33 and name HA  ) 1.8 0.0 2.0 ! 42
  assign (resid   7 and name HG2*) (resid  34 and name HA  ) 1.8 0.0 2.6 ! 1123
  assign (resid   7 and name HG2*) (resid  34 and name HN  ) 1.8 0.0 2.4 ! 367
  assign (resid   7 and name HB  ) (resid  34 and name HG2*) 1.8 0.0 2.6 ! lm  
  assign (resid   7 and name HG2*) (resid  34 and name HG2*) 1.8 0.0 2.3 ! 4162
  assign (resid   7 and name HD1*) (resid  34 and name HG2*) 1.8 0.0 1.7 ! lm
  assign (resid   8 and name HN  ) (resid   8 and name HB2 ) 1.8 0.0 1.0 ! 148
  assign (resid   8 and name HA  ) (resid   8 and name HB1 ) 2.2 0.0 0.6 
  assign (resid   8 and name HA  ) (resid   8 and name HB2 ) 2.2 0.0 0.6 
  assign (resid   8 and name HN  ) (resid   9 and name HN  ) 1.8 0.0 0.9 ! 139
  assign (resid   8 and name HA  ) (resid   9 and name HN  ) 1.8 0.0 1.4 ! 157
  assign (resid   8 and name HA  ) (resid  11 and name HN  ) 1.8 0.0 2.2 
  assign (resid   8 and name HA  ) (resid  11 and name HB* ) 1.8 0.0 2.3 ! 2445
  assign (resid   8 and name HA  ) (resid  11 and name HG* ) 1.8 0.0 1.1 ! 865
  assign (resid   9 and name HN  ) (resid   9 and name HB1 ) 1.8 0.0 0.7 ! 158
  assign (resid   9 and name HN  ) (resid   9 and name HB2 ) 1.8 0.0 1.4 ! 159
  assign (resid   9 and name HA  ) (resid   9 and name HD2*) 1.8 0.0 2.8 ! 1135,1135
  assign (resid   9 and name HB1 ) (resid   9 and name HD2*) 1.8 0.0 2.2 ! 1136,1140
  assign (resid   9 and name HN  ) (resid  10 and name HN  ) 2.3 0.5 0.5 
  assign (resid   9 and name HA  ) (resid  10 and name HN  ) 1.8 0.0 1.4 ! 84
  assign (resid   9 and name HB1 ) (resid  10 and name HN  ) 1.8 0.0 1.3 ! 89
  assign (resid   9 and name HB2 ) (resid  10 and name HN  ) 1.8 0.0 1.8 ! 90
  assign (resid   9 and name HA  ) (resid  11 and name HN  ) 1.8 0.0 2.2 
  assign (resid   9 and name HB* ) (resid  11 and name HN  ) 1.8 0.0 3.8 ! 986
  assign (resid   9 and name HN  ) (resid  12 and name HB* ) 1.8 0.0 3.0 ! 951
  assign (resid   9 and name HA  ) (resid  12 and name HN  ) 1.8 0.0 2.0 ! 176
  assign (resid   9 and name HA  ) (resid  12 and name HB* ) 1.8 0.0 0.8 ! 991,790
  assign (resid   9 and name HB* ) (resid  12 and name HB* ) 1.8 0.0 2.5 ! 2171
  assign (resid   9 and name HA  ) (resid  13 and name HN  ) 1.8 0.0 2.7 ! 132
  assign (resid   9 and name HD2*) (resid  19 and name HA  ) 1.8 0.0 2.6 ! 589
  assign (resid   9 and name HD2*) (resid  19 and name HB* ) 1.8 0.0 2.1 ! 519
  assign (resid   9 and name HD2*) (resid 112 and name HA  ) 1.8 0.0 1.9 ! 632
  assign (resid   9 and name HD2*) (resid 112 and name HD* ) 1.8 0.0 2.2 ! 511
  assign (resid   9 and name HD2*) (resid 113 and name HN  ) 1.8 0.0 3.1 ! 857
  assign (resid   9 and name HB* ) (resid 130 and name HE* ) 1.8 0.0 2.7 ! a  
  assign (resid  10 and name HN  ) (resid  10 and name HB* ) 1.8 0.0 0.8 ! 91
  assign (resid  10 and name HN  ) (resid  10 and name HD* ) 1.8 0.0 1.6 ! 94
  assign (resid  10 and name HA  ) (resid  10 and name HD* ) 1.8 0.0 0.6 ! 196
  assign (resid  10 and name HB* ) (resid  10 and name HD* ) 1.8 0.0 0.4 ! 1295
  assign (resid  10 and name HG  ) (resid  10 and name HD* ) 1.8 0.0 0.8 ! 2250
  assign (resid  10 and name HN  ) (resid  11 and name HN  ) 1.8 0.0 1.0 ! 163
  assign (resid  10 and name HA  ) (resid  11 and name HN  ) 2.5 0.8 0.8 
  assign (resid  10 and name HN  ) (resid  12 and name HN  ) 3.0 1.2 1.2 ! 1198
  assign (resid  10 and name HA  ) (resid  13 and name HN  ) 1.8 0.0 2.3 ! 184
  assign (resid  10 and name HB* ) (resid  19 and name HB* ) 1.8 0.0 2.9 ! lm   
  assign (resid  10 and name HD* ) (resid  19 and name HB* ) 1.8 0.0 1.6 ! 3380
  assign (resid  10 and name HB* ) (resid  34 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  10 and name HD1*) (resid  34 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  10 and name HD2*) (resid  34 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  10 and name HD* ) (resid 112 and name HD* ) 1.8 0.0 2.1 ! 4028
  assign (resid  10 and name HD1*) (resid 130 and name HG* ) 1.8 0.0 2.4 ! lm 
  assign (resid  10 and name HD2*) (resid 130 and name HG* ) 1.8 0.0 2.4 ! lm 
  assign (resid  10 and name HD1*) (resid 130 and name HE* ) 1.8 0.0 2.2 ! lm 
  assign (resid  10 and name HD2*) (resid 130 and name HE* ) 1.8 0.0 2.2 ! lm 
  assign (resid  11 and name HN  ) (resid  11 and name HB* ) 1.8 0.0 1.2 ! 169
  assign (resid  11 and name HN  ) (resid  11 and name HG* ) 1.8 0.0 1.4 ! 168,167
  assign (resid  11 and name HA  ) (resid  11 and name HG* ) 1.8 0.0 1.2 ! 831
  assign (resid  11 and name HN  ) (resid  12 and name HN  ) 1.8 0.0 1.1 ! 173
  assign (resid  11 and name HB* ) (resid  12 and name HN  ) 1.8 0.0 2.1 ! 178
  assign (resid  11 and name HN  ) (resid  13 and name HN  ) 3.0 1.2 1.2 ! 1171
  assign (resid  11 and name HE* ) (resid  17 and name HA  ) 1.8 0.0 2.7 ! lm
  assign (resid  11 and name HG* ) (resid  34 and name HG1*) 1.8 0.0 2.2 ! lm
  assign (resid  11 and name HG* ) (resid  34 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  11 and name HE* ) (resid  34 and name HG1*) 1.8 0.0 2.7 ! lm
  assign (resid  11 and name HE* ) (resid  34 and name HG2*) 1.8 0.0 2.7 ! lm
  assign (resid  12 and name HN  ) (resid  12 and name HB* ) 1.8 0.0 0.9 ! 179
  assign (resid  12 and name HN  ) (resid  13 and name HN  ) 1.8 0.0 1.2 ! 182
  assign (resid  12 and name HA  ) (resid  13 and name HN  ) 2.5 0.8 0.8 
  assign (resid  12 and name HB* ) (resid  13 and name HN  ) 1.8 0.0 1.6 ! 187
  assign (resid  12 and name HN  ) (resid  14 and name HN  ) 1.8 0.0 2.9 ! 1200
  assign (resid  13 and name HN  ) (resid  13 and name HB1 ) 1.8 0.0 1.5 ! 186
  assign (resid  13 and name HN  ) (resid  13 and name HB2 ) 1.8 0.0 2.1 ! 185
  assign (resid  13 and name HA  ) (resid  13 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  13 and name HA  ) (resid  13 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  13 and name HN  ) (resid  14 and name HN  ) 1.8 0.0 1.4 ! 180
  assign (resid  13 and name HN  ) (resid  15 and name HN  ) 1.8 0.0 2.9 
  assign (resid  13 and name HB2 ) (resid  16 and name HB2 ) 1.8 0.0 3.2 ! 1862
  assign (resid  14 and name HN  ) (resid  14 and name HA* ) 1.8 0.0 1.0 ! 193
  assign (resid  14 and name HN  ) (resid  15 and name HN  ) 1.8 0.0 2.0 ! 190
  assign (resid  14 and name HA* ) (resid  15 and name HN  ) 2.4 0.6 0.6 
  assign (resid  14 and name HA* ) (resid  16 and name HN  ) 1.8 0.0 2.9 
  assign (resid  14 and name HN  ) (resid  16 and name HN  ) 1.8 0.0 3.3 ! 206,189
  assign (resid  15 and name HA  ) (resid  15 and name HG2*) 1.8 0.0 0.5 ! 349
  assign (resid  15 and name HB  ) (resid  15 and name HG2*) 1.8 0.0 0.3 ! 331
  assign (resid  15 and name HN  ) (resid  15 and name HB  ) 1.8 0.0 1.5 ! 201
  assign (resid  15 and name HN  ) (resid  15 and name HG2*) 1.8 0.0 1.9 ! 204
  assign (resid  15 and name HG2*) (resid 118 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  15 and name HG2*) (resid  16 and name HN  ) 1.8 0.0 2.3 ! 215
  assign (resid  15 and name HN  ) (resid  16 and name HN  ) 1.8 0.0 1.6 ! 196
  assign (resid  15 and name HG2*) (resid 112 and name HD* ) 1.8 0.0 2.4 ! 3508
  assign (resid  15 and name HG2*) (resid 118 and name HA  ) 1.8 0.0 1.9 ! 3473
  assign (resid  15 and name HG2*) (resid 118 and name HB  ) 1.8 0.0 1.9 ! 3850
  assign (resid  15 and name HB  ) (resid 122 and name HD* ) 1.8 0.0 2.5 ! 3869
  assign (resid  15 and name HG2*) (resid 122 and name HB* ) 1.8 0.0 2.1 ! 3548
  assign (resid  15 and name HG2*) (resid 122 and name HG  ) 1.8 0.0 2.4 ! 2895
  assign (resid  15 and name HG2*) (resid 122 and name HD* ) 1.8 0.0 0.5 ! 4187,3427,4200
  assign (resid  15 and name HA  ) (resid 123 and name HG1*) 1.8 0.0 2.8 ! 1896
  assign (resid  15 and name HG2*) (resid 123 and name HA  ) 1.8 0.0 2.2 ! lm
  assign (resid  15 and name HG2*) (resid 123 and name HG1*) 1.8 0.0 0.9 ! 3360,3505
  assign (resid  15 and name HG2*) (resid 123 and name HD1*) 1.8 0.0 0.7 ! 4276,3825
  assign (resid  16 and name HN  ) (resid  16 and name HB1 ) 1.8 0.0 1.6 ! 212
  assign (resid  16 and name HN  ) (resid  16 and name HB2 ) 1.8 0.0 1.8 ! 214
  assign (resid  16 and name HA  ) (resid  16 and name HB1 ) 2.2 0.0 0.5 
  assign (resid  16 and name HA  ) (resid  16 and name HB2 ) 2.2 0.0 0.5 
  assign (resid  16 and name HA  ) (resid  17 and name HN  ) 1.8 0.0 1.5 ! 219
  assign (resid  16 and name HB2 ) (resid  17 and name HN  ) 1.8 0.0 2.5 ! 221
  assign (resid  16 and name HA  ) (resid  18 and name HN  ) 1.8 0.0 2.4 ! 225
  assign (resid  16 and name HB2 ) (resid  18 and name HN  ) 1.8 0.0 2.3 ! 228
  assign (resid  16 and name HB* ) (resid  19 and name HB* ) 1.8 0.0 2.4 ! 2298
  assign (resid  16 and name HB* ) (resid 112 and name HD* ) 1.8 0.0 0.7 ! 1141,1119,1430
  assign (resid  16 and name HA  ) (resid 114 and name HN  ) 1.8 0.0 2.6 
  assign (resid  16 and name HA  ) (resid 114 and name HA* ) 1.8 0.0 0.8 ! 16,15,158,159
  assign (resid  16 and name HA  ) (resid 115 and name HN  ) 1.8 0.0 2.1 ! 565
  assign (resid  16 and name HN  ) (resid 123 and name HG1*) 1.8 0.0 2.8 ! 216
  assign (resid  16 and name HA  ) (resid 123 and name HG1*) 1.8 0.0 1.5 ! 1904
  assign (resid  16 and name HA  ) (resid 123 and name HD1*) 1.8 0.0 1.3 ! 1901
  assign (resid  16 and name HB* ) (resid 123 and name HD1*) 1.8 0.0 2.4 ! 1256
  assign (resid  17 and name HN  ) (resid  17 and name HB1 ) 1.8 0.0 1.5 ! 222
  assign (resid  17 and name HA  ) (resid  17 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  17 and name HA  ) (resid  17 and name HG* ) 1.8 0.0 0.6 ! 846
  assign (resid  17 and name HN  ) (resid  18 and name HN  ) 1.8 0.0 1.1 ! 223
  assign (resid  17 and name HA  ) (resid  18 and name HN  ) 1.8 0.0 1.8 
  assign (resid  17 and name HB1 ) (resid  18 and name HN  ) 1.8 0.0 1.2 ! 231
  assign (resid  17 and name HG* ) (resid 115 and name HA  ) 1.8 0.0 3.2 ! 1662
  assign (resid  17 and name HA  ) (resid 115 and name HN  ) 3.0 1.2 1.2 
  assign (resid  17 and name HB2 ) (resid 115 and name HN  ) 1.8 0.0 1.5 ! 574
  assign (resid  18 and name HN  ) (resid  18 and name HB1 ) 1.8 0.0 1.3 ! 230
  assign (resid  18 and name HN  ) (resid  18 and name HB2 ) 1.8 0.0 2.1 ! 229
  assign (resid  18 and name HA  ) (resid  18 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  18 and name HN  ) (resid  19 and name HN  ) 3.1 1.3 1.3 
  assign (resid  18 and name HA  ) (resid  19 and name HN  ) 1.8 0.0 1.1 ! 4,635
  assign (resid  18 and name HB1 ) (resid  19 and name HN  ) 1.8 0.0 2.6 ! 7
  assign (resid  18 and name HA  ) (resid  34 and name HB  ) 1.8 0.0 1.3 ! 649,889,,874
  assign (resid  18 and name HA  ) (resid  34 and name HG1*) 1.8 0.0 2.6 ! 4518
  assign (resid  18 and name HA  ) (resid  34 and name HG2*) 1.8 0.0 1.6 ! 568
  assign (resid  18 and name HN  ) (resid 113 and name HN  ) 1.8 0.0 2.2 ! 224
  assign (resid  18 and name HA  ) (resid 113 and name HN  ) 1.8 0.0 2.9 
  assign (resid  18 and name HB1 ) (resid 113 and name HE* ) 1.8 0.0 2.7 !      
  assign (resid  18 and name HB2 ) (resid 113 and name HE* ) 1.8 0.0 2.7 !      
  assign (resid  18 and name HN  ) (resid 114 and name HA* ) 3.0 1.2 1.2 
  assign (resid  18 and name HN  ) (resid 114 and name HN  ) 1.8 0.0 3.2 ! 1272
  assign (resid  19 and name HN  ) (resid  19 and name HB* ) 1.8 0.0 1.1 ! 9
  assign (resid  19 and name HA  ) (resid  20 and name HB* ) 1.8 0.0 2.3 ! 515
  assign (resid  19 and name HA  ) (resid  20 and name HN  ) 1.8 0.0 1.1 ! 235,587
  assign (resid  19 and name HN  ) (resid  20 and name HN  ) 3.0 1.2 1.2 
  assign (resid  19 and name HB* ) (resid  20 and name HN  ) 1.8 0.0 1.5 ! 944
  assign (resid  19 and name HB* ) (resid  33 and name HA  ) 1.8 0.0 2.4 ! lm  
  assign (resid  19 and name HB* ) (resid  34 and name HB  ) 1.8 0.0 3.2 ! lm  
  assign (resid  19 and name HB* ) (resid  34 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  19 and name HN  ) (resid  34 and name HB  ) 1.8 0.0 2.3 ! 6
  assign (resid  19 and name HN  ) (resid  34 and name HN  ) 1.8 0.0 2.4 ! 1
  assign (resid  19 and name HA  ) (resid  39 and name HD* ) 1.8 0.0 2.0 ! 37
  assign (resid  19 and name HA  ) (resid  39 and name HE* ) 1.8 0.0 3.2 !   
  assign (resid  19 and name HA  ) (resid 112 and name HA  ) 1.8 0.0 0.9 ! 1,339
  assign (resid  19 and name HA  ) (resid 112 and name HD* ) 1.8 0.0 1.3 ! 510,504,47
  assign (resid  19 and name HB* ) (resid 112 and name HA  ) 1.8 0.0 1.4 ! 200
  assign (resid  19 and name HB* ) (resid 112 and name HD* ) 1.8 0.0 1.2 ! 3379
  assign (resid  20 and name HN  ) (resid  21 and name HN  ) 3.0 1.2 1.2 
  assign (resid  20 and name HA  ) (resid  21 and name HN  ) 1.8 0.0 1.1 ! 244
  assign (resid  20 and name HB* ) (resid  21 and name HN  ) 1.8 0.0 1.4 ! 249
  assign (resid  20 and name HB* ) (resid  22 and name HA  ) 1.8 0.0 2.6 ! 3638
  assign (resid  20 and name HN  ) (resid  22 and name HG2*) 1.8 0.0 2.9 ! 239
  assign (resid  20 and name HB* ) (resid  22 and name HG2*) 1.8 0.0 0.8 ! 3517
  assign (resid  20 and name HB* ) (resid  30 and name HG1*) 1.8 0.0 1.5 ! 3449
  assign (resid  20 and name HB* ) (resid  30 and name HG2*) 1.8 0.0 1.8 ! 4100
  assign (resid  20 and name HA  ) (resid  33 and name HA  ) 1.8 0.0 0.6 ! 590
  assign (resid  20 and name HA  ) (resid  33 and name HB* ) 1.8 0.0 2.1 ! 224,962
  assign (resid  20 and name HB* ) (resid  33 and name HA  ) 1.8 0.0 1.8 ! 182
  assign (resid  20 and name HB* ) (resid  33 and name HB* ) 1.8 0.0 1.1 ! 3518
  assign (resid  20 and name HA  ) (resid  34 and name HN  ) 3.1 1.3 1.3 
  assign (resid  20 and name HB* ) (resid  39 and name HB* ) 1.8 0.0 1.8 ! 3687,1747
  assign (resid  20 and name HB* ) (resid  39 and name HD* ) 1.8 0.0 2.1 ! 3278
  assign (resid  20 and name HB* ) (resid  42 and name HD1*) 1.8 0.0 1.2 ! 3764
  assign (resid  20 and name HB* ) (resid  65 and name HD* ) 1.8 0.0 3.1 ! 3415
  assign (resid  20 and name HN  ) (resid 110 and name HG1*) 1.8 0.0 2.6 ! 238
  assign (resid  20 and name HN  ) (resid 111 and name HN  ) 2.4 0.6 0.6 
  assign (resid  20 and name HN  ) (resid 111 and name HG  ) 1.8 0.0 2.4 ! 241
  assign (resid  20 and name HN  ) (resid 111 and name HD* ) 1.8 0.0 2.0 ! 240
  assign (resid  20 and name HB* ) (resid 111 and name HB* ) 1.8 0.0 2.2 ! 3411
  assign (resid  20 and name HB* ) (resid 111 and name HG  ) 1.8 0.0 2.2 ! lm
  assign (resid  20 and name HB* ) (resid 111 and name HD* ) 1.8 0.0 3.0 ! 4691
  assign (resid  20 and name HN  ) (resid 112 and name HA  ) 1.8 0.0 1.8 
  assign (resid  20 and name HN  ) (resid 112 and name HN  ) 1.8 0.0 2.8 ! 1279
  assign (resid  20 and name HN  ) (resid 113 and name HN  ) 1.8 0.0 1.9 ! 855
  assign (resid  21 and name HN  ) (resid  21 and name HB  ) 1.8 0.0 1.2 ! 250
  assign (resid  21 and name HN  ) (resid  21 and name HG1*) 1.8 0.0 2.4 ! 251
  assign (resid  21 and name HN  ) (resid  21 and name HD1*) 1.8 0.0 2.2 ! 248
  assign (resid  21 and name HA  ) (resid  21 and name HG2*) 1.8 0.0 0.9 ! 282
  assign (resid  21 and name HA  ) (resid  21 and name HD1*) 1.8 0.0 1.8 ! 293
  assign (resid  21 and name HB  ) (resid  21 and name HG2*) 1.8 0.0 0.8 ! 1405
  assign (resid  21 and name HB  ) (resid  21 and name HD1*) 1.8 0.0 0.8 ! 1249
  assign (resid  21 and name HG1*) (resid  21 and name HD1*) 1.8 0.0 0.5 ! 1099
  assign (resid  21 and name HG2*) (resid  21 and name HD1*) 1.8 0.0 0.7 ! 466
  assign (resid  21 and name HN  ) (resid  22 and name HN  ) 1.8 0.0 2.8 ! 242
  assign (resid  21 and name HG2*) (resid  22 and name HN  ) 1.8 0.0 1.4 ! 260
  assign (resid  21 and name HA  ) (resid  22 and name HN  ) 1.8 0.0 1.1 ! 253
  assign (resid  21 and name HG2*) (resid  31 and name HB* ) 1.8 0.0 1.2 ! 4624,1403
  assign (resid  21 and name HG2*) (resid  31 and name HZ3 ) 1.8 0.0 3.4 ! 2098
  assign (resid  21 and name HG2*) (resid  31 and name HE3 ) 1.8 0.0 2.7 ! a
  assign (resid  21 and name HD1*) (resid  31 and name HB* ) 1.8 0.0 2.3 ! 2200
  assign (resid  21 and name HN  ) (resid  32 and name HN  ) 1.8 0.0 2.0 ! 243
  assign (resid  21 and name HB  ) (resid  32 and name HB* ) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HG1*) (resid  32 and name HB* ) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HG2*) (resid  32 and name HB* ) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HD1*) (resid  32 and name HB* ) 1.8 0.0 1.4 ! 3138
  assign (resid  21 and name HN  ) (resid  33 and name HA  ) 2.4 0.6 0.6 
  assign (resid  21 and name HN  ) (resid  34 and name HN  ) 1.8 0.0 3.2 ! 1135,  as
  assign (resid  21 and name HG2*) (resid 108 and name HB  ) 1.8 0.0 2.3 ! 1653,1052
  assign (resid  21 and name HA  ) (resid 110 and name HA  ) 2.3 0.5 0.5 
  assign (resid  21 and name HA  ) (resid 110 and name HG1*) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HA  ) (resid 110 and name HG2*) 1.8 0.0 1.4 ! 596
  assign (resid  21 and name HG1*) (resid 110 and name HG1*) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HG1*) (resid 110 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HG2*) (resid 110 and name HG2*) 1.8 0.0 2.1 ! 4441
  assign (resid  21 and name HG2*) (resid 110 and name HA  ) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HD1*) (resid 110 and name HA  ) 1.8 0.0 2.6 ! 824
  assign (resid  21 and name HD1*) (resid 110 and name HG1*) 1.8 0.0 3.4 ! 3599
  assign (resid  21 and name HD1*) (resid 110 and name HG2*) 1.8 0.0 2.1 ! 3600
  assign (resid  21 and name HA  ) (resid 111 and name HN  ) 2.4 0.6 0.6 
  assign (resid  21 and name HA  ) (resid 111 and name HD* ) 1.8 0.0 2.7 ! lm
  assign (resid  21 and name HG1*) (resid 134 and name HD* ) 1.8 0.0 2.2 ! lm
  assign (resid  21 and name HG2*) (resid 134 and name HD* ) 1.8 0.0 2.3 ! 4682
  assign (resid  21 and name HD1*) (resid 134 and name HD* ) 1.8 0.0 2.0 ! 4491
  assign (resid  22 and name HN  ) (resid  22 and name HB  ) 1.8 0.0 1.5 ! 256
  assign (resid  22 and name HN  ) (resid  22 and name HG2*) 1.8 0.0 1.3 ! 259
  assign (resid  22 and name HA  ) (resid  22 and name HG1*) 1.8 0.0 0.9 ! 257
  assign (resid  22 and name HA  ) (resid  22 and name HG2*) 1.8 0.0 0.9 ! 205
  assign (resid  22 and name HB  ) (resid  22 and name HG1*) 1.8 0.0 0.7 ! 1230
  assign (resid  22 and name HB  ) (resid  22 and name HG2*) 1.8 0.0 0.7 ! 1231
  assign (resid  22 and name HN  ) (resid  23 and name HN  ) 1.8 0.0 2.4 ! 261
  assign (resid  22 and name HA  ) (resid  23 and name HN  ) 1.8 0.0 0.9 ! 268
  assign (resid  22 and name HG1*) (resid  23 and name HN  ) 1.8 0.0 1.4 ! 275
  assign (resid  22 and name HG2*) (resid  23 and name HN  ) 1.8 0.0 2.8 ! 274
  assign (resid  22 and name HG1*) (resid  29 and name HN  ) 1.8 0.0 2.1 ! 320
  assign (resid  22 and name HA  ) (resid  30 and name HA  ) 1.8 0.0 1.0 ! 1427
  assign (resid  22 and name HA  ) (resid  30 and name HG2*) 1.8 0.0 1.9 ! 1458
  assign (resid  22 and name HG1*) (resid  30 and name HA  ) 1.8 0.0 2.2 ! lm
  assign (resid  22 and name HG1*) (resid  30 and name HG2*) 1.8 0.0 1.6 ! 4790
  assign (resid  22 and name HG2*) (resid  30 and name HA  ) 1.8 0.0 1.9 ! 1384
  assign (resid  22 and name HG2*) (resid  30 and name HG1*) 1.8 0.0 1.6 ! 4212
  assign (resid  22 and name HG1*) (resid  30 and name HN  ) 1.8 0.0 2.6 ! 330
  assign (resid  22 and name HA  ) (resid  31 and name HN  ) 1.8 0.0 1.6 ! 333
  assign (resid  22 and name HA  ) (resid  32 and name HN  ) 1.8 0.0 1.8 
  assign (resid  22 and name HG2*) (resid  32 and name HN  ) 1.8 0.0 2.6 ! 346
  assign (resid  22 and name HG2*) (resid  33 and name HB* ) 1.8 0.0 2.5 ! 4772
  assign (resid  22 and name HG1*) (resid  42 and name HB  ) 1.8 0.0 2.2 ! lm 
  assign (resid  22 and name HG1*) (resid  42 and name HG2*) 1.8 0.0 2.0 ! 4341
  assign (resid  22 and name HG2*) (resid  42 and name HG1*) 1.8 0.0 2.0 ! 2330
  assign (resid  22 and name HG2*) (resid  42 and name HG2*) 1.8 0.0 1.6 ! 4262
  assign (resid  22 and name HG1*) (resid  47 and name HG1*) 1.8 0.0 1.6 ! 4294
  assign (resid  22 and name HG1*) (resid  47 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  22 and name HG2*) (resid  47 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  22 and name HG2*) (resid  50 and name HD* ) 1.8 0.0 2.1 ! 4725
  assign (resid  22 and name HN  ) (resid 109 and name HN  ) 1.8 0.0 1.3 ! 62,252
  assign (resid  22 and name HN  ) (resid 109 and name HB2 ) 1.8 0.0 2.4 ! 257
  assign (resid  22 and name HB  ) (resid 109 and name HN  ) 1.8 0.0 2.5 ! 66
  assign (resid  22 and name HB  ) (resid 109 and name HB1 ) 1.8 0.0 1.7 ! lm  
  assign (resid  22 and name HB  ) (resid 109 and name HD* ) 1.8 0.0 1.3 ! lm  
  assign (resid  22 and name HG1*) (resid 109 and name HB1 ) 1.8 0.0 2.2 ! lm
  assign (resid  22 and name HG1*) (resid 109 and name HD* ) 1.8 0.0 2.1 ! 4659
  assign (resid  22 and name HG2*) (resid 109 and name HD* ) 1.8 0.0 2.2 ! lm
  assign (resid  22 and name HN  ) (resid 110 and name HA  ) 2.4 0.6 0.6 
  assign (resid  22 and name HB  ) (resid 111 and name HD* ) 1.8 0.0 2.5 ! 2747
  assign (resid  22 and name HG1*) (resid 111 and name HD* ) 1.8 0.0 2.5 ! 4660
  assign (resid  22 and name HG2*) (resid 111 and name HD* ) 1.8 0.0 1.0 ! 451,4857
  assign (resid  23 and name HN  ) (resid  23 and name HA* ) 1.8 0.0 1.4 ! 270,269
  assign (resid  23 and name HN  ) (resid  24 and name HN  ) 1.8 0.0 2.3 ! 263
  assign (resid  23 and name HA* ) (resid  24 and name HN  ) 1.8 0.0 1.3 ! 279
  assign (resid  23 and name HA* ) (resid  25 and name HN  ) 1.8 0.0 3.6 ! 289
  assign (resid  23 and name HN  ) (resid  30 and name HN  ) 1.8 0.0 3.2 ! 323
  assign (resid  23 and name HN  ) (resid  31 and name HN  ) 1.8 0.0 1.2 ! 1354
  assign (resid  23 and name HN  ) (resid  31 and name HE1 ) 1.8 0.0 2.1 ! 1082
  assign (resid  23 and name HA* ) (resid  31 and name HE1 ) 1.8 0.0 1.5 ! 1087
  assign (resid  23 and name HA* ) (resid  31 and name HZ2 ) 1.8 0.0 2.4 ! 936
  assign (resid  23 and name HA* ) (resid 108 and name HA  ) 1.8 0.0 1.0 ! 12,45
  assign (resid  24 and name HN  ) (resid  24 and name HB1 ) 1.8 0.0 1.5 ! 280
  assign (resid  24 and name HN  ) (resid  24 and name HB2 ) 1.8 0.0 2.4 ! 281
  assign (resid  24 and name HA  ) (resid  24 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  24 and name HA  ) (resid  24 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  24 and name HB1 ) (resid  24 and name HD* ) 1.8 0.0 1.0 ! 106 a,477
  assign (resid  24 and name HB2 ) (resid  24 and name HD* ) 1.8 0.0 1.1 ! 128 a
  assign (resid  24 and name HN  ) (resid  25 and name HN  ) 1.8 0.0 1.3 ! 286
  assign (resid  24 and name HA  ) (resid  25 and name HN  ) 2.7 0.9 0.9 
  assign (resid  24 and name HD* ) (resid  25 and name HN  ) 1.8 0.0 1.7 ! 285
  assign (resid  24 and name HE* ) (resid  25 and name HE* ) 1.8 0.0 2.3 ! 105a
  assign (resid  24 and name HA  ) (resid  28 and name HA  ) 1.8 0.0 1.2 ! 787
  assign (resid  24 and name HA  ) (resid  28 and name HB* ) 1.8 0.0 1.3 ! 2508,870
  assign (resid  24 and name HN  ) (resid  29 and name HN  ) 1.8 0.0 2.5 
  assign (resid  24 and name HB1 ) (resid  29 and name HN  ) 1.8 0.0 3.2 ! 316
  assign (resid  24 and name HA  ) (resid  47 and name HG2*) 1.8 0.0 2.0 ! 4478
  assign (resid  24 and name HB1 ) (resid  47 and name HG2*) 1.8 0.0 1.2 ! 4307,1839
  assign (resid  24 and name HB2 ) (resid  47 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  24 and name HD* ) (resid  47 and name HG* ) 1.8 0.0 1.9 ! 192 a,545
  assign (resid  24 and name HB1 ) (resid  51 and name HG1*) 1.8 0.0 2.7 ! lm  
  assign (resid  24 and name HB1 ) (resid  51 and name HG2*) 1.8 0.0 2.7 ! 4337
  assign (resid  24 and name HB2 ) (resid  51 and name HG2*) 1.8 0.0 2.7 ! lm  
  assign (resid  24 and name HD* ) (resid  51 and name HG1*) 1.8 0.0 1.5 ! 552
  assign (resid  24 and name HD* ) (resid  51 and name HG2*) 1.8 0.0 1.3 ! 556,4529
  assign (resid  24 and name HE* ) (resid  51 and name HG2*) 1.8 0.0 1.3 ! 557
  assign (resid  24 and name HE* ) (resid 107 and name HG* ) 1.8 0.0 2.7 ! P 86 
  assign (resid  24 and name HE* ) (resid 108 and name HN  ) 1.8 0.0 2.2 ! 55
  assign (resid  24 and name HD* ) (resid 108 and name HA  ) 1.8 0.0 1.1 ! 606,90a
  assign (resid  24 and name HN  ) (resid 109 and name HN  ) 3.0 1.2 1.2 
  assign (resid  24 and name HD* ) (resid 109 and name HN  ) 1.8 0.0 2.6 ! 63
  assign (resid  24 and name HD* ) (resid 109 and name HB* ) 1.8 0.0 2.0 ! 182 a
  assign (resid  24 and name HB2 ) (resid 109 and name HG  ) 1.8 0.0 2.7 ! lm  
  assign (resid  24 and name HD* ) (resid 109 and name HG  ) 1.8 0.0 1.9 ! 3808
  assign (resid  24 and name HB1 ) (resid 109 and name HD1*) 1.8 0.0 2.4 ! lm  
  assign (resid  24 and name HB2 ) (resid 109 and name HD1*) 1.8 0.0 2.9 ! lm  
  assign (resid  24 and name HB2 ) (resid 109 and name HD2*) 1.8 0.0 2.9 ! lm  
  assign (resid  24 and name HD* ) (resid 109 and name HD1*) 1.8 0.0 2.1 ! 2082
  assign (resid  24 and name HD* ) (resid 109 and name HD2*) 1.8 0.0 3.2 ! 
  assign (resid  24 and name HE* ) (resid 109 and name HD1*) 1.8 0.0 3.2 ! 
  assign (resid  25 and name HN  ) (resid  25 and name HG* ) 1.8 0.0 1.8 ! 292
  assign (resid  25 and name HA  ) (resid  25 and name HB1 ) 1.8 0.0 0.7 
  assign (resid  25 and name HA  ) (resid  25 and name HB2 ) 1.8 0.0 1.0 
  assign (resid  25 and name HA  ) (resid  25 and name HG* ) 1.8 0.0 1.1 ! 392
  assign (resid  25 and name HA  ) (resid  25 and name HD* ) 1.8 0.0 1.0 ! 987
  assign (resid  25 and name HB2 ) (resid  25 and name HG* ) 1.8 0.0 0.7 ! 1055
  assign (resid  25 and name HB2 ) (resid  25 and name HE* ) 1.8 0.0 2.2 ! 2107
  assign (resid  25 and name HG* ) (resid  25 and name HE* ) 1.8 0.0 0.6 ! 1297
  assign (resid  25 and name HD* ) (resid  25 and name HE* ) 1.8 0.0 1.5 ! 1355
  assign (resid  25 and name HD* ) (resid  26 and name HN  ) 1.8 0.0 2.7 ! 301
  assign (resid  25 and name HN  ) (resid  26 and name HN  ) 1.8 0.0 2.4 ! 295
  assign (resid  25 and name HA  ) (resid  26 and name HN  ) 1.8 0.0 1.0 ! 298
  assign (resid  25 and name HB2 ) (resid  26 and name HN  ) 1.8 0.0 1.7 ! 300
  assign (resid  25 and name HG* ) (resid  26 and name HN  ) 1.8 0.0 2.8 ! 302
  assign (resid  25 and name HN  ) (resid  27 and name HN  ) 1.8 0.0 3.0 ! 304
  assign (resid  25 and name HB1 ) (resid  27 and name HN  ) 1.8 0.0 2.7 ! 310
  assign (resid  25 and name HG* ) (resid 108 and name HG2*) 1.8 0.0 3.2 ! 2268
  assign (resid  25 and name HE* ) (resid 108 and name HG2*) 1.8 0.0 1.1 ! 4786
  assign (resid  26 and name HN  ) (resid  26 and name HA  ) 1.8 0.0 1.0 ! 297
  assign (resid  26 and name HN  ) (resid  26 and name HB1 ) 1.8 0.0 2.0 ! 299
  assign (resid  26 and name HA  ) (resid  26 and name HB1 ) 1.8 0.0 0.7 
  assign (resid  26 and name HA  ) (resid  26 and name HB2 ) 1.8 0.0 0.7 
  assign (resid  26 and name HN  ) (resid  27 and name HN  ) 1.8 0.0 2.1 ! 294
  assign (resid  26 and name HB* ) (resid  27 and name HN  ) 1.8 0.0 0.9 ! 309
  assign (resid  27 and name HN  ) (resid  27 and name HA  ) 1.8 0.0 1.1 ! 305
  assign (resid  27 and name HN  ) (resid  27 and name HB1 ) 1.8 0.0 1.3 ! 307
  assign (resid  27 and name HN  ) (resid  27 and name HB2 ) 1.8 0.0 1.6 ! 308
  assign (resid  27 and name HA  ) (resid  27 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  27 and name HA  ) (resid  27 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  27 and name HA  ) (resid  28 and name HG* ) 1.8 0.0 1.8 ! 468
  assign (resid  27 and name HA  ) (resid  28 and name HD* ) 1.8 0.0 0.9 ! 1471
  assign (resid  28 and name HA  ) (resid  28 and name HB* ) 2.2 0.0 0.3 
  assign (resid  28 and name HA  ) (resid  28 and name HG* ) 1.8 0.0 1.6 ! 921
  assign (resid  28 and name HB* ) (resid  28 and name HD* ) 1.8 0.0 1.5 ! 1484
  assign (resid  28 and name HG* ) (resid  28 and name HD* ) 1.8 0.0 0.9 ! 1285,2196
  assign (resid  28 and name HB* ) (resid  29 and name HN  ) 1.8 0.0 2.0 ! 317,319
  assign (resid  28 and name HD* ) (resid  43 and name HA  ) 1.8 0.0 2.6 ! 335
  assign (resid  28 and name HB* ) (resid  44 and name HA  ) 1.8 0.0 1.5 ! 2788,1042
! assign (resid  28 and name HB* ) (resid  44 and name HA  ) 1.8 0.0 1.5 ! 687,1486
  assign (resid  28 and name HG* ) (resid  44 and name HA  ) 1.8 0.0 0.7 ! 1116,1117
  assign (resid  28 and name HD* ) (resid  44 and name HB* ) 1.8 0.0 2.0 ! 1498
  assign (resid  28 and name HB* ) (resid  47 and name HG1*) 1.8 0.0 2.2 ! 4512
  assign (resid  28 and name HB* ) (resid  47 and name HG2*) 1.8 0.0 1.2 ! 2377
  assign (resid  28 and name HG* ) (resid  47 and name HG2*) 1.8 0.0 3.2 ! 2354
  assign (resid  29 and name HN  ) (resid  29 and name HA  ) 1.8 0.0 0.9 ! 312
  assign (resid  29 and name HN  ) (resid  29 and name HB1 ) 1.8 0.0 2.2 ! 315
  assign (resid  29 and name HN  ) (resid  29 and name HB2 ) 1.8 0.0 2.3 ! 322
  assign (resid  29 and name HA  ) (resid  29 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  29 and name HA  ) (resid  29 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  29 and name HA  ) (resid  30 and name HB  ) 1.8 0.0 2.6 ! 916
  assign (resid  29 and name HA  ) (resid  30 and name HN  ) 1.8 0.0 1.1 ! 324
  assign (resid  29 and name HA  ) (resid  30 and name HG2*) 1.8 0.0 3.4 ! 603
  assign (resid  29 and name HB1 ) (resid  30 and name HN  ) 1.8 0.0 2.1 ! 326
  assign (resid  29 and name HN  ) (resid  30 and name HN  ) 3.0 1.2 1.2 
  assign (resid  30 and name HN  ) (resid  30 and name HB  ) 1.8 0.0 1.1 ! 327
  assign (resid  30 and name HN  ) (resid  30 and name HG1*) 1.8 0.0 1.7 ! 329
  assign (resid  30 and name HN  ) (resid  30 and name HG2*) 1.8 0.0 1.3 ! 328
  assign (resid  30 and name HA  ) (resid  30 and name HG1*) 1.8 0.0 0.8 ! 192
  assign (resid  30 and name HA  ) (resid  30 and name HG2*) 1.8 0.0 0.3 ! 211
  assign (resid  30 and name HB  ) (resid  30 and name HG1*) 1.8 0.0 0.5 ! 1333
  assign (resid  30 and name HB  ) (resid  30 and name HG2*) 1.8 0.0 0.4 ! 1340
  assign (resid  30 and name HN  ) (resid  31 and name HN  ) 3.0 1.2 1.2 
  assign (resid  30 and name HA  ) (resid  31 and name HN  ) 1.8 0.0 1.3 ! 334
  assign (resid  30 and name HG1*) (resid  31 and name HN  ) 1.8 0.0 2.3 ! 336
  assign (resid  30 and name HA  ) (resid  32 and name HN  ) 1.8 0.0 2.6 ! 347
  assign (resid  30 and name HG1*) (resid  32 and name HA  ) 1.8 0.0 1.3 ! 325,572
  assign (resid  30 and name HG1*) (resid  32 and name HN  ) 1.8 0.0 1.1 ! 628,629,345
  assign (resid  30 and name HG1*) (resid  33 and name HB* ) 1.8 0.0 1.3 ! 2865
  assign (resid  30 and name HG1*) (resid  33 and name HN  ) 1.8 0.0 2.2 ! 357
  assign (resid  30 and name HB  ) (resid  40 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  30 and name HG1*) (resid  40 and name HA  ) 1.8 0.0 1.6 ! 1368
  assign (resid  30 and name HG1*) (resid  40 and name HB  ) 1.8 0.0 1.6 ! lm 
  assign (resid  30 and name HG1*) (resid  40 and name HG1*) 1.8 0.0 2.1 ! 4250
  assign (resid  30 and name HG1*) (resid  40 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  30 and name HG2*) (resid  40 and name HA  ) 1.8 0.0 2.2 ! lm  
  assign (resid  30 and name HG2*) (resid  40 and name HB  ) 1.8 0.0 1.8 ! lm 
  assign (resid  30 and name HG2*) (resid  42 and name HB  ) 1.8 0.0 1.8 ! 2934
  assign (resid  30 and name HG2*) (resid  42 and name HG2*) 1.8 0.0 1.7 ! 4263
  assign (resid  30 and name HG2*) (resid  43 and name HG2*) 1.8 0.0 3.2 ! 4222
  assign (resid  31 and name HN  ) (resid  31 and name HB* ) 1.8 0.0 2.0 ! 335
  assign (resid  31 and name HN  ) (resid  31 and name HD1 ) 1.8 0.0 3.4 ! 1163
  assign (resid  31 and name HN  ) (resid  31 and name HE1 ) 1.8 0.0 3.4 ! 1081
  assign (resid  31 and name HA  ) (resid  31 and name HE1 ) 1.8 0.0 2.4 ! 1085
  assign (resid  31 and name HN  ) (resid  32 and name HN  ) 1.8 0.0 1.2 ! 331
  assign (resid  31 and name HA  ) (resid  32 and name HN  ) 1.8 0.0 1.6 ! 341
  assign (resid  31 and name HB* ) (resid  32 and name HN  ) 1.8 0.0 1.3 ! 343
  assign (resid  31 and name HZ3 ) (resid 108 and name HA  ) 1.8 0.0 2.7 ! 26a
  assign (resid  31 and name HE3 ) (resid 108 and name HA  ) 1.8 0.0 2.7 !     
  assign (resid  31 and name HE3 ) (resid 108 and name HB  ) 1.8 0.0 2.7 !
  assign (resid  31 and name HE3 ) (resid 108 and name HG2*) 1.8 0.0 2.7 !
  assign (resid  31 and name HZ3 ) (resid 108 and name HG2*) 1.8 0.0 1.9 ! 217
  assign (resid  31 and name HH2 ) (resid 108 and name HG2*) 1.8 0.0 2.7 !     
  assign (resid  31 and name HZ3 ) (resid 134 and name HD* ) 1.8 0.0 2.3 ! 523
  assign (resid  31 and name HZ3 ) (resid 139 and name HE* ) 1.8 0.0 2.7 ! P 139 
  assign (resid  32 and name HN  ) (resid  32 and name HB* ) 1.8 0.0 1.1 ! 344
  assign (resid  32 and name HN  ) (resid  33 and name HN  ) 1.8 0.0 2.4 ! 350
  assign (resid  32 and name HA  ) (resid  33 and name HN  ) 1.8 0.0 0.9 ! 353
  assign (resid  32 and name HB* ) (resid 110 and name HG2*) 1.8 0.0 3.2 ! 2904
  assign (resid  33 and name HN  ) (resid  33 and name HB* ) 1.8 0.0 1.1 ! 354
  assign (resid  33 and name HN  ) (resid  34 and name HN  ) 1.8 0.0 2.5 ! 351
  assign (resid  33 and name HA  ) (resid  34 and name HN  ) 1.8 0.0 1.3 ! 360
  assign (resid  33 and name HB* ) (resid  34 and name HN  ) 1.8 0.0 1.2 ! 364
  assign (resid  33 and name HB* ) (resid  40 and name HN  ) 1.8 0.0 3.0 ! 418
  assign (resid  33 and name HB* ) (resid  40 and name HA  ) 1.8 0.0 0.7 ! 1385,1172
  assign (resid  33 and name HB* ) (resid  40 and name HB  ) 1.8 0.0 2.1 ! 3212
  assign (resid  33 and name HB* ) (resid  40 and name HG1*) 1.8 0.0 1.3 ! 2990,4249
  assign (resid  33 and name HB* ) (resid  40 and name HG2*) 1.8 0.0 1.3 ! 2925
  assign (resid  34 and name HN  ) (resid  34 and name HB  ) 1.8 0.0 1.4 ! 363
  assign (resid  34 and name HN  ) (resid  34 and name HG1*) 1.8 0.0 2.3 ! 366
  assign (resid  34 and name HN  ) (resid  34 and name HG2*) 1.8 0.0 1.0 ! 365
  assign (resid  34 and name HA  ) (resid  35 and name HD* ) 1.8 0.0 0.4 ! 1829,1120
  assign (resid  34 and name HG1*) (resid  35 and name HD* ) 1.8 0.0 2.2 ! 4560
  assign (resid  34 and name HG1*) (resid  37 and name HN  ) 1.8 0.0 2.2 ! 388
  assign (resid  35 and name HA  ) (resid  35 and name HB* ) 2.2 0.0 0.3 
  assign (resid  35 and name HB* ) (resid  35 and name HG* ) 1.8 0.0 1.5 ! 2190,2189
  assign (resid  35 and name HA  ) (resid  36 and name HN  ) 1.8 0.0 1.1 ! 371
  assign (resid  35 and name HB* ) (resid  36 and name HN  ) 1.8 0.0 2.5 ! 374
  assign (resid  35 and name HA  ) (resid  37 and name HN  ) 1.8 0.0 2.7 ! 384
  assign (resid  35 and name HA  ) (resid  40 and name HG1*) 1.8 0.0 2.2 ! 4160,352
  assign (resid  35 and name HA  ) (resid  40 and name HG2*) 1.8 0.0 1.9 ! 1077
  assign (resid  35 and name HB* ) (resid  40 and name HG1*) 1.8 0.0 1.7 ! 2169
  assign (resid  35 and name HB* ) (resid  40 and name HG2*) 1.8 0.0 2.2 ! lm
  assign (resid  36 and name HN  ) (resid  36 and name HA* ) 1.8 0.0 1.1 ! 373,372
  assign (resid  36 and name HN  ) (resid  37 and name HN  ) 1.8 0.0 1.9 ! 369
  assign (resid  36 and name HN  ) (resid  40 and name HG1*) 1.8 0.0 2.1 ! 377
  assign (resid  36 and name HN  ) (resid  40 and name HG2*) 1.8 0.0 2.8 ! 376
  assign (resid  36 and name HA* ) (resid  40 and name HG1*) 1.8 0.0 2.9 ! 4042
  assign (resid  37 and name HN  ) (resid  37 and name HB* ) 1.8 0.0 1.3 ! 392
  assign (resid  37 and name HN  ) (resid  37 and name HG* ) 1.8 0.0 1.7 ! 389
  assign (resid  37 and name HN  ) (resid  37 and name HD* ) 1.8 0.0 1.5 ! 390
  assign (resid  37 and name HN  ) (resid  38 and name HN  ) 1.8 0.0 2.8 ! 381
  assign (resid  37 and name HA  ) (resid  38 and name HN  ) 2.7 0.9 0.9 
  assign (resid  37 and name HN  ) (resid  40 and name HG1*) 1.8 0.0 1.4 ! 387
  assign (resid  38 and name HN  ) (resid  38 and name HB  ) 1.8 0.0 1.3 ! 397
  assign (resid  38 and name HN  ) (resid  38 and name HG2*) 1.8 0.0 2.8 ! 402
  assign (resid  38 and name HA  ) (resid  38 and name HB  ) 2.2 0.0 0.6 
  assign (resid  38 and name HN  ) (resid  39 and name HN  ) 1.8 0.0 1.4 ! 393
  assign (resid  38 and name HA  ) (resid  39 and name HN  ) 2.7 0.9 0.9 
  assign (resid  38 and name HB  ) (resid  39 and name HN  ) 1.8 0.0 1.6 ! 409
  assign (resid  38 and name HB  ) (resid  39 and name HD* ) 1.8 0.0 2.1 ! 1928
  assign (resid  38 and name HG2*) (resid  39 and name HN  ) 1.8 0.0 2.4 ! 412
  assign (resid  38 and name HG2*) (resid  39 and name HD* ) 1.8 0.0 2.0 ! 3285
  assign (resid  38 and name HG2*) (resid  39 and name HE* ) 1.8 0.0 3.2 ! 
  assign (resid  38 and name HG2*) (resid  39 and name HZ  ) 1.8 0.0 3.2 !
  assign (resid  38 and name HA  ) (resid  40 and name HG1*) 1.8 0.0 2.0 ! 1894
  assign (resid  38 and name HN  ) (resid  40 and name HN  ) 3.0 1.2 1.2 
  assign (resid  38 and name HA  ) (resid  41 and name HN  ) 3.0 1.2 1.2 
  assign (resid  38 and name HG2*) (resid  66 and name HA* ) 1.8 0.0 1.9 ! 1358
  assign (resid  38 and name HG2*) (resid  68 and name HN  ) 1.8 0.0 1.4 ! 650
  assign (resid  38 and name HG2*) (resid  68 and name HB2 ) 1.8 0.0 1.9 ! 3286
  assign (resid  38 and name HG2*) (resid  68 and name HG* ) 1.8 0.0 2.2 ! 2342
  assign (resid  38 and name HB  ) (resid 113 and name HE* ) 1.8 0.0 2.7 !      
  assign (resid  38 and name HG2*) (resid 113 and name HE* ) 1.8 0.0 2.7 !      
  assign (resid  39 and name HN  ) (resid  39 and name HB* ) 1.8 0.0 1.5 ! 410
  assign (resid  39 and name HN  ) (resid  39 and name HD* ) 1.8 0.0 2.5 ! 406
  assign (resid  39 and name HA  ) (resid  39 and name HD* ) 1.8 0.0 0.7 ! 72 a
  assign (resid  39 and name HA  ) (resid  39 and name HE* ) 1.8 0.0 2.7 ! 71a   
  assign (resid  39 and name HB* ) (resid  39 and name HD* ) 1.8 0.0 1.0 ! 108 a
  assign (resid  39 and name HB* ) (resid  40 and name HG1*) 1.8 0.0 1.8 ! 1377
  assign (resid  39 and name HN  ) (resid  40 and name HN  ) 2.3 0.5 0.5 
  assign (resid  39 and name HA  ) (resid  40 and name HN  ) 2.7 0.9 0.9 
  assign (resid  39 and name HN  ) (resid  41 and name HN  ) 3.0 1.2 1.2 
  assign (resid  39 and name HA  ) (resid  41 and name HN  ) 1.8 0.0 2.3 ! 425
  assign (resid  39 and name HA  ) (resid  42 and name HG1*) 1.8 0.0 2.1 ! 956
  assign (resid  39 and name HA  ) (resid  42 and name HD1*) 1.8 0.0 2.6 ! 1187
  assign (resid  39 and name HA  ) (resid  42 and name HB  ) 1.8 0.0 2.7 ! 1164
  assign (resid  39 and name HB* ) (resid  42 and name HN  ) 1.8 0.0 2.8 ! 439
  assign (resid  39 and name HB* ) (resid  42 and name HD1*) 1.8 0.0 1.5 ! 1408
  assign (resid  39 and name HD* ) (resid  42 and name HD1*) 1.8 0.0 1.5 ! 568
  assign (resid  39 and name HE* ) (resid 100 and name HG1*) 1.8 0.0 2.3 !    
  assign (resid  39 and name HZ  ) (resid 100 and name HG1*) 1.8 0.0 2.3 !    
  assign (resid  39 and name HB* ) (resid 111 and name HD* ) 1.8 0.0 2.2 ! 1276
  assign (resid  39 and name HD* ) (resid 111 and name HD* ) 1.8 0.0 2.5 ! 497
  assign (resid  39 and name HE* ) (resid 111 and name HD* ) 1.8 0.0 2.3 ! 498
  assign (resid  39 and name HE* ) (resid 112 and name HA  ) 1.8 0.0 2.7 !    
  assign (resid  39 and name HE* ) (resid 113 and name HE* ) 1.8 0.0 2.7 ! 150a
  assign (resid  39 and name HZ  ) (resid 113 and name HE* ) 1.8 0.0 2.7 ! 149a
  assign (resid  40 and name HN  ) (resid  40 and name HB  ) 1.8 0.0 1.3 ! 417
  assign (resid  40 and name HN  ) (resid  40 and name HG1*) 1.8 0.0 1.4 ! 420
  assign (resid  40 and name HN  ) (resid  40 and name HG2*) 1.8 0.0 2.3 ! 419
  assign (resid  40 and name HA  ) (resid  40 and name HB  ) 2.2 0.0 0.3 
  assign (resid  40 and name HN  ) (resid  41 and name HN  ) 1.8 0.0 2.1 ! 413
  assign (resid  40 and name HA  ) (resid  41 and name HN  ) 2.7 0.9 0.9 
  assign (resid  40 and name HG1*) (resid  41 and name HN  ) 1.8 0.0 1.3 ! 431
  assign (resid  40 and name HG1*) (resid  41 and name HA  ) 1.8 0.0 2.0 ! 263
  assign (resid  40 and name HG2*) (resid  41 and name HN  ) 1.8 0.0 2.2 ! 430
  assign (resid  40 and name HG1*) (resid  41 and name HD2*) 1.8 0.0 2.5 ! 161
  assign (resid  40 and name HN  ) (resid  42 and name HN  ) 3.0 1.2 1.2 ! 1205
  assign (resid  40 and name HA  ) (resid  42 and name HN  ) 1.8 0.0 3.2 ! 437
  assign (resid  40 and name HG2*) (resid  42 and name HN  ) 1.8 0.0 2.2 ! 442
  assign (resid  41 and name HN  ) (resid  41 and name HB1 ) 1.8 0.0 1.6 ! 427
  assign (resid  41 and name HN  ) (resid  41 and name HB2 ) 1.8 0.0 1.1 ! 428
  assign (resid  41 and name HA  ) (resid  41 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  41 and name HB2 ) (resid  41 and name HD2*) 1.8 0.0 2.2 ! 1090
  assign (resid  41 and name HN  ) (resid  42 and name HN  ) 1.8 0.0 1.1 ! 423,432
  assign (resid  41 and name HN  ) (resid  42 and name HG1*) 1.8 0.0 2.9 ! 429
  assign (resid  41 and name HB2 ) (resid  66 and name HA* ) 1.8 0.0 2.6 ! 1425
  assign (resid  42 and name HN  ) (resid  42 and name HB  ) 1.8 0.0 1.0 ! 441
  assign (resid  42 and name HN  ) (resid  42 and name HG1*) 1.8 0.0 1.6 ! 440
  assign (resid  42 and name HN  ) (resid  42 and name HG2*) 1.8 0.0 1.6 ! 443
  assign (resid  42 and name HN  ) (resid  43 and name HN  ) 1.8 0.0 2.5 ! 433,458
  assign (resid  42 and name HA  ) (resid  43 and name HN  ) 1.8 0.0 0.9 ! 449,598
  assign (resid  42 and name HA  ) (resid  43 and name HG2*) 1.8 0.0 2.3 ! 3471
  assign (resid  42 and name HG2*) (resid  43 and name HN  ) 1.8 0.0 1.9 ! 457
  assign (resid  42 and name HG2*) (resid  43 and name HA  ) 1.8 0.0 2.3 ! 281
  assign (resid  42 and name HG2*) (resid  47 and name HA  ) 1.8 0.0 2.2 ! 1500
  assign (resid  42 and name HG2*) (resid  47 and name HG1*) 1.8 0.0 1.9 ! 4113
  assign (resid  42 and name HD1*) (resid  47 and name HA  ) 1.8 0.0 3.5 ! 2194
  assign (resid  42 and name HD1*) (resid  50 and name HD* ) 1.8 0.0 3.2 ! 4683
  assign (resid  42 and name HG1*) (resid  65 and name HA  ) 1.8 0.0 2.9 ! 957
  assign (resid  42 and name HD1*) (resid  65 and name HD* ) 1.8 0.0 1.6 ! 4476
  assign (resid  42 and name HA  ) (resid  66 and name HN  ) 1.8 0.0 1.1 ! 1073
  assign (resid  42 and name HN  ) (resid  66 and name HA* ) 1.8 0.0 2.5 ! 438
  assign (resid  42 and name HA  ) (resid  66 and name HA* ) 1.8 0.0 1.1 ! 714,1357
  assign (resid  42 and name HD1*) (resid 109 and name HD* ) 1.8 0.0 2.2 ! lm
  assign (resid  42 and name HD1*) (resid 111 and name HD* ) 1.8 0.0 1.7 ! 4606,467
  assign (resid  43 and name HN  ) (resid  43 and name HG2*) 1.8 0.0 1.3 ! 400
  assign (resid  43 and name HA  ) (resid  44 and name HD* ) 1.8 0.0 1.7 ! 112
  assign (resid  43 and name HB  ) (resid  44 and name HD* ) 1.8 0.0 1.1 ! 362
  assign (resid  43 and name HG2*) (resid  44 and name HD* ) 1.8 0.0 2.5 ! 1072,3238
  assign (resid  43 and name HB  ) (resid  45 and name HB* ) 1.8 0.0 2.5 ! 703
  assign (resid  43 and name HG2*) (resid  45 and name HN  ) 1.8 0.0 2.9 ! 904,906
  assign (resid  43 and name HG2*) (resid  45 and name HB* ) 1.8 0.0 2.2 ! 3694
  assign (resid  43 and name HN  ) (resid  45 and name HN  ) 1.8 0.0 2.0 ! 461
  assign (resid  43 and name HB  ) (resid  45 and name HN  ) 1.8 0.0 1.2 ! 464
  assign (resid  43 and name HB  ) (resid  45 and name HB* ) 1.8 0.0 1.5 ! 2175
  assign (resid  43 and name HB  ) (resid  46 and name HN  ) 1.8 0.0 2.4 ! 475
  assign (resid  43 and name HN  ) (resid  66 and name HN  ) 1.8 0.0 2.7 ! 1072
  assign (resid  44 and name HA  ) (resid  44 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  44 and name HA  ) (resid  44 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  44 and name HB* ) (resid  44 and name HG* ) 1.8 0.0 1.4 ! 2257
  assign (resid  44 and name HG* ) (resid  44 and name HD* ) 1.8 0.0 1.2 ! 978,979
  assign (resid  44 and name HB* ) (resid  45 and name HN  ) 1.8 0.0 1.7 ! 468,467
  assign (resid  44 and name HA  ) (resid  45 and name HN  ) 1.8 0.0 1.3 ! 465
  assign (resid  44 and name HA  ) (resid  47 and name HN  ) 1.8 0.0 1.9 ! 593
  assign (resid  44 and name HA  ) (resid  47 and name HB  ) 1.8 0.0 1.8 ! 1254
  assign (resid  44 and name HA  ) (resid  47 and name HG1*) 1.8 0.0 0.7 ! 344,4030
  assign (resid  44 and name HA  ) (resid  48 and name HN  ) 3.0 1.2 1.2 
  assign (resid  45 and name HN  ) (resid  45 and name HB* ) 1.8 0.0 1.0 ! 469
  assign (resid  45 and name HN  ) (resid  46 and name HN  ) 1.8 0.0 0.9 ! 470,460
  assign (resid  45 and name HA  ) (resid  46 and name HN  ) 1.8 0.0 1.5 ! 477
  assign (resid  45 and name HB* ) (resid  46 and name HN  ) 1.8 0.0 1.3 ! 481
  assign (resid  45 and name HN  ) (resid  47 and name HN  ) 3.0 1.2 1.2 
  assign (resid  45 and name HB* ) (resid  47 and name HN  ) 1.8 0.0 2.1 ! 93
  assign (resid  45 and name HA  ) (resid  48 and name HN  ) 1.8 0.0 2.1 ! 487
  assign (resid  45 and name HB* ) (resid  48 and name HN  ) 1.8 0.0 4.2 ! 679
  assign (resid  46 and name HA  ) (resid  46 and name HB1 ) 2.2 0.0 0.5 
  assign (resid  46 and name HA  ) (resid  46 and name HB2 ) 2.2 0.0 0.5 
  assign (resid  46 and name HN  ) (resid  47 and name HN  ) 1.8 0.0 0.9 ! 471,76
  assign (resid  46 and name HN  ) (resid  48 and name HN  ) 1.8 0.0 3.2 ! 1193
  assign (resid  47 and name HA  ) (resid  47 and name HB  ) 1.8 0.0 0.9 
  assign (resid  47 and name HN  ) (resid  47 and name HG1*) 1.8 0.0 1.5 ! 96,95
  assign (resid  47 and name HN  ) (resid  48 and name HN  ) 1.8 0.0 0.7 ! 485
  assign (resid  47 and name HB  ) (resid  48 and name HN  ) 1.8 0.0 1.7 ! 490
  assign (resid  47 and name HG1*) (resid  48 and name HN  ) 1.8 0.0 1.9 ! 492
  assign (resid  47 and name HN  ) (resid  49 and name HN  ) 3.0 1.2 1.2 
  assign (resid  47 and name HA  ) (resid  50 and name HN  ) 1.8 0.0 2.3 ! 501
  assign (resid  47 and name HA  ) (resid  50 and name HB1 ) 1.8 0.0 1.4 ! 1597
  assign (resid  47 and name HA  ) (resid  50 and name HD* ) 1.8 0.0 1.1 ! 1290,1558
  assign (resid  47 and name HG1*) (resid  50 and name HN  ) 1.8 0.0 2.6 ! 506
  assign (resid  47 and name HA  ) (resid  51 and name HG1*) 1.8 0.0 3.2 ! lm
  assign (resid  47 and name HG2*) (resid  51 and name HB  ) 1.8 0.0 3.0 ! 2379
  assign (resid  47 and name HG1*) (resid  51 and name HG2*) 1.8 0.0 2.6 ! 4166
  assign (resid  47 and name HG2*) (resid  51 and name HG1*) 1.8 0.0 1.9 ! 4783
  assign (resid  47 and name HG2*) (resid  51 and name HG2*) 1.8 0.0 1.3 ! 4257
  assign (resid  47 and name HG2*) (resid 109 and name HD* ) 1.8 0.0 0.9 ! 3974
  assign (resid  47 and name HG1*) (resid 109 and name HD* ) 1.8 0.0 1.4 ! 3966
  assign (resid  47 and name HG1*) (resid 111 and name HD* ) 1.8 0.0 3.4 ! 2291
  assign (resid  48 and name HN  ) (resid  48 and name HA* ) 1.8 0.0 1.0 ! 488
  assign (resid  48 and name HN  ) (resid  49 and name HN  ) 1.8 0.0 1.5 ! 486
  assign (resid  48 and name HA* ) (resid  49 and name HN  ) 1.8 0.0 0.8 
  assign (resid  48 and name HN  ) (resid  50 and name HN  ) 3.0 1.2 1.2 
  assign (resid  48 and name HA* ) (resid  51 and name HG2*) 1.8 0.0 1.0 ! 1443,3988
  assign (resid  48 and name HA* ) (resid  51 and name HN  ) 1.8 0.0 2.6 ! 512
  assign (resid  48 and name HA* ) (resid  52 and name HN  ) 1.8 0.0 1.7 ! 525
  assign (resid  49 and name HN  ) (resid  49 and name HB  ) 1.8 0.0 1.1 ! 497
  assign (resid  49 and name HN  ) (resid  49 and name HG* ) 1.8 0.0 1.1 ! 498
  assign (resid  49 and name HA  ) (resid  49 and name HB  ) 2.2 0.0 0.3 
  assign (resid  49 and name HN  ) (resid  50 and name HN  ) 1.8 0.0 0.7 
  assign (resid  49 and name HA  ) (resid  50 and name HN  ) 1.8 0.0 1.5 
  assign (resid  49 and name HG* ) (resid  50 and name HD* ) 1.8 0.0 3.3 ! 3425
  assign (resid  49 and name HN  ) (resid  51 and name HN  ) 3.0 1.2 1.2 
  assign (resid  49 and name HN  ) (resid  52 and name HN  ) 1.8 0.0 2.1 ! 494
  assign (resid  49 and name HA  ) (resid  52 and name HN  ) 3.0 1.2 1.2 ! 1267
  assign (resid  49 and name HG* ) (resid  58 and name HB1 ) 1.8 0.0 2.7 ! lm  
  assign (resid  49 and name HG* ) (resid  58 and name HD* ) 1.8 0.0 2.7 ! 166a
  assign (resid  49 and name HG* ) (resid  58 and name HE* ) 1.8 0.0 2.7 ! 542,161a
  assign (resid  49 and name HG* ) (resid  58 and name HZ  ) 1.8 0.0 2.7 ! 163a
  assign (resid  49 and name HG* ) (resid  59 and name HD* ) 1.8 0.0 3.6 ! 544
  assign (resid  49 and name HG* ) (resid  63 and name HA  ) 1.8 0.0 3.0 ! 3784
  assign (resid  49 and name HG* ) (resid  63 and name HD* ) 1.8 0.0 1.2 ! 4768,1513
  assign (resid  49 and name HG* ) (resid  64 and name HN  ) 1.8 0.0 2.0 ! 613
  assign (resid  50 and name HN  ) (resid  50 and name HB1 ) 1.8 0.0 1.4 ! 502
  assign (resid  50 and name HN  ) (resid  50 and name HB2 ) 1.8 0.0 1.4 ! 504
  assign (resid  50 and name HN  ) (resid  50 and name HG  ) 1.8 0.0 1.9 ! 503
  assign (resid  50 and name HN  ) (resid  50 and name HD* ) 1.8 0.0 1.6 ! 505
  assign (resid  50 and name HA  ) (resid  50 and name HB1 ) 1.8 0.0 0.8 
  assign (resid  50 and name HN  ) (resid  51 and name HN  ) 1.8 0.0 1.3 ! 510,499
  assign (resid  50 and name HA  ) (resid  51 and name HN  ) 1.8 0.0 1.5 
  assign (resid  50 and name HB1 ) (resid  51 and name HN  ) 1.8 0.0 2.4 ! 514
  assign (resid  50 and name HG  ) (resid  51 and name HN  ) 1.8 0.0 4.0 ! 515
  assign (resid  50 and name HB1 ) (resid  51 and name HG1*) 1.8 0.0 2.5 ! lm  
  assign (resid  50 and name HD* ) (resid  51 and name HG1*) 1.8 0.0 3.0 ! 4711
  assign (resid  50 and name HN  ) (resid  52 and name HN  ) 3.0 1.2 1.2 
  assign (resid  50 and name HA  ) (resid  63 and name HD1*) 1.8 0.0 2.0 ! 378
  assign (resid  50 and name HA  ) (resid  63 and name HD2*) 1.8 0.0 2.0 ! lm 
  assign (resid  50 and name HB2 ) (resid  63 and name HB* ) 1.8 0.0 2.5 ! 2913
  assign (resid  50 and name HB2 ) (resid  63 and name HD* ) 1.8 0.0 1.9 ! 3362
  assign (resid  50 and name HG  ) (resid  63 and name HD* ) 1.8 0.0 2.0 ! lm 
  assign (resid  50 and name HD* ) (resid  63 and name HB* ) 1.8 0.0 2.3 ! 2820
  assign (resid  50 and name HD* ) (resid  63 and name HG  ) 1.8 0.0 4.3 ! 4023
  assign (resid  50 and name HD* ) (resid  63 and name HD* ) 1.8 0.0 0.5 ! 441
  assign (resid  50 and name HD* ) (resid  65 and name HB1 ) 1.8 0.0 2.0 ! 2775
  assign (resid  50 and name HA  ) (resid  85 and name HE* ) 1.8 0.0 2.7 ! lm  
  assign (resid  50 and name HD* ) (resid  85 and name HB* ) 1.8 0.0 3.2 ! lm  
  assign (resid  50 and name HD* ) (resid  85 and name HE* ) 1.8 0.0 2.7 ! lm  
  assign (resid  50 and name HD* ) (resid 102 and name HB  ) 1.8 0.0 2.4 ! 2827
  assign (resid  50 and name HD* ) (resid 102 and name HG1*) 1.8 0.0 1.4 ! 4203
  assign (resid  50 and name HD* ) (resid 102 and name HG2*) 1.8 0.0 1.5 ! 4104
  assign (resid  50 and name HB1 ) (resid 109 and name HD* ) 1.8 0.0 2.2 ! lm  
  assign (resid  50 and name HD* ) (resid 109 and name HD* ) 1.8 0.0 1.9 ! 4706
  assign (resid  50 and name HD* ) (resid 109 and name HB1 ) 1.8 0.0 2.4 ! 3409
  assign (resid  50 and name HD* ) (resid 111 and name HD* ) 1.8 0.0 0.9 ! 440,4600
  assign (resid  51 and name HN  ) (resid  51 and name HB  ) 1.8 0.0 3.8 ! 513
  assign (resid  51 and name HN  ) (resid  51 and name HG1*) 1.8 0.0 2.1 ! 519
  assign (resid  51 and name HN  ) (resid  51 and name HG2*) 1.8 0.0 1.3 ! 517
  assign (resid  51 and name HA  ) (resid  51 and name HB  ) 2.2 0.0 0.3 
  assign (resid  51 and name HG2*) (resid  52 and name HN  ) 1.8 0.0 2.0 ! 526
  assign (resid  51 and name HN  ) (resid  52 and name HN  ) 1.8 0.0 1.3 ! 509
  assign (resid  51 and name HA  ) (resid  52 and name HN  ) 1.8 0.0 1.5 !
  assign (resid  51 and name HG* ) (resid  53 and name HN  ) 1.8 0.0 3.6 ! 434
  assign (resid  51 and name HA  ) (resid  77 and name HD2*) 1.8 0.0 3.2 ! lm
  assign (resid  51 and name HA  ) (resid  78 and name HD1*) 1.8 0.0 2.7 ! lm
  assign (resid  51 and name HA  ) (resid  78 and name HD2*) 1.8 0.0 2.7 ! lm
  assign (resid  51 and name HG1*) (resid 104 and name HD* ) 1.8 0.0 2.9 ! 3499
  assign (resid  51 and name HG1*) (resid 104 and name HE* ) 1.8 0.0 1.9 ! 2047,1845
  assign (resid  51 and name HG1*) (resid 109 and name HD* ) 1.8 0.0 1.8 ! 4658
  assign (resid  51 and name HG2*) (resid 109 and name HD* ) 1.8 0.0 3.0 ! 3987
  assign (resid  52 and name HN  ) (resid  52 and name HA* ) 1.8 0.0 0.8 ! 524
  assign (resid  52 and name HN  ) (resid  53 and name HN  ) 1.8 0.0 2.5 ! 520
  assign (resid  53 and name HN  ) (resid  53 and name HA  ) 1.8 0.0 0.9 ! 532
  assign (resid  53 and name HN  ) (resid  53 and name HB* ) 1.8 0.0 1.1 ! 533
  assign (resid  53 and name HN  ) (resid  53 and name HG* ) 1.8 0.0 1.9 ! 534
  assign (resid  52 and name HA* ) (resid  53 and name HN  ) 1.8 0.0 1.3 ! 531
  assign (resid  53 and name HA  ) (resid  53 and name HB* ) 2.2 0.0 0.3 
  assign (resid  53 and name HA  ) (resid  78 and name HD* ) 1.8 0.0 2.7 ! lm
  assign (resid  53 and name HN  ) (resid  54 and name HN  ) 1.8 0.0 0.9 ! 528
  assign (resid  53 and name HA  ) (resid  54 and name HN  ) 1.8 0.0 1.5 !     
  assign (resid  53 and name HB* ) (resid  54 and name HN  ) 1.8 0.0 1.9 ! 542
  assign (resid  53 and name HG* ) (resid  54 and name HN  ) 1.8 0.0 2.4 ! 543
  assign (resid  53 and name HD* ) (resid  55 and name HN  ) 1.8 0.0 2.7 ! 549
  assign (resid  54 and name HN  ) (resid  54 and name HA  ) 1.8 0.0 0.9 ! 
  assign (resid  54 and name HN  ) (resid  54 and name HB1 ) 1.8 0.0 1.1 ! 541
  assign (resid  54 and name HN  ) (resid  54 and name HB2 ) 1.8 0.0 0.7 ! 540
  assign (resid  54 and name HA  ) (resid  54 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  54 and name HN  ) (resid  55 and name HN  ) 1.8 0.0 2.4 ! 
  assign (resid  54 and name HA  ) (resid  55 and name HN  ) 1.8 0.0 1.1 ! 546
  assign (resid  55 and name HN  ) (resid  55 and name HA  ) 1.8 0.0 0.9 !   
  assign (resid  55 and name HN  ) (resid  55 and name HB* ) 1.8 0.0 2.0 ! 550
  assign (resid  55 and name HB* ) (resid  55 and name HE  ) 1.8 0.0 2.6 ! 1150
  assign (resid  55 and name HD* ) (resid  55 and name HE  ) 1.8 0.0 2.2 ! 1149,1149
  assign (resid  55 and name HE  ) (resid  55 and name HH1*) 1.8 0.0 3.5 ! 1146
  assign (resid  55 and name HE  ) (resid  55 and name HH2*) 1.8 0.0 3.8 ! 1147
  assign (resid  55 and name HN  ) (resid  56 and name HN  ) 1.8 0.0 1.2 ! 544,552
  assign (resid  55 and name HA  ) (resid  56 and name HN  ) 2.5 0.8 0.8 
  assign (resid  55 and name HB* ) (resid  56 and name HN  ) 1.8 0.0 2.7 ! 557
  assign (resid  56 and name HN  ) (resid  56 and name HB* ) 1.8 0.0 1.3 ! 555
  assign (resid  56 and name HA  ) (resid  56 and name HB* ) 2.2 0.0 0.3 
  assign (resid  56 and name HN  ) (resid  57 and name HN  ) 1.8 0.0 0.9 ! 551
  assign (resid  56 and name HA  ) (resid  57 and name HN  ) 2.5 0.7 0.8 
  assign (resid  56 and name HN  ) (resid  58 and name HN  ) 1.8 0.0 2.9 ! 1372
  assign (resid  56 and name HA  ) (resid  59 and name HD* ) 1.8 0.0 1.1 ! 607,871
  assign (resid  56 and name HA  ) (resid  59 and name HE* ) 1.8 0.0 1.6 ! 608
  assign (resid  56 and name HB* ) (resid  59 and name HD* ) 1.8 0.0 2.2 ! 80 a
  assign (resid  57 and name HN  ) (resid  57 and name HB* ) 1.8 0.0 1.4 ! 562
  assign (resid  57 and name HA  ) (resid  57 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  57 and name HA  ) (resid  57 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  57 and name HN  ) (resid  58 and name HN  ) 1.8 0.0 2.1 ! 559
  assign (resid  57 and name HA  ) (resid  58 and name HN  ) 1.8 0.0 1.5 ! 568
  assign (resid  57 and name HB* ) (resid  58 and name HN  ) 1.8 0.0 1.4 ! 570
  assign (resid  58 and name HN  ) (resid  58 and name HB* ) 1.8 0.0 1.3 ! 572,571
  assign (resid  58 and name HN  ) (resid  58 and name HD* ) 1.8 0.0 2.1 ! 564
  assign (resid  58 and name HA  ) (resid  58 and name HD* ) 1.8 0.0 2.1 ! 54a
  assign (resid  58 and name HB1 ) (resid  58 and name HD* ) 1.8 0.0 2.1 ! 109a
  assign (resid  58 and name HB2 ) (resid  58 and name HD* ) 1.8 0.0 2.1 ! 110a
  assign (resid  58 and name HN  ) (resid  59 and name HN  ) 2.6 0.8 1.2 
  assign (resid  58 and name HD* ) (resid  59 and name HN  ) 1.8 0.0 2.0 ! 79
  assign (resid  58 and name HA  ) (resid  61 and name HB1 ) 1.8 0.0 2.3 ! 652
  assign (resid  58 and name HD* ) (resid  63 and name HD* ) 1.8 0.0 2.7 ! 224a
  assign (resid  58 and name HE* ) (resid  63 and name HD* ) 1.8 0.0 3.5 ! 506
  assign (resid  58 and name HB1 ) (resid  72 and name HG* ) 1.8 0.0 3.1 ! 1886 
  assign (resid  58 and name HB2 ) (resid  72 and name HG* ) 1.8 0.0 3.1 ! 1887
  assign (resid  58 and name HD* ) (resid  72 and name HB  ) 1.8 0.0 2.7 ! 151 a
  assign (resid  58 and name HD* ) (resid  72 and name HG* ) 1.8 0.0 2.0 ! 548,216a
  assign (resid  58 and name HE* ) (resid  72 and name HG* ) 1.8 0.0 3.2 ! a  
  assign (resid  58 and name HD* ) (resid  85 and name HE* ) 1.8 0.0 2.5 ! 145a
  assign (resid  58 and name HE* ) (resid  85 and name HE* ) 1.8 0.0 2.5 ! 143a
  assign (resid  58 and name HZ  ) (resid  85 and name HE* ) 1.8 0.0 2.5 ! 142a
  assign (resid  59 and name HN  ) (resid  59 and name HB2 ) 1.8 0.0 1.0 ! 88
  assign (resid  59 and name HN  ) (resid  59 and name HD* ) 1.8 0.0 1.3 ! 78
  assign (resid  59 and name HA  ) (resid  59 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  59 and name HA  ) (resid  59 and name HD* ) 1.8 0.0 0.9 ! 45 a
  assign (resid  59 and name HB1 ) (resid  59 and name HD1 ) 1.8 0.0 0.9 ! 93 a
  assign (resid  59 and name HB2 ) (resid  59 and name HD2 ) 1.8 0.0 0.9 ! 107 a
  assign (resid  59 and name HA  ) (resid  60 and name HN  ) 1.8 0.0 1.3 !
  assign (resid  59 and name HN  ) (resid  60 and name HN  ) 1.8 0.0 1.8 ! 583,77
  assign (resid  59 and name HA  ) (resid  60 and name HG* ) 1.8 0.0 2.1 ! 590
  assign (resid  59 and name HB1 ) (resid  60 and name HN  ) 1.8 0.0 2.5 ! 587
  assign (resid  59 and name HB2 ) (resid  60 and name HN  ) 1.8 0.0 2.0 ! 588
  assign (resid  59 and name HB* ) (resid  60 and name HG* ) 1.8 0.0 1.2 ! 2165,1851
  assign (resid  59 and name HB2 ) (resid  60 and name HG* ) 1.8 0.0 3.9 ! 1851
  assign (resid  59 and name HN  ) (resid  61 and name HN  ) 3.1 1.3 1.3 
  assign (resid  59 and name HA  ) (resid  61 and name HN  ) 1.8 0.0 2.8 ! 266
  assign (resid  59 and name HA  ) (resid  72 and name HB  ) 1.8 0.0 3.2 ! 910
  assign (resid  59 and name HD* ) (resid  72 and name HG* ) 1.8 0.0 3.2 ! 550
  assign (resid  59 and name HE* ) (resid  72 and name HG* ) 1.8 0.0 3.2 ! 215a 
  assign (resid  59 and name HB1 ) (resid  85 and name HE* ) 1.8 0.0 3.2 ! 1639 
  assign (resid  60 and name HN  ) (resid  60 and name HB  ) 1.8 0.0 1.6 ! 590
  assign (resid  60 and name HN  ) (resid  60 and name HG* ) 1.8 0.0 1.3 ! 591
  assign (resid  60 and name HA  ) (resid  60 and name HB  ) 2.2 0.0 0.5 
  assign (resid  60 and name HN  ) (resid  61 and name HN  ) 1.8 0.0 1.5 ! 582
  assign (resid  60 and name HB  ) (resid  61 and name HN  ) 1.8 0.0 1.7 ! 605
  assign (resid  60 and name HG* ) (resid  61 and name HN  ) 1.8 0.0 2.0 ! 606
  assign (resid  60 and name HN  ) (resid  62 and name HN  ) 3.0 1.2 1.2 ! 1018
  assign (resid  61 and name HN  ) (resid  61 and name HA  ) 1.8 0.0 1.0 ! 600
  assign (resid  61 and name HN  ) (resid  61 and name HB1 ) 1.8 0.0 1.4 ! 604
  assign (resid  61 and name HN  ) (resid  61 and name HB2 ) 1.8 0.0 1.6 ! 603
  assign (resid  61 and name HN  ) (resid  61 and name HD2*) 1.8 0.0 1.1 ! 598
  assign (resid  61 and name HA  ) (resid  61 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  61 and name HA  ) (resid  61 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  61 and name HB1 ) (resid  61 and name HD2*) 1.8 0.0 1.5 ! 1116,1117
  assign (resid  61 and name HB2 ) (resid  61 and name HD2*) 1.8 0.0 2.6 ! 1115
  assign (resid  61 and name HN  ) (resid  62 and name HN  ) 1.8 0.0 0.9 ! 599,592
  assign (resid  61 and name HB1 ) (resid  62 and name HN  ) 1.8 0.0 2.3 ! 597
  assign (resid  61 and name HB2 ) (resid  62 and name HN  ) 1.8 0.0 2.3 ! 596
  assign (resid  61 and name HB2 ) (resid  69 and name HE* ) 1.8 0.0 1.4 ! 1843,1847
  assign (resid  62 and name HN  ) (resid  62 and name HA* ) 1.8 0.0 1.2 ! 595,594
  assign (resid  62 and name HN  ) (resid  63 and name HN  ) 1.8 0.0 2.2 
  assign (resid  62 and name HA* ) (resid  63 and name HN  ) 1.8 0.0 1.1 ! 267,265
  assign (resid  62 and name HA* ) (resid  63 and name HD* ) 1.8 0.0 2.5 ! 146
  assign (resid  62 and name HA* ) (resid  71 and name HB1 ) 1.8 0.0 1.3 ! 1012,1316
  assign (resid  63 and name HN  ) (resid  63 and name HB* ) 1.8 0.0 2.0 ! 271
  assign (resid  63 and name HN  ) (resid  63 and name HG  ) 1.8 0.0 1.5 ! 272
  assign (resid  63 and name HN  ) (resid  63 and name HD* ) 1.8 0.0 1.9 ! 273
  assign (resid  63 and name HA  ) (resid  63 and name HB* ) 2.2 0.0 0.3 
  assign (resid  63 and name HA  ) (resid  64 and name HG2*) 1.8 0.0 1.5 ! 402,654
  assign (resid  63 and name HA  ) (resid  64 and name HN  ) 1.8 0.0 1.2 ! 609
  assign (resid  63 and name HB* ) (resid  64 and name HN  ) 1.8 0.0 1.1 ! 612
  assign (resid  63 and name HD* ) (resid  64 and name HN  ) 1.8 0.0 2.3 ! 616
  assign (resid  63 and name HD* ) (resid  65 and name HN  ) 1.8 0.0 4.9 
  assign (resid  63 and name HN  ) (resid  70 and name HN  ) 1.8 0.0 1.6 ! 662,262
  assign (resid  63 and name HD* ) (resid  70 and name HN  ) 1.8 0.0 2.8 ! 670
  assign (resid  63 and name HD* ) (resid  70 and name HB* ) 1.8 0.0 2.7 ! 2256,2023
  assign (resid  63 and name HN  ) (resid  72 and name HN  ) 3.1 1.3 1.3 
  assign (resid  63 and name HG  ) (resid  72 and name HG1*) 1.8 0.0 2.6 ! 3612
  assign (resid  63 and name HD* ) (resid  77 and name HD* ) 1.8 0.0 3.2 ! 2262
  assign (resid  63 and name HG  ) (resid  85 and name HE* ) 1.8 0.0 1.5 ! 1698
  assign (resid  63 and name HD* ) (resid  85 and name HE* ) 1.8 0.0 1.8 ! 2746
  assign (resid  63 and name HG  ) (resid  87 and name HD* ) 1.8 0.0 2.4 ! 4001
  assign (resid  63 and name HD* ) (resid  87 and name HD* ) 1.8 0.0 1.4 ! 4619
  assign (resid  63 and name HD* ) (resid 109 and name HD* ) 1.8 0.0 2.1 ! 4710
  assign (resid  63 and name HD* ) (resid 111 and name HD* ) 1.8 0.0 2.1 ! 4603
  assign (resid  64 and name HN  ) (resid  64 and name HB  ) 1.8 0.0 2.9 ! 610
  assign (resid  64 and name HN  ) (resid  64 and name HG2*) 1.8 0.0 1.5 ! 614
  assign (resid  64 and name HA  ) (resid  64 and name HB  ) 2.2 0.0 0.3 
  assign (resid  64 and name HN  ) (resid  65 and name HN  ) 1.8 0.0 2.2 ! 619
  assign (resid  64 and name HA  ) (resid  65 and name HN  ) 1.8 0.0 0.8 ! 611,622
  assign (resid  64 and name HB  ) (resid  65 and name HN  ) 1.8 0.0 1.6 ! 884,624
  assign (resid  64 and name HG2*) (resid  65 and name HN  ) 1.8 0.0 1.9 ! 555
  assign (resid  64 and name HB  ) (resid  67 and name HN  ) 1.8 0.0 1.5 ! 639
  assign (resid  64 and name HB  ) (resid  67 and name HA* ) 1.8 0.0 1.9 ! 1674
  assign (resid  64 and name HG2*) (resid  67 and name HA* ) 1.8 0.0 2.9 ! 1106
  assign (resid  64 and name HG2*) (resid  68 and name HA  ) 1.8 0.0 3.2 ! lm   
  assign (resid  64 and name HA  ) (resid  69 and name HA  ) 1.8 0.0 1.2 ! 77,1134
  assign (resid  64 and name HG2*) (resid  69 and name HN  ) 1.8 0.0 4.2 ! 659
  assign (resid  64 and name HG2*) (resid  69 and name HA  ) 1.8 0.0 0.7 ! 1114
  assign (resid  64 and name HG2*) (resid  69 and name HG* ) 1.8 0.0 2.3 ! 2957
  assign (resid  64 and name HN  ) (resid  70 and name HN  ) 1.8 0.0 2.4 ! 1403
  assign (resid  64 and name HA  ) (resid  70 and name HN  ) 1.8 0.0 1.5 ! 663
  assign (resid  64 and name HG2*) (resid  70 and name HN  ) 1.8 0.0 2.2 ! 669
  assign (resid  64 and name HN  ) (resid 111 and name HD* ) 1.8 0.0 3.5 ! 617
  assign (resid  65 and name HN  ) (resid  65 and name HB1 ) 1.8 0.0 1.7 ! 626
  assign (resid  65 and name HN  ) (resid  65 and name HB2 ) 1.8 0.0 1.9 ! 631
  assign (resid  65 and name HN  ) (resid  65 and name HG  ) 1.8 0.0 2.1 ! 627
  assign (resid  65 and name HN  ) (resid  65 and name HD* ) 1.8 0.0 1.2 ! 630,32
  assign (resid  65 and name HA  ) (resid  65 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  65 and name HA  ) (resid  65 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  65 and name HA  ) (resid  66 and name HN  ) 2.0 0.3 0.3 
  assign (resid  65 and name HN  ) (resid  66 and name HN  ) 3.0 1.2 1.2 
  assign (resid  65 and name HN  ) (resid  68 and name HN  ) 1.8 0.0 0.6 ! 620,644
  assign (resid  65 and name HN  ) (resid  70 and name HN  ) 1.8 0.0 2.3 ! 1109
  assign (resid  65 and name HD* ) (resid  87 and name HD* ) 1.8 0.0 2.1 ! 3935
  assign (resid  65 and name HD* ) (resid 100 and name HG2*) 1.8 0.0 1.7 ! 4151
  assign (resid  65 and name HB2 ) (resid 111 and name HD* ) 1.8 0.0 1.4 ! 3962
  assign (resid  65 and name HD* ) (resid 111 and name HD* ) 1.8 0.0 0.5 ! 1523,3910,446
  assign (resid  65 and name HD* ) (resid 113 and name HE* ) 1.8 0.0 2.7 ! a      
  assign (resid  66 and name HN  ) (resid  66 and name HA* ) 1.8 0.0 1.6 ! 1075,1074
  assign (resid  66 and name HN  ) (resid  67 and name HN  ) 1.8 0.0 1.6 ! 1071
  assign (resid  66 and name HA* ) (resid  67 and name HN  ) 1.8 0.0 2.7 ! 641
  assign (resid  66 and name HN  ) (resid  68 and name HN  ) 1.8 0.0 1.8 ! 1146,
  assign (resid  67 and name HN  ) (resid  67 and name HA* ) 1.8 0.0 1.2 ! 638,637
  assign (resid  67 and name HA* ) (resid  68 and name HN  ) 1.8 0.0 2.2 ! 645
  assign (resid  67 and name HN  ) (resid  68 and name HN  ) 1.8 0.0 2.0 ! 634
  assign (resid  68 and name HN  ) (resid  68 and name HB1 ) 1.8 0.0 1.2 ! 647
  assign (resid  68 and name HN  ) (resid  68 and name HB2 ) 1.8 0.0 1.7 ! 646
  assign (resid  68 and name HA  ) (resid  68 and name HB1 ) 1.8 0.0 0.9 
  assign (resid  68 and name HA  ) (resid  68 and name HB2 ) 1.8 0.0 0.6 
  assign (resid  68 and name HN  ) (resid  69 and name HN  ) 1.8 0.0 2.7 ! 643
  assign (resid  68 and name HA  ) (resid  69 and name HN  ) 1.8 0.0 1.0 ! 654
  assign (resid  68 and name HB1 ) (resid  69 and name HN  ) 1.8 0.0 2.5 ! 660
  assign (resid  68 and name HE2*) (resid  69 and name HN  ) 1.8 0.0 2.1 ! 651,1097,652
  assign (resid  68 and name HG* ) (resid  89 and name HG2*) 1.8 0.0 1.1 ! 2343,3815
  assign (resid  68 and name HE2*) (resid  89 and name HB  ) 1.8 0.0 2.4 ! 1094,1095
  assign (resid  68 and name HE2*) (resid  90 and name HN  ) 1.8 0.0 2.1 ! 813
  assign (resid  68 and name HG* ) (resid 113 and name HE* ) 1.8 0.0 2.7 ! a      
  assign (resid  69 and name HN  ) (resid  69 and name HG* ) 1.8 0.0 1.9 ! 658,657
  assign (resid  69 and name HN  ) (resid  69 and name HD* ) 1.8 0.0 1.9 ! 656
  assign (resid  69 and name HA  ) (resid  70 and name HN  ) 1.8 0.0 1.0 ! 665
  assign (resid  69 and name HG* ) (resid  70 and name HN  ) 1.8 0.0 1.9 ! 1010
  assign (resid  70 and name HN  ) (resid  70 and name HB1 ) 1.8 0.0 1.3 ! 666
  assign (resid  70 and name HA  ) (resid  70 and name HB1 ) 1.8 0.0 0.6 
  assign (resid  70 and name HA  ) (resid  70 and name HB2 ) 1.8 0.0 0.6 
  assign (resid  70 and name HN  ) (resid  71 and name HN  ) 1.8 0.0 2.4 ! 661
  assign (resid  70 and name HA  ) (resid  71 and name HN  ) 1.8 0.0 1.0 ! 673
  assign (resid  70 and name HB1 ) (resid  71 and name HN  ) 1.8 0.0 2.0 ! 677
  assign (resid  70 and name HB1 ) (resid  87 and name HD* ) 1.8 0.0 2.2 ! 1994
  assign (resid  70 and name HB2 ) (resid  87 and name HD* ) 1.8 0.0 2.2 ! lm  
  assign (resid  70 and name HB2 ) (resid  87 and name HB2 ) 1.8 0.0 2.2 ! lm  
  assign (resid  70 and name HA  ) (resid  89 and name HA  ) 1.8 0.0 0.9 ! 192
  assign (resid  70 and name HA  ) (resid  89 and name HB  ) 1.8 0.0 2.5 ! 592
  assign (resid  70 and name HA  ) (resid  89 and name HG2*) 1.8 0.0 3.3 ! 193
  assign (resid  70 and name HA  ) (resid  90 and name HN  ) 1.8 0.0 1.9 ! 143,210
  assign (resid  70 and name HA  ) (resid  90 and name HG* ) 1.8 0.0 1.8 ! 775,160
  assign (resid  70 and name HB2 ) (resid 100 and name HB  ) 1.8 0.0 2.2 ! 3192
  assign (resid  71 and name HN  ) (resid  71 and name HB1 ) 1.8 0.0 2.0 ! 676
  assign (resid  71 and name HN  ) (resid  71 and name HB2 ) 1.8 0.0 2.1 ! 675
  assign (resid  71 and name HA  ) (resid  71 and name HB1 ) 2.2 0.0 0.5 
  assign (resid  71 and name HA  ) (resid  71 and name HB2 ) 2.2 0.0 0.5 
  assign (resid  71 and name HA  ) (resid  72 and name HN  ) 1.8 0.0 0.9 ! 705
  assign (resid  71 and name HB2 ) (resid  73 and name HD1*) 1.8 0.0 2.3 ! 1508
  assign (resid  71 and name HN  ) (resid  87 and name HD* ) 1.8 0.0 3.1 ! 682
  assign (resid  71 and name HN  ) (resid  88 and name HN  ) 1.8 0.0 1.9 ! 671
  assign (resid  71 and name HB1 ) (resid  88 and name HN  ) 1.8 0.0 2.5 ! 796
  assign (resid  71 and name HN  ) (resid  89 and name HN  ) 1.8 0.0 2.8 ! 805
  assign (resid  71 and name HN  ) (resid  89 and name HA  ) 1.8 0.0 2.2 ! 91
  assign (resid  71 and name HN  ) (resid  90 and name HN  ) 1.8 0.0 2.8 ! 672,136
  assign (resid  71 and name HN  ) (resid  90 and name HG* ) 1.8 0.0 2.5 ! 681
  assign (resid  72 and name HN  ) (resid  72 and name HB  ) 1.8 0.0 1.4 ! 687
  assign (resid  72 and name HA  ) (resid  72 and name HB  ) 2.2 0.0 0.6 
  assign (resid  72 and name HN  ) (resid  72 and name HG1*) 1.8 0.0 2.3 ! 689
  assign (resid  72 and name HN  ) (resid  72 and name HG2*) 1.8 0.0 1.6 ! 688
  assign (resid  72 and name HN  ) (resid  73 and name HN  ) 3.1 1.3 1.3 
  assign (resid  72 and name HA  ) (resid  73 and name HN  ) 1.8 0.0 1.3 ! 698
  assign (resid  72 and name HG1*) (resid  73 and name HN  ) 1.8 0.0 2.2 ! 704
  assign (resid  72 and name HG2*) (resid  73 and name HA  ) 1.8 0.0 3.4 ! 1108
  assign (resid  72 and name HG1*) (resid  74 and name HN  ) 1.8 0.0 2.1 ! 581
  assign (resid  72 and name HG* ) (resid  75 and name HA  ) 1.8 0.0 2.3 ! 317
  assign (resid  72 and name HG2*) (resid  75 and name HB1 ) 1.8 0.0 2.6 ! 4750
  assign (resid  72 and name HG2*) (resid  75 and name HB2 ) 1.8 0.0 2.6 ! 1863
  assign (resid  72 and name HG1*) (resid  75 and name HN  ) 1.8 0.0 2.7 ! 712
  assign (resid  72 and name HG* ) (resid  85 and name HB* ) 1.8 0.0 2.0 ! 2347
  assign (resid  72 and name HG1*) (resid  85 and name HE* ) 1.8 0.0 1.8 ! 2972
  assign (resid  72 and name HA  ) (resid  86 and name HB1 ) 1.8 0.0 3.2 ! 1367
  assign (resid  72 and name HA  ) (resid  87 and name HA  ) 1.8 0.0 2.2 ! Peak   
  assign (resid  72 and name HA  ) (resid  87 and name HD* ) 1.8 0.0 2.0 ! 4128
  assign (resid  72 and name HG2*) (resid  87 and name HD* ) 1.8 0.0 2.5 ! 4621
  assign (resid  72 and name HA  ) (resid  87 and name HA  ) 1.8 0.0 1.3 ! 54
  assign (resid  72 and name HA  ) (resid  87 and name HG  ) 1.8 0.0 2.6 ! 1279
  assign (resid  72 and name HG* ) (resid  87 and name HA  ) 1.8 0.0 2.6 ! 238,244
  assign (resid  72 and name HG1*) (resid  87 and name HD* ) 1.8 0.0 1.2 ! 4286
  assign (resid  72 and name HN  ) (resid  88 and name HN  ) 1.8 0.0 2.7 ! 1108,  as
  assign (resid  72 and name HA  ) (resid  88 and name HN  ) 3.0 1.2 1.2 
  assign (resid  73 and name HA  ) (resid  73 and name HB  ) 2.2 0.0 0.6 
  assign (resid  73 and name HN  ) (resid  73 and name HB  ) 1.8 0.0 2.0 ! 699
  assign (resid  73 and name HN  ) (resid  73 and name HG1*) 1.8 0.0 2.4 ! 701,700
  assign (resid  73 and name HN  ) (resid  73 and name HG2*) 1.8 0.0 3.7 ! 702
  assign (resid  73 and name HN  ) (resid  73 and name HD1*) 1.8 0.0 2.6 ! 703
  assign (resid  73 and name HG1*) (resid  73 and name HD1*) 1.8 0.0 1.2 ! 3231
  assign (resid  73 and name HG2*) (resid  74 and name HB* ) 1.8 0.0 2.1 ! 3096
  assign (resid  73 and name HN  ) (resid  74 and name HN  ) 1.8 0.0 1.2 ! 563
  assign (resid  73 and name HB  ) (resid  74 and name HN  ) 1.8 0.0 2.4 ! 577
  assign (resid  73 and name HA  ) (resid  74 and name HN  ) 2.4 0.6 0.6 
  assign (resid  73 and name HN  ) (resid  86 and name HN  ) 3.0 1.2 1.2 
  assign (resid  73 and name HG2*) (resid  86 and name HB2 ) 1.8 0.0 3.0 ! 4165
  assign (resid  73 and name HB  ) (resid  86 and name HB1 ) 1.8 0.0 2.2 ! 1636,1570
  assign (resid  73 and name HB  ) (resid  86 and name HB2 ) 1.8 0.0 1.2 ! 2083,1569
  assign (resid  73 and name HG2*) (resid  86 and name HB* ) 1.8 0.0 1.4 ! 1401
  assign (resid  73 and name HD1*) (resid  86 and name HB* ) 1.8 0.0 2.0 ! 1261
  assign (resid  73 and name HN  ) (resid  87 and name HA  ) 1.8 0.0 2.1 ! 695
  assign (resid  73 and name HG1*) (resid  87 and name HA  ) 1.8 0.0 3.2 ! lm 
  assign (resid  73 and name HN  ) (resid  88 and name HN  ) 1.8 0.0 2.3 ! 802
  assign (resid  73 and name HG1*) (resid  88 and name HB* ) 1.8 0.0 2.9 ! 3776
  assign (resid  73 and name HG1*) (resid  88 and name HG* ) 1.8 0.0 2.1 ! 3346
  assign (resid  73 and name HD1*) (resid  88 and name HB* ) 1.8 0.0 3.0 ! 3219
  assign (resid  73 and name HD1*) (resid  88 and name HG* ) 1.8 0.0 3.0 ! 3996
  assign (resid  73 and name HD1*) (resid  88 and name HD* ) 1.8 0.0 1.2 ! 4172,1151,1676
  assign (resid  73 and name HD1*) (resid  90 and name HB1 ) 1.8 0.0 2.8 ! 3220,2628
  assign (resid  74 and name HN  ) (resid  74 and name HB* ) 1.8 0.0 1.4 ! 575
  assign (resid  74 and name HB* ) (resid  74 and name HE  ) 1.8 0.0 2.4 ! 1161
  assign (resid  74 and name HG* ) (resid  74 and name HE  ) 1.8 0.0 2.8 ! 1162
  assign (resid  74 and name HD* ) (resid  74 and name HE  ) 1.8 0.0 1.5 ! 1159
  assign (resid  74 and name HN  ) (resid  75 and name HN  ) 3.1 1.3 1.3 
  assign (resid  74 and name HA  ) (resid  75 and name HN  ) 1.8 0.0 0.6 ! 707
  assign (resid  74 and name HB* ) (resid  75 and name HN  ) 1.8 0.0 2.4 ! 710
  assign (resid  74 and name HG* ) (resid  75 and name HN  ) 1.8 0.0 2.3 ! 711
  assign (resid  74 and name HB* ) (resid  76 and name HB* ) 1.8 0.0 2.4 ! 697
  assign (resid  74 and name HN  ) (resid  86 and name HN  ) 1.8 0.0 2.4 ! 774
  assign (resid  74 and name HN  ) (resid  86 and name HB2 ) 1.8 0.0 2.5 ! 573
  assign (resid  74 and name HB* ) (resid  86 and name HN  ) 1.8 0.0 2.0 ! 781
  assign (resid  74 and name HB* ) (resid  86 and name HB2 ) 1.8 0.0 2.2 ! lm 
  assign (resid  75 and name HN  ) (resid  75 and name HB1 ) 1.8 0.0 2.1 ! 709
  assign (resid  75 and name HN  ) (resid  75 and name HB2 ) 1.8 0.0 1.6 ! 708
  assign (resid  75 and name HA  ) (resid  75 and name HB1 ) 2.2 0.0 0.6 
  assign (resid  75 and name HN  ) (resid  76 and name HN  ) 3.1 1.3 1.3 
  assign (resid  75 and name HA  ) (resid  76 and name HN  ) 1.8 0.0 1.1 ! 715
  assign (resid  75 and name HA  ) (resid  75 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  75 and name HN  ) (resid  85 and name HA  ) 1.8 0.0 3.0 
  assign (resid  75 and name HA  ) (resid  85 and name HB2 ) 1.8 0.0 1.7 ! 254,857
  assign (resid  75 and name HA  ) (resid  85 and name HG* ) 1.8 0.0 1.2 ! 340,855
  assign (resid  75 and name HB2 ) (resid  85 and name HG* ) 1.8 0.0 2.7 ! lm
  assign (resid  75 and name HB1 ) (resid  85 and name HE* ) 1.8 0.0 1.9 ! 2101,2874
  assign (resid  75 and name HB2 ) (resid  85 and name HE* ) 1.8 0.0 1.7 ! 1924,2177
  assign (resid  76 and name HN  ) (resid  76 and name HB2 ) 1.8 0.0 1.6 ! 22
  assign (resid  76 and name HA  ) (resid  76 and name HB* ) 2.2 0.0 0.3 
  assign (resid  76 and name HN  ) (resid  77 and name HD* ) 1.8 0.0 3.3 ! 717
  assign (resid  76 and name HN  ) (resid  77 and name HN  ) 1.8 0.0 1.2 ! 719,713
  assign (resid  76 and name HA  ) (resid  77 and name HN  ) 2.5 0.8 0.8 
  assign (resid  76 and name HB1 ) (resid  82 and name HB1 ) 1.8 0.0 1.4 ! 1221
  assign (resid  76 and name HB2 ) (resid  82 and name HB1 ) 1.8 0.0 2.3 ! 2318
  assign (resid  76 and name HB1 ) (resid  82 and name HG* ) 1.8 0.0 1.6 ! 2312,1183
  assign (resid  76 and name HB2 ) (resid  82 and name HG* ) 1.8 0.0 1.4 ! 2313,1475
  assign (resid  76 and name HN  ) (resid  85 and name HB1 ) 1.8 0.0 2.6 ! 716
  assign (resid  77 and name HN  ) (resid  77 and name HB1 ) 1.8 0.0 1.5 ! 724
  assign (resid  77 and name HN  ) (resid  77 and name HB2 ) 1.8 0.0 1.6 ! 723
  assign (resid  77 and name HN  ) (resid  77 and name HD* ) 1.8 0.0 2.7 ! 725
  assign (resid  77 and name HA  ) (resid  77 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  77 and name HA  ) (resid  83 and name HA  ) 1.8 0.0 1.6 ! 1451
  assign (resid  77 and name HA  ) (resid  83 and name HB1 ) 1.8 0.0 2.0 ! lm  
  assign (resid  77 and name HA  ) (resid  83 and name HB2 ) 1.8 0.0 2.0 ! lm  
  assign (resid  77 and name HB2 ) (resid  85 and name HE* ) 1.8 0.0 1.5 ! 5088
  assign (resid  77 and name HD* ) (resid  85 and name HG* ) 1.8 0.0 1.6 ! 2128
  assign (resid  77 and name HD* ) (resid  85 and name HE* ) 1.8 0.0 0.9 ! 2785,4433
  assign (resid  77 and name HD* ) (resid  87 and name HD* ) 1.8 0.0 1.6 ! 4061
  assign (resid  77 and name HD* ) (resid 104 and name HB1 ) 1.8 0.0 1.7 ! lm  
  assign (resid  77 and name HD* ) (resid 104 and name HB2 ) 1.8 0.0 1.7 ! lm  
  assign (resid  77 and name HD* ) (resid 104 and name HD* ) 1.8 0.0 2.0 ! 3868
  assign (resid  77 and name HD* ) (resid 109 and name HD* ) 1.8 0.0 1.0 ! 4136
  assign (resid  78 and name HN  ) (resid  78 and name HG  ) 1.8 0.0 1.4 ! 291
  assign (resid  78 and name HA  ) (resid  78 and name HB2 ) 2.2 0.0 0.5 
  assign (resid  78 and name HA  ) (resid  79 and name HN  ) 2.4 0.6 0.6 
  assign (resid  78 and name HA  ) (resid  83 and name HA  ) 1.8 0.0 1.9 ! 1804
  assign (resid  78 and name HA  ) (resid  83 and name HD* ) 1.8 0.0 2.7 ! 58 a
  assign (resid  79 and name HN  ) (resid  79 and name HB1 ) 1.8 0.0 1.1 ! 734
  assign (resid  79 and name HN  ) (resid  79 and name HG* ) 1.8 0.0 1.3 ! 756,735
  assign (resid  79 and name HN  ) (resid  79 and name HE2*) 1.8 0.0 2.9 ! 751
  assign (resid  79 and name HA  ) (resid  79 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  79 and name HA  ) (resid  79 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  79 and name HB1 ) (resid  79 and name HE2*) 1.8 0.0 2.8 ! 1122
  assign (resid  79 and name HB2 ) (resid  79 and name HE2*) 1.8 0.0 3.3 ! 1128
  assign (resid  79 and name HB2 ) (resid  79 and name HG* ) 1.8 0.0 0.4 ! 2231
  assign (resid  79 and name HG* ) (resid  79 and name HE2*) 1.8 0.0 3.4 ! 1127
  assign (resid  79 and name HG* ) (resid  79 and name HE2*) 1.8 0.0 2.5 ! 1121
  assign (resid  79 and name HN  ) (resid  80 and name HN  ) 1.8 0.0 1.6 ! 727
  assign (resid  79 and name HA  ) (resid  80 and name HN  ) 1.8 0.0 1.3 ! 740
  assign (resid  79 and name HN  ) (resid  81 and name HN  ) 1.8 0.0 3.5 
  assign (resid  79 and name HN  ) (resid  83 and name HN  ) 1.8 0.0 2.8 
  assign (resid  79 and name HN  ) (resid  83 and name HA  ) 1.8 0.0 2.4 ! 730
  assign (resid  79 and name HG* ) (resid  83 and name HD* ) 1.8 0.0 2.3 ! 2555
  assign (resid  80 and name HN  ) (resid  80 and name HB* ) 1.8 0.0 1.4 ! 738
  assign (resid  80 and name HA  ) (resid  80 and name HB* ) 2.2 0.0 0.3 
  assign (resid  80 and name HN  ) (resid  81 and name HN  ) 3.0 1.2 1.2 
  assign (resid  80 and name HN  ) (resid  83 and name HN  ) 1.8 0.0 2.4 
  assign (resid  81 and name HN  ) (resid  81 and name HA* ) 1.8 0.0 3.2 ! 745
  assign (resid  81 and name HN  ) (resid  82 and name HN  ) 1.8 0.0 2.3 ! 748
  assign (resid  81 and name HA* ) (resid  82 and name HN  ) 1.8 0.0 2.2 ! 753
  assign (resid  82 and name HN  ) (resid  82 and name HB1 ) 1.8 0.0 1.6 ! 755
  assign (resid  82 and name HN  ) (resid  82 and name HB2 ) 1.8 0.0 1.6 ! 754
  assign (resid  82 and name HA  ) (resid  82 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  82 and name HN  ) (resid  83 and name HN  ) 1.8 0.0 1.2 ! 728
  assign (resid  82 and name HA  ) (resid  83 and name HN  ) 2.6 0.8 0.8 
  assign (resid  82 and name HB1 ) (resid  83 and name HN  ) 1.8 0.0 1.5 ! 759
  assign (resid  82 and name HA  ) (resid 128 and name HE* ) 1.8 0.8 2.7 !
  assign (resid  83 and name HN  ) (resid  83 and name HD* ) 1.8 0.0 1.4 ! 757
  assign (resid  83 and name HA  ) (resid  83 and name HB2 ) 1.8 0.0 0.8 
  assign (resid  83 and name HB1 ) (resid  83 and name HD1 ) 1.8 0.0 1.2 ! 83 a
  assign (resid  83 and name HB2 ) (resid  83 and name HD2 ) 1.8 0.0 1.4 ! 94 a
  assign (resid  83 and name HN  ) (resid  84 and name HN  ) 3.0 1.2 1.2 
  assign (resid  83 and name HB1 ) (resid 103 and name HG2*) 1.8 0.0 3.2 ! 2320
  assign (resid  83 and name HB2 ) (resid 103 and name HG2*) 1.8 0.0 4.2 ! 1375
  assign (resid  83 and name HD* ) (resid 103 and name HB  ) 1.8 0.0 1.3 ! 2089
  assign (resid  83 and name HD* ) (resid 103 and name HG2*) 1.8 0.0 2.3 ! 2089
  assign (resid  83 and name HB2 ) (resid 104 and name HN  ) 1.8 0.0 3.0 ! 23
  assign (resid  84 and name HN  ) (resid  84 and name HB* ) 1.8 0.0 2.2 ! 763
  assign (resid  84 and name HA  ) (resid  84 and name HB* ) 2.2 0.0 0.3 
  assign (resid  84 and name HN  ) (resid  85 and name HN  ) 1.8 0.0 2.6 
  assign (resid  84 and name HA  ) (resid  85 and name HN  ) 1.8 0.0 1.3 ! 766,621
  assign (resid  84 and name HB* ) (resid  85 and name HN  ) 1.8 0.0 2.2 ! 768
  assign (resid  84 and name HB* ) (resid 101 and name HG2*) 1.8 0.0 1.5 ! 681,682,2708
  assign (resid  84 and name HA  ) (resid 102 and name HN  ) 1.8 0.0 2.3 
  assign (resid  84 and name HA  ) (resid 103 and name HA  ) 1.8 0.0 0.9 ! 8,22
  assign (resid  84 and name HA  ) (resid 103 and name HG2*) 1.8 0.0 1.0 ! 529,12,3743
  assign (resid  84 and name HB* ) (resid 103 and name HA  ) 1.8 0.0 2.0 ! 39
  assign (resid  84 and name HB* ) (resid 103 and name HG2*) 1.8 0.0 0.8 ! 337,336
  assign (resid  84 and name HA  ) (resid 104 and name HN  ) 1.8 0.0 3.2 
  assign (resid  84 and name HB* ) (resid 128 and name HD* ) 1.8 0.0 2.6 ! 1933
  assign (resid  85 and name HN  ) (resid  85 and name HB2 ) 1.8 0.0 2.0 ! 770
  assign (resid  85 and name HN  ) (resid  86 and name HN  ) 3.0 1.2 1.2 
  assign (resid  85 and name HA  ) (resid  86 and name HN  ) 2.0 0.3 0.3 ! 630
  assign (resid  85 and name HB1 ) (resid  86 and name HN  ) 1.8 0.0 2.2 ! 780
  assign (resid  85 and name HB1 ) (resid  87 and name HD* ) 1.8 0.0 2.6 ! 4354
  assign (resid  85 and name HB2 ) (resid  87 and name HD* ) 1.8 0.0 2.7 ! lm   
  assign (resid  85 and name HG* ) (resid  87 and name HD* ) 1.8 0.0 2.2 ! 4542
  assign (resid  85 and name HE* ) (resid  87 and name HG  ) 1.8 0.0 1.9 ! 3052
  assign (resid  85 and name HE* ) (resid  87 and name HD* ) 1.8 0.0 1.8 ! 2713
  assign (resid  85 and name HN  ) (resid 101 and name HG2*) 1.8 0.0 2.3 ! 771
  assign (resid  85 and name HN  ) (resid 102 and name HN  ) 1.8 0.0 1.4 ! 765
  assign (resid  85 and name HB2 ) (resid 102 and name HB  ) 1.8 0.0 2.7 ! lm 
  assign (resid  85 and name HB1 ) (resid 102 and name HG1*) 1.8 0.0 2.2 ! lm 
  assign (resid  85 and name HB2 ) (resid 102 and name HG1*) 1.8 0.0 2.2 ! lm 
  assign (resid  85 and name HE* ) (resid 102 and name HG2*) 1.8 0.0 3.2 ! lm 
  assign (resid  85 and name HN  ) (resid 103 and name HN  ) 1.8 0.0 2.8 ! 1131
  assign (resid  85 and name HN  ) (resid 103 and name HA  ) 1.8 0.0 2.2 
  assign (resid  86 and name HN  ) (resid  86 and name HB2 ) 1.8 0.0 1.4 ! 779
  assign (resid  86 and name HA  ) (resid  86 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  86 and name HN  ) (resid  87 and name HN  ) 1.8 0.0 2.8 ! 783
  assign (resid  86 and name HA  ) (resid  87 and name HN  ) 1.8 0.0 1.1 ! 785
  assign (resid  86 and name HB1 ) (resid  87 and name HN  ) 1.8 0.0 2.7 ! 789
  assign (resid  86 and name HA  ) (resid  87 and name HD1*) 1.8 0.0 1.7 ! lm 
  assign (resid  86 and name HA  ) (resid 101 and name HA  ) 1.8 0.0 0.9 ! 5,14
  assign (resid  86 and name HA  ) (resid 101 and name HG2*) 1.8 0.0 2.2 ! lm  
  assign (resid  86 and name HA  ) (resid 102 and name HN  ) 1.8 0.0 2.0 ! 884
  assign (resid  87 and name HN  ) (resid  87 and name HB1 ) 1.8 0.0 1.6 ! 792
  assign (resid  87 and name HN  ) (resid  87 and name HB2 ) 1.8 0.0 2.1 ! 791
  assign (resid  87 and name HN  ) (resid  87 and name HD* ) 1.8 0.0 1.9 ! 793
  assign (resid  87 and name HA  ) (resid  87 and name HB1 ) 1.8 0.0 0.5 
  assign (resid  87 and name HA  ) (resid  87 and name HB2 ) 1.8 0.0 0.9 
  assign (resid  87 and name HA  ) (resid  87 and name HD* ) 1.8 0.0 1.1 ! 4488
  assign (resid  87 and name HB2 ) (resid  87 and name HD* ) 1.8 0.0 0.9 ! 2703
  assign (resid  87 and name HN  ) (resid  88 and name HN  ) 3.0 1.2 1.2 
  assign (resid  87 and name HA  ) (resid  88 and name HN  ) 1.8 0.0 1.1 ! 795,634
  assign (resid  87 and name HB* ) (resid  88 and name HN  ) 1.8 0.0 1.6 ! 912
  assign (resid  87 and name HN  ) (resid 100 and name HN  ) 1.8 0.0 2.3 ! 784
  assign (resid  87 and name HB* ) (resid 100 and name HB  ) 1.8 0.0 2.2 ! lm  
  assign (resid  87 and name HD* ) (resid 100 and name HB  ) 1.8 0.0 2.3 ! 4428
  assign (resid  87 and name HD* ) (resid 100 and name HG1*) 1.8 0.0 1.1 ! 3982,4287
  assign (resid  87 and name HD* ) (resid 100 and name HG2*) 1.8 0.0 3.7 ! 3971
  assign (resid  87 and name HN  ) (resid 101 and name HA  ) 1.8 0.0 1.4 ! 786
  assign (resid  87 and name HD* ) (resid 101 and name HA  ) 1.8 0.0 2.2 ! lm 
  assign (resid  87 and name HN  ) (resid 102 and name HN  ) 3.0 1.2 2.2 
  assign (resid  87 and name HD* ) (resid 102 and name HB  ) 1.8 0.0 2.2 ! lm  
  assign (resid  87 and name HD* ) (resid 102 and name HG2*) 1.8 0.0 1.5 ! 3939
  assign (resid  87 and name HD* ) (resid 102 and name HG1*) 1.8 0.0 2.0 ! 3977
  assign (resid  88 and name HN  ) (resid  88 and name HB* ) 1.8 0.0 1.0 ! 797
  assign (resid  88 and name HA  ) (resid  88 and name HB* ) 2.2 0.0 0.3 
  assign (resid  88 and name HB* ) (resid  88 and name HG* ) 1.8 0.0 0.8 ! 2750
  assign (resid  88 and name HN  ) (resid  89 and name HN  ) 1.8 0.0 2.7 ! 804
  assign (resid  88 and name HA  ) (resid  89 and name HN  ) 1.8 0.0 1.1 ! 806
  assign (resid  88 and name HG* ) (resid  90 and name HB1 ) 1.8 0.0 1.9 ! 2751
  assign (resid  88 and name HD* ) (resid  90 and name HD* ) 1.8 0.0 2.7 ! 2840
  assign (resid  88 and name HG* ) (resid  97 and name HB  ) 1.8 0.0 1.8 ! 989,665,666
  assign (resid  88 and name HD* ) (resid  97 and name HB  ) 1.8 0.0 1.6 ! 664,1675
  assign (resid  88 and name HD* ) (resid  97 and name HG2*) 1.8 0.0 1.4 ! 1152,1599
  assign (resid  88 and name HB* ) (resid  98 and name HN  ) 1.8 0.0 2.2 ! 453
  assign (resid  88 and name HA  ) (resid  99 and name HA  ) 1.8 0.0 0.9 ! 85
  assign (resid  88 and name HB* ) (resid  99 and name HA  ) 1.8 0.0 2.7 ! lm  
  assign (resid  88 and name HD* ) (resid  99 and name HA  ) 1.8 0.0 2.3 ! 1581
  assign (resid  88 and name HD* ) (resid  99 and name HB1 ) 1.8 0.0 1.7 ! 1570
  assign (resid  88 and name HA  ) (resid 100 and name HN  ) 3.0 1.2 1.2 
  assign (resid  88 and name HA  ) (resid 100 and name HG2*) 1.8 0.0 2.1 ! 817
  assign (resid  89 and name HN  ) (resid  89 and name HG2*) 1.8 0.0 1.2 ! 810
  assign (resid  89 and name HN  ) (resid  90 and name HN  ) 1.8 0.0 2.7 ! 137
  assign (resid  89 and name HA  ) (resid  90 and name HN  ) 1.8 0.0 1.0 ! 144
  assign (resid  89 and name HB  ) (resid  97 and name HA  ) 1.8 0.0 2.7 ! 663
  assign (resid  89 and name HN  ) (resid  98 and name HN  ) 1.8 0.0 1.5 ! 803,444
  assign (resid  89 and name HB  ) (resid  98 and name HB* ) 1.8 0.0 1.6 ! 89
  assign (resid  89 and name HG2*) (resid  98 and name HN  ) 1.8 0.0 2.0 ! 455
  assign (resid  89 and name HG2*) (resid  98 and name HA  ) 1.8 0.0 2.4 ! 1915,2161
  assign (resid  89 and name HG2*) (resid  98 and name HB2 ) 1.8 0.0 2.2 ! 2021
  assign (resid  89 and name HG2*) (resid  98 and name HD* ) 1.8 0.0 2.0 ! 3816
  assign (resid  89 and name HN  ) (resid  99 and name HA  ) 1.8 0.0 1.3 ! 807
  assign (resid  89 and name HG2*) (resid 100 and name HG2*) 1.8 0.0 1.4 ! 3533
  assign (resid  89 and name HN  ) (resid 100 and name HG2*) 1.8 0.0 2.5 ! 811
  assign (resid  89 and name HG2*) (resid 113 and name HE* ) 1.8 0.0 2.7 ! a    
  assign (resid  89 and name HG2*) (resid 115 and name HE* ) 1.8 0.0 3.0 ! 2031
  assign (resid  90 and name HN  ) (resid  90 and name HA  ) 1.8 0.0 1.0 ! 145
  assign (resid  90 and name HN  ) (resid  90 and name HB1 ) 1.8 0.0 1.6 ! 150
  assign (resid  90 and name HN  ) (resid  90 and name HB2 ) 1.8 0.0 1.6 ! 151
  assign (resid  90 and name HN  ) (resid  90 and name HG* ) 1.8 0.0 1.3 ! 152
  assign (resid  90 and name HA  ) (resid  90 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  90 and name HN  ) (resid  91 and name HN  ) 1.8 0.0 2.5 ! 138
  assign (resid  90 and name HA  ) (resid  91 and name HN  ) 1.8 0.0 0.6 ! 816
  assign (resid  90 and name HB1 ) (resid  91 and name HN  ) 1.8 0.0 2.2 ! 819
  assign (resid  90 and name HG* ) (resid  91 and name HN  ) 1.8 0.0 2.7 ! 820
  assign (resid  90 and name HA  ) (resid  97 and name HA  ) 1.8 0.0 3.0 ! Peak ! a
  assign (resid  90 and name HA  ) (resid  97 and name HG2*) 1.8 0.0 2.3 ! 4477,610
  assign (resid  91 and name HA  ) (resid  91 and name HB2 ) 2.2 0.0 0.3 
  assign (resid  91 and name HA  ) (resid  92 and name HG2*) 1.8 0.0 1.4 ! 608
  assign (resid  91 and name HA  ) (resid  92 and name HN  ) 1.8 0.0 0.8 ! 823
  assign (resid  91 and name HB1 ) (resid  92 and name HN  ) 1.8 0.0 2.7 ! 825
  assign (resid  91 and name HB2 ) (resid  92 and name HN  ) 1.8 0.0 2.4 ! 824
  assign (resid  91 and name HA  ) (resid  95 and name HB* ) 1.8 0.0 2.5 ! 3089
  assign (resid  91 and name HB1 ) (resid  95 and name HB* ) 1.8 0.0 1.2 ! 694,2784
  assign (resid  91 and name HB2 ) (resid  95 and name HB* ) 1.8 0.0 0.8 ! 693,2783
  assign (resid  91 and name HN  ) (resid  97 and name HG2*) 1.8 0.0 2.3 ! 821
  assign (resid  91 and name HA  ) (resid  97 and name HG2*) 1.8 0.0 2.1 ! 800
  assign (resid  91 and name HB1 ) (resid  97 and name HA  ) 1.8 0.0 2.0 ! 1355
  assign (resid  91 and name HB1 ) (resid  97 and name HG2*) 1.8 0.0 0.8 ! 347,4031
  assign (resid  91 and name HB2 ) (resid  97 and name HG2*) 1.8 0.0 0.7 ! 1142
  assign (resid  92 and name HN  ) (resid  92 and name HG2*) 1.8 0.0 3.3 ! 827
  assign (resid  92 and name HA  ) (resid  92 and name HB  ) 2.2 0.0 0.3 
  assign (resid  92 and name HN  ) (resid  95 and name HB* ) 1.8 0.0 3.0 ! 826,821
  assign (resid  92 and name HN  ) (resid  96 and name HD* ) 1.8 0.0 2.8 
  assign (resid  93 and name HN  ) (resid  93 and name HA* ) 1.8 0.0 2.7 ! 829
  assign (resid  93 and name HN  ) (resid  94 and name HN  ) 3.0 1.2 1.2 
  assign (resid  93 and name HA* ) (resid  94 and name HN  ) 2.4 0.6 0.6 
  assign (resid  94 and name HN  ) (resid  94 and name HA* ) 1.8 0.0 2.0 ! 833,832
  assign (resid  94 and name HN  ) (resid  95 and name HN  ) 1.8 0.0 2.1 ! 830
  assign (resid  94 and name HA* ) (resid  95 and name HN  ) 1.8 0.0 1.4 ! 838,837
  assign (resid  95 and name HN  ) (resid  95 and name HB* ) 1.8 0.0 1.0 ! 840
  assign (resid  95 and name HA  ) (resid  96 and name HG* ) 1.8 0.0 1.8 ! 445,670
  assign (resid  95 and name HA  ) (resid  96 and name HD* ) 1.8 0.0 0.6 ! 358
  assign (resid  95 and name HB* ) (resid  96 and name HG* ) 1.8 0.0 1.8 ! 2744
  assign (resid  95 and name HB* ) (resid  96 and name HD* ) 1.8 0.0 1.7 ! 2622
  assign (resid  96 and name HA  ) (resid  96 and name HB* ) 2.2 0.0 0.3 
  assign (resid  96 and name HA  ) (resid  97 and name HN  ) 1.8 0.0 0.8 ! 843
  assign (resid  96 and name HB* ) (resid  97 and name HN  ) 1.8 0.0 1.5 ! 845,846
  assign (resid  96 and name HB* ) (resid  98 and name HE* ) 1.8 0.0 2.2 !    
  assign (resid  96 and name HG* ) (resid  98 and name HE* ) 1.8 0.0 1.2 ! 916
  assign (resid  96 and name HG* ) (resid  98 and name HZ  ) 1.8 0.0 2.2 !     
  assign (resid  97 and name HN  ) (resid  97 and name HG2*) 1.8 0.0 2.0 ! 847
  assign (resid  97 and name HA  ) (resid  97 and name HB  ) 2.2 0.0 0.3 
  assign (resid  97 and name HG2*) (resid  98 and name HN  ) 1.8 0.0 2.0 ! 456
  assign (resid  97 and name HA  ) (resid  98 and name HN  ) 1.8 0.0 1.1 ! 450
  assign (resid  97 and name HA  ) (resid  98 and name HD* ) 1.8 0.0 2.4 ! 82 a
  assign (resid  98 and name HN  ) (resid  98 and name HB1 ) 1.8 0.0 2.2 ! 451
  assign (resid  98 and name HN  ) (resid  98 and name HB2 ) 1.8 0.0 1.4 ! 452
  assign (resid  98 and name HN  ) (resid  98 and name HD* ) 1.8 0.0 2.0 ! 447
  assign (resid  98 and name HA  ) (resid  98 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  98 and name HB1 ) (resid  98 and name HD1 ) 1.8 0.0 0.9 ! 91 a
  assign (resid  98 and name HB2 ) (resid  98 and name HD2 ) 1.8 0.0 0.9 ! 118 a
  assign (resid  98 and name HA  ) (resid  99 and name HN  ) 2.0 0.3 0.3 
  assign (resid  98 and name HB1 ) (resid  99 and name HN  ) 1.8 0.0 2.2 ! 851
  assign (resid  98 and name HA  ) (resid 115 and name HA  ) 2.8 1.0 1.5 
  assign (resid  98 and name HD* ) (resid 116 and name HA  ) 1.8 0.0 2.7 ! 69a
  assign (resid  98 and name HE* ) (resid 116 and name HA  ) 2.8 1.0 2.2 
  assign (resid  98 and name HE* ) (resid 116 and name HB1 ) 1.8 0.0 3.4 
  assign (resid  98 and name HE* ) (resid 116 and name HB2 ) 1.8 0.0 3.4 
  assign (resid  99 and name HN  ) (resid  99 and name HB1 ) 1.8 0.0 2.2 ! 852
  assign (resid  99 and name HN  ) (resid  99 and name HB2 ) 1.8 0.0 1.3 ! 853
  assign (resid  99 and name HN  ) (resid  99 and name HD2*) 1.8 0.0 2.7 ! 848
  assign (resid  99 and name HA  ) (resid  99 and name HB1 ) 2.2 0.0 0.3 
  assign (resid  99 and name HB1 ) (resid  99 and name HD2*) 1.8 0.0 3.5 ! 1108,1105
  assign (resid  99 and name HA  ) (resid 100 and name HN  ) 1.8 0.0 0.7 ! 859,631
  assign (resid  99 and name HA  ) (resid 100 and name HG2*) 1.8 0.0 1.4 ! 1916
  assign (resid  99 and name HB1 ) (resid 100 and name HN  ) 1.8 0.0 2.3 ! 860
  assign (resid  99 and name HN  ) (resid 114 and name HN  ) 3.0 1.2 1.2 
  assign (resid  99 and name HD21) (resid 120 and name HN  ) 1.8 0.0 3.3 ! 944
  assign (resid  99 and name HB1 ) (resid 123 and name HD1*) 1.8 0.0 3.3 ! 1666
  assign (resid 100 and name HN  ) (resid 100 and name HB  ) 1.8 0.0 1.0 ! 863
  assign (resid 100 and name HN  ) (resid 100 and name HG1*) 1.8 0.0 2.0 ! 867
  assign (resid 100 and name HN  ) (resid 100 and name HG2*) 1.8 0.0 1.5 ! 866
  assign (resid 100 and name HA  ) (resid 101 and name HN  ) 1.8 0.0 0.9 ! 869
  assign (resid 100 and name HB  ) (resid 102 and name HB  ) 1.8 0.0 3.2 ! 2095
  assign (resid 100 and name HG1*) (resid 102 and name HA  ) 1.8 0.0 3.4 ! 237
  assign (resid 100 and name HA  ) (resid 113 and name HA  ) 1.8 0.0 0.6 ! 1795,74
  assign (resid 100 and name HG2*) (resid 113 and name HA  ) 1.8 0.0 1.1 ! 319,55
  assign (resid 100 and name HG2*) (resid 113 and name HG* ) 1.8 0.0 1.9 ! 2011
  assign (resid 100 and name HN  ) (resid 114 and name HN  ) 1.8 0.0 3.2 ! 1096
  assign (resid 100 and name HA  ) (resid 114 and name HN  ) 2.4 0.6 0.6 
  assign (resid 100 and name HA  ) (resid 114 and name HA* ) 1.8 0.0 2.8 ! lm 
  assign (resid 100 and name HN  ) (resid 118 and name HG* ) 1.8 0.0 3.0 ! 865
  assign (resid 100 and name HA  ) (resid 123 and name HG2*) 1.8 0.0 2.2 ! 76
  assign (resid 100 and name HG1*) (resid 123 and name HG2*) 1.8 0.0 2.0 ! 4256
  assign (resid 100 and name HA  ) (resid 123 and name HD1*) 1.8 0.0 2.7 ! lm 
  assign (resid 101 and name HN  ) (resid 101 and name HB  ) 1.8 0.0 2.0 ! 876
  assign (resid 101 and name HA  ) (resid 102 and name HN  ) 1.8 0.0 1.1 ! 885
  assign (resid 101 and name HG2*) (resid 102 and name HN  ) 1.8 0.0 1.5 ! 888
  assign (resid 101 and name HG2*) (resid 103 and name HG2*) 1.8 0.0 1.7 ! 3461
  assign (resid 101 and name HN  ) (resid 112 and name HN  ) 1.8 0.0 1.3 ! 899,868
  assign (resid 101 and name HB  ) (resid 112 and name HB2 ) 1.8 0.0 2.5 ! 2001
  assign (resid 101 and name HG2*) (resid 112 and name HB2 ) 1.8 0.0 2.3 ! 2222
  assign (resid 101 and name HN  ) (resid 114 and name HN  ) 1.8 0.0 3.2 
  assign (resid 101 and name HN  ) (resid 123 and name HG2*) 1.8 0.0 1.1 ! 879
  assign (resid 101 and name HA  ) (resid 123 and name HG2*) 1.8 0.0 2.2 ! lm 
  assign (resid 101 and name HB  ) (resid 123 and name HG2*) 1.8 0.0 2.0 ! 1457
  assign (resid 101 and name HB  ) (resid 124 and name HA  ) 1.8 0.0 1.3 ! 1458
  assign (resid 101 and name HG2*) (resid 124 and name HA  ) 1.8 0.0 0.6 ! 1532,1063
  assign (resid 101 and name HG2*) (resid 127 and name HB1 ) 1.8 0.0 2.0 ! 2737
  assign (resid 101 and name HB  ) (resid 127 and name HB1 ) 1.8 0.0 1.5 ! 863
  assign (resid 101 and name HB  ) (resid 127 and name HB2 ) 1.8 0.0 1.5 ! 1300
  assign (resid 101 and name HG2*) (resid 127 and name HB1 ) 1.8 0.0 2.2 ! 1754
  assign (resid 101 and name HG2*) (resid 127 and name HB2 ) 1.8 0.0 0.7 ! 1166
  assign (resid 102 and name HN  ) (resid 102 and name HB  ) 1.8 0.0 1.9 ! 887
  assign (resid 102 and name HN  ) (resid 102 and name HG2*) 1.8 0.0 1.4 ! 889
  assign (resid 102 and name HA  ) (resid 103 and name HN  ) 1.8 0.0 1.0 ! 13
  assign (resid 102 and name HG2*) (resid 103 and name HN  ) 1.8 0.0 1.8 ! 18
  assign (resid 102 and name HG1*) (resid 109 and name HD* ) 1.8 0.0 1.5 ! 4769
  assign (resid 102 and name HA  ) (resid 111 and name HA  ) 1.8 0.0 1.3 ! 290
  assign (resid 102 and name HG1*) (resid 111 and name HG  ) 1.8 0.0 2.1 ! 3937
  assign (resid 102 and name HG1*) (resid 111 and name HD* ) 1.8 0.0 1.9 ! 3979
  assign (resid 102 and name HG2*) (resid 111 and name HG  ) 1.8 0.0 1.8 ! 3938
  assign (resid 102 and name HG2*) (resid 111 and name HD* ) 1.8 0.0 0.8 ! 3984,3917
  assign (resid 102 and name HG2*) (resid 111 and name HA  ) 1.8 0.0 2.4 ! 220
  assign (resid 102 and name HG* ) (resid 111 and name HD* ) 1.8 0.0 0.6 ! 459,452
  assign (resid 102 and name HA  ) (resid 112 and name HN  ) 2.6 0.8 0.8 
  assign (resid 103 and name HN  ) (resid 103 and name HG2*) 1.8 0.0 2.6 ! 17
  assign (resid 103 and name HA  ) (resid 103 and name HB  ) 2.2 0.0 0.3 
  assign (resid 103 and name HA  ) (resid 104 and name HN  ) 1.8 0.0 1.4 ! 20
  assign (resid 103 and name HN  ) (resid 109 and name HD* ) 1.8 0.0 3.2 ! 19
  assign (resid 103 and name HN  ) (resid 110 and name HN  ) 1.8 0.0 2.0 ! 11
  assign (resid 103 and name HN  ) (resid 110 and name HB  ) 1.8 0.0 2.6 ! 16
  assign (resid 103 and name HB  ) (resid 110 and name HB  ) 1.8 0.0 2.0 ! 2011
  assign (resid 103 and name HN  ) (resid 111 and name HA  ) 3.0 1.2 1.2 
  assign (resid 103 and name HN  ) (resid 112 and name HN  ) 3.1 1.3 1.3 
  assign (resid 103 and name HG2*) (resid 112 and name HD* ) 1.8 0.0 2.6 ! 3384
  assign (resid 103 and name HG2*) (resid 127 and name HB1 ) 1.8 0.0 2.9 ! 3383
  assign (resid 103 and name HG2*) (resid 127 and name HB2 ) 1.8 0.0 1.6 ! 1422,1755,1752
  assign (resid 103 and name HG2*) (resid 128 and name HA  ) 1.8 0.0 1.4 ! 1060,366
  assign (resid 103 and name HG2*) (resid 128 and name HB* ) 1.8 0.0 2.1 ! 1423
  assign (resid 103 and name HG2*) (resid 128 and name HD* ) 1.8 0.0 2.3 ! 531,3820
  assign (resid 103 and name HG2*) (resid 128 and name HE* ) 1.8 0.0 3.2 !     
  assign (resid 103 and name HA  ) (resid 131 and name HB* ) 1.8 0.0 2.7 ! 563
  assign (resid 103 and name HB  ) (resid 131 and name HB* ) 1.8 0.0 1.9 ! 1459
  assign (resid 103 and name HG2*) (resid 131 and name HB* ) 1.8 0.0 1.4 ! 3485
  assign (resid 104 and name HN  ) (resid 104 and name HB1 ) 1.8 0.0 2.1 ! 24
  assign (resid 104 and name HN  ) (resid 104 and name HB2 ) 1.8 0.0 1.5 ! 25
  assign (resid 104 and name HA  ) (resid 104 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 104 and name HA  ) (resid 105 and name HN  ) 1.8 0.0 1.2 ! 29
  assign (resid 104 and name HG* ) (resid 105 and name HN  ) 1.8 0.0 2.6 ! 31
  assign (resid 104 and name HN  ) (resid 105 and name HN  ) 3.1 1.3 1.3 
  assign (resid 104 and name HA  ) (resid 109 and name HA  ) 1.8 0.0 1.2 ! 320  
  assign (resid 104 and name HA  ) (resid 109 and name HD* ) 1.8 0.0 2.2 ! lm   
  assign (resid 104 and name HB1 ) (resid 109 and name HD* ) 1.8 0.0 2.7 ! lm   
  assign (resid 104 and name HB2 ) (resid 109 and name HD* ) 1.8 0.0 2.7 ! lm   
  assign (resid 104 and name HD* ) (resid 109 and name HD* ) 1.8 0.0 2.7 ! lm   
  assign (resid 104 and name HD* ) (resid 110 and name HN  ) 1.8 0.0 2.4 ! 894
  assign (resid 105 and name HN  ) (resid 105 and name HG2*) 1.8 0.0 1.5 ! 32
  assign (resid 105 and name HA  ) (resid 105 and name HB  ) 2.2 0.0 0.3 
  assign (resid 105 and name HA  ) (resid 106 and name HN  ) 1.8 0.0 1.3 ! 38
  assign (resid 105 and name HG2*) (resid 106 and name HN  ) 1.8 0.0 2.5 ! 41
  assign (resid 105 and name HB  ) (resid 107 and name HN  ) 1.8 0.0 2.5 ! 46
  assign (resid 105 and name HN  ) (resid 108 and name HN  ) 1.8 0.0 2.8 ! 28
  assign (resid 105 and name HB  ) (resid 108 and name HN  ) 1.8 0.0 2.3 ! 57
  assign (resid 105 and name HG2*) (resid 108 and name HN  ) 1.8 0.0 3.6 
  assign (resid 105 and name HG2*) (resid 108 and name HG2*) 1.8 0.0 1.6 ! 4782
  assign (resid 105 and name HN  ) (resid 109 and name HD* ) 1.8 0.0 2.5 ! 33,34
  assign (resid 105 and name HG2*) (resid 110 and name HG2*) 1.8 0.0 1.5 ! 356a
  assign (resid 105 and name HG2*) (resid 131 and name HA  ) 1.8 0.0 1.8 ! 1407
  assign (resid 105 and name HG2*) (resid 131 and name HB* ) 1.8 0.0 1.6 ! 3695
  assign (resid 105 and name HG2*) (resid 134 and name HA  ) 1.8 0.0 2.1 ! 1098
  assign (resid 105 and name HG2*) (resid 134 and name HB2 ) 1.8 0.0 2.0 ! 2371
  assign (resid 105 and name HG2*) (resid 134 and name HD* ) 1.8 0.0 0.6 ! 3389,4194
  assign (resid 105 and name HG2*) (resid 135 and name HA  ) 1.8 0.0 2.0 ! 3644
  assign (resid 105 and name HG2*) (resid 135 and name HB* ) 1.8 0.0 2.4 ! 3243
  assign (resid 106 and name HN  ) (resid 106 and name HB1 ) 1.8 0.0 2.1 ! 40
  assign (resid 106 and name HN  ) (resid 106 and name HB2 ) 1.8 0.0 1.5 ! 39
  assign (resid 106 and name HA  ) (resid 106 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 106 and name HN  ) (resid 107 and name HN  ) 1.8 0.0 1.4 ! 35,44
  assign (resid 106 and name HB1 ) (resid 107 and name HG* ) 1.8 0.0 2.4 ! 2030
  assign (resid 106 and name HN  ) (resid 108 and name HN  ) 1.8 0.0 1.9 ! 53,36
  assign (resid 106 and name HN  ) (resid 135 and name HG* ) 1.8 0.0 4.2 ! 42
  assign (resid 107 and name HN  ) (resid 107 and name HB* ) 1.8 0.0 2.0 ! 49
  assign (resid 107 and name HN  ) (resid 107 and name HG* ) 1.8 0.0 3.2 ! 51
  assign (resid 107 and name HA  ) (resid 107 and name HB* ) 2.2 0.0 0.3 
  assign (resid 107 and name HA  ) (resid 107 and name HG* ) 1.8 0.0 1.3 ! 3762
  assign (resid 107 and name HB* ) (resid 107 and name HD* ) 1.8 0.0 1.2 ! 3099,3049
  assign (resid 107 and name HG* ) (resid 107 and name HD* ) 1.8 0.0 0.8 ! 2756
  assign (resid 107 and name HB* ) (resid 107 and name HD* ) 1.8 0.0 1.4 ! 2227
  assign (resid 107 and name HN  ) (resid 108 and name HN  ) 1.8 0.0 1.3 ! 43
  assign (resid 107 and name HB* ) (resid 108 and name HG2*) 1.8 0.0 1.4 ! 1345
  assign (resid 107 and name HG* ) (resid 108 and name HG2*) 1.8 0.0 2.3 ! 2338
  assign (resid 107 and name HG* ) (resid 139 and name HA  ) 1.8 0.0 3.0 ! 738
  assign (resid 107 and name HD* ) (resid 139 and name HA  ) 1.8 0.0 1.7 ! 737
  assign (resid 107 and name HE* ) (resid 139 and name HA  ) 1.8 0.0 2.3 ! 1938
  assign (resid 108 and name HN  ) (resid 108 and name HB  ) 1.8 0.0 3.5 ! 60
  assign (resid 108 and name HA  ) (resid 108 and name HB  ) 2.2 0.0 0.3 
  assign (resid 108 and name HN  ) (resid 109 and name HN  ) 3.0 1.2 1.2 
  assign (resid 108 and name HA  ) (resid 109 and name HN  ) 1.8 0.0 1.1 ! 64,610
  assign (resid 108 and name HB  ) (resid 109 and name HN  ) 1.8 0.0 1.4 ! 65
  assign (resid 108 and name HG2*) (resid 110 and name HG2*) 1.8 0.0 4.4 ! 4788
  assign (resid 108 and name HG2*) (resid 134 and name HD* ) 1.8 0.0 2.3 ! 4746
  assign (resid 108 and name HG2*) (resid 139 and name HB* ) 1.8 0.0 0.9 ! 1346
  assign (resid 108 and name HG2*) (resid 139 and name HD* ) 1.8 0.0 2.1 ! 540
  assign (resid 109 and name HN  ) (resid 109 and name HB2 ) 1.8 0.0 1.6 ! 67
  assign (resid 109 and name HN  ) (resid 109 and name HD* ) 1.8 0.0 1.9 ! 70,69
  assign (resid 109 and name HA  ) (resid 109 and name HB2 ) 1.8 0.0 0.8 
  assign (resid 109 and name HB2 ) (resid 109 and name HG  ) 1.8 0.0 1.3 ! 3399
  assign (resid 109 and name HD* ) (resid 110 and name HN  ) 1.8 0.0 2.3 ! 891
  assign (resid 109 and name HA  ) (resid 110 and name HN  ) 1.8 0.0 1.0 ! 72
  assign (resid 109 and name HD* ) (resid 111 and name HD* ) 1.8 0.0 2.2 ! lm
  assign (resid 110 and name HN  ) (resid 110 and name HB  ) 1.8 0.0 1.6 ! 74
  assign (resid 110 and name HN  ) (resid 110 and name HG1*) 1.8 0.0 1.8 ! 893
  assign (resid 110 and name HN  ) (resid 110 and name HG2*) 1.8 0.0 1.4 ! 892
  assign (resid 110 and name HA  ) (resid 111 and name HN  ) 1.8 0.0 1.1 ! 777,603
  assign (resid 110 and name HA  ) (resid 111 and name HD* ) 1.8 0.0 2.5 ! 459
  assign (resid 110 and name HG1*) (resid 111 and name HN  ) 1.8 0.0 1.6 ! 896
  assign (resid 110 and name HG1*) (resid 127 and name HA  ) 1.8 0.0 1.9 ! 1393
  assign (resid 110 and name HG1*) (resid 130 and name HG* ) 1.8 0.0 1.2 ! 1059,3879
  assign (resid 110 and name HG2*) (resid 130 and name HG* ) 1.8 0.0 1.2 ! 2050,lm
  assign (resid 110 and name HB  ) (resid 131 and name HB* ) 1.8 0.0 2.2 ! 3856
  assign (resid 110 and name HG2*) (resid 131 and name HA  ) 1.8 0.0 2.2 ! 1408,4479
  assign (resid 110 and name HG2*) (resid 131 and name HB* ) 1.8 0.0 2.0 ! 4397
  assign (resid 110 and name HG2*) (resid 131 and name HN  ) 1.8 0.0 2.7 ! 880
  assign (resid 110 and name HG1*) (resid 134 and name HD* ) 1.8 0.0 1.9 ! 4033
  assign (resid 110 and name HG2*) (resid 134 and name HN  ) 1.8 0.0 2.4 ! 1038
  assign (resid 110 and name HG2*) (resid 134 and name HB1 ) 1.8 0.0 2.0 ! 3535
  assign (resid 110 and name HG2*) (resid 134 and name HD* ) 1.8 0.0 2.1 ! 4037
  assign (resid 111 and name HN  ) (resid 111 and name HB* ) 1.8 0.0 1.5 ! 897
  assign (resid 111 and name HN  ) (resid 111 and name HG  ) 1.8 0.0 2.2 ! 895
  assign (resid 111 and name HN  ) (resid 111 and name HD* ) 1.8 0.0 1.4 ! 898
  assign (resid 111 and name HD* ) (resid 112 and name HN  ) 1.8 0.0 2.0 ! 908
  assign (resid 111 and name HN  ) (resid 112 and name HN  ) 3.0 1.2 1.2 
  assign (resid 111 and name HA  ) (resid 112 and name HN  ) 1.8 0.0 0.9 ! 900
  assign (resid 112 and name HN  ) (resid 112 and name HB1 ) 1.8 0.0 2.1 ! 982
  assign (resid 112 and name HN  ) (resid 112 and name HB2 ) 1.8 0.0 1.4 ! 903
  assign (resid 112 and name HA  ) (resid 112 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 112 and name HB1 ) (resid 113 and name HN  ) 1.8 0.0 2.3 ! 864
  assign (resid 112 and name HN  ) (resid 113 and name HN  ) 3.0 1.2 1.2 
  assign (resid 112 and name HA  ) (resid 113 and name HN  ) 2.0 0.3 0.3 
  assign (resid 112 and name HN  ) (resid 123 and name HG2*) 1.8 0.0 2.3 ! 905
  assign (resid 112 and name HB1 ) (resid 123 and name HG2*) 1.8 0.0 2.3 ! 3676
  assign (resid 112 and name HB2 ) (resid 123 and name HG2*) 1.8 0.0 2.0 ! 3003
  assign (resid 112 and name HG  ) (resid 123 and name HG2*) 1.8 0.0 2.0 ! 3943
  assign (resid 112 and name HD* ) (resid 123 and name HA  ) 1.8 0.0 1.8 ! 2130,1296
  assign (resid 112 and name HD* ) (resid 123 and name HG2*) 1.8 0.0 1.6 ! 3986
  assign (resid 112 and name HD* ) (resid 123 and name HD1*) 1.8 0.0 2.5 ! 3840
  assign (resid 112 and name HG  ) (resid 126 and name HB* ) 1.8 0.0 1.9 ! 3175
  assign (resid 112 and name HD* ) (resid 126 and name HB* ) 1.8 0.0 1.1 ! 2205,3810
  assign (resid 112 and name HD* ) (resid 127 and name HN  ) 1.8 0.0 1.6 ! 1002
  assign (resid 112 and name HB1 ) (resid 127 and name HA  ) 1.8 0.0 2.7 ! lm  
  assign (resid 112 and name HD* ) (resid 127 and name HA  ) 1.8 0.0 0.7 ! 2026,1140,3512
  assign (resid 112 and name HB1 ) (resid 127 and name HB1 ) 1.8 0.0 2.7 ! lm  
  assign (resid 112 and name HB1 ) (resid 127 and name HB2 ) 1.8 0.0 2.7 ! lm  
  assign (resid 112 and name HB2 ) (resid 127 and name HB1 ) 1.8 0.0 2.7 ! lm  
  assign (resid 112 and name HB2 ) (resid 127 and name HB2 ) 1.8 0.0 2.7 ! lm  
  assign (resid 112 and name HD* ) (resid 127 and name HB1 ) 1.8 0.0 2.3 ! 3370
  assign (resid 113 and name HN  ) (resid 113 and name HB* ) 1.8 0.0 1.6 ! 862
  assign (resid 113 and name HN  ) (resid 113 and name HG* ) 1.8 0.0 2.4 ! 861
  assign (resid 113 and name HA  ) (resid 113 and name HG* ) 1.8 0.0 1.3 ! 33
  assign (resid 113 and name HN  ) (resid 114 and name HN  ) 3.1 1.3 1.3 
  assign (resid 113 and name HA  ) (resid 114 and name HN  ) 1.8 0.0 1.2 ! 912
  assign (resid 113 and name HA  ) (resid 114 and name HA* ) 1.8 0.0 2.5 ! lm
  assign (resid 113 and name HG* ) (resid 114 and name HN  ) 1.8 0.0 2.0 ! 915
  assign (resid 113 and name HA  ) (resid 123 and name HG2*) 1.8 0.0 2.3 ! 4526
  assign (resid 114 and name HN  ) (resid 114 and name HA* ) 1.8 0.0 1.5 ! 914,813
  assign (resid 114 and name HN  ) (resid 115 and name HN  ) 3.0 1.2 1.2 
  assign (resid 114 and name HA* ) (resid 115 and name HN  ) 1.8 0.0 1.3 ! 569
  assign (resid 114 and name HA* ) (resid 118 and name HG* ) 1.8 0.0 2.4 ! 1074
  assign (resid 114 and name HN  ) (resid 123 and name HD1*) 1.8 0.0 2.1 ! 917
  assign (resid 114 and name HA* ) (resid 123 and name HD1*) 1.8 0.0 1.6 ! 343,1200
  assign (resid 115 and name HN  ) (resid 115 and name HB2 ) 1.8 0.0 1.1 ! 576
  assign (resid 115 and name HA  ) (resid 115 and name HB1 ) 2.2 0.0 0.3 
  assign (resid 115 and name HB1 ) (resid 115 and name HB2 ) 1.8 0.0 0.9 ! 3154
  assign (resid 115 and name HB2 ) (resid 116 and name HN  ) 1.8 0.0 2.2 ! 922
  assign (resid 115 and name HN  ) (resid 116 and name HN  ) 3.1 1.3 1.3 
  assign (resid 115 and name HN  ) (resid 118 and name HG* ) 1.8 0.0 2.0 ! 578
  assign (resid 115 and name HB1 ) (resid 118 and name HG* ) 1.8 0.0 2.8 ! lm  
  assign (resid 115 and name HB2 ) (resid 118 and name HG* ) 1.8 0.0 2.8 ! lm  
  assign (resid 116 and name HN  ) (resid 116 and name HB1 ) 1.8 0.0 1.0 ! 921
  assign (resid 116 and name HN  ) (resid 116 and name HB2 ) 1.8 0.0 0.9 ! 920
  assign (resid 116 and name HA  ) (resid 116 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 116 and name HB1 ) (resid 118 and name HB  ) 1.8 0.0 3.1 ! 2566
  assign (resid 116 and name HB2 ) (resid 118 and name HB  ) 1.8 0.0 3.1 ! 2238
  assign (resid 116 and name HB2 ) (resid 118 and name HN  ) 1.8 0.0 2.8 ! 935
  assign (resid 116 and name HN  ) (resid 118 and name HG1*) 1.8 0.0 2.6 ! 923
  assign (resid 117 and name HN  ) (resid 117 and name HA* ) 1.8 0.0 1.0 ! 926,927
  assign (resid 117 and name HA* ) (resid 118 and name HN  ) 1.8 0.0 1.9 ! 931,933
  assign (resid 117 and name HN  ) (resid 118 and name HN  ) 1.8 0.0 2.0 ! 924
  assign (resid 118 and name HN  ) (resid 118 and name HB  ) 1.8 0.0 1.1 ! 934
  assign (resid 118 and name HN  ) (resid 118 and name HG1*) 1.8 0.0 1.1 ! 936
  assign (resid 118 and name HA  ) (resid 118 and name HB  ) 2.2 0.0 0.3 
  assign (resid 118 and name HB  ) (resid 118 and name HG2*) 1.8 0.0 1.0 ! 3241
  assign (resid 118 and name HN  ) (resid 119 and name HN  ) 1.8 0.0 2.4 
  assign (resid 118 and name HA  ) (resid 119 and name HN  ) 1.8 0.0 1.1 ! 938
  assign (resid 118 and name HG* ) (resid 119 and name HN  ) 1.8 0.0 1.6 ! 942
  assign (resid 118 and name HG2*) (resid 120 and name HA* ) 1.8 0.0 1.4 ! 1379
  assign (resid 118 and name HB  ) (resid 123 and name HD1*) 1.8 0.0 2.9 ! 4577
  assign (resid 118 and name HG2*) (resid 123 and name HD1*) 1.8 0.0 2.3 ! 3826
  assign (resid 119 and name HN  ) (resid 119 and name HB1 ) 1.8 0.0 1.4 ! 941
  assign (resid 119 and name HN  ) (resid 119 and name HB2 ) 1.8 0.0 1.3 ! 940
  assign (resid 119 and name HA  ) (resid 119 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 119 and name HN  ) (resid 120 and name HN  ) 3.0 1.2 1.2 
  assign (resid 119 and name HB1 ) (resid 122 and name HN  ) 1.8 0.0 2.6 ! 962
  assign (resid 119 and name HB1 ) (resid 122 and name HB* ) 1.8 0.0 3.2 ! 1859
  assign (resid 119 and name HB1 ) (resid 122 and name HD* ) 1.8 0.0 1.3 ! 1301,2276
  assign (resid 119 and name HB2 ) (resid 122 and name HD* ) 1.8 0.0 1.6 ! 1302
  assign (resid 120 and name HN  ) (resid 122 and name HN  ) 3.0 1.2 1.2 
  assign (resid 120 and name HN  ) (resid 123 and name HN  ) 1.8 0.0 2.2 
  assign (resid 120 and name HN  ) (resid 123 and name HD1*) 1.8 0.0 3.6 ! 951
  assign (resid 120 and name HA* ) (resid 123 and name HD1*) 1.8 0.0 1.1 ! 338
  assign (resid 121 and name HN  ) (resid 121 and name HA* ) 1.8 0.0 2.3 ! 954
  assign (resid 121 and name HA* ) (resid 122 and name HN  ) 1.8 0.0 1.5 ! 961
  assign (resid 121 and name HN  ) (resid 122 and name HN  ) 1.8 0.0 2.5 ! 952
  assign (resid 121 and name HA* ) (resid 124 and name HB1 ) 1.8 0.0 1.2 ! 1997
  assign (resid 121 and name HA* ) (resid 124 and name HB2 ) 1.8 0.0 1.2 ! 1984
  assign (resid 121 and name HA* ) (resid 124 and name HN  ) 1.8 0.0 2.7 ! 901
  assign (resid 122 and name HN  ) (resid 122 and name HB* ) 1.8 0.0 1.0 ! 963
  assign (resid 122 and name HN  ) (resid 122 and name HD* ) 1.8 0.0 2.6 ! 964
  assign (resid 122 and name HA  ) (resid 122 and name HB* ) 2.2 0.0 0.3 
  assign (resid 122 and name HN  ) (resid 123 and name HN  ) 1.8 0.0 1.5 ! 968,957
  assign (resid 122 and name HB* ) (resid 123 and name HN  ) 1.8 0.0 1.4 ! 973
  assign (resid 122 and name HD* ) (resid 123 and name HG2*) 1.8 0.0 3.4 ! 4388
  assign (resid 122 and name HD* ) (resid 123 and name HD1*) 1.8 0.0 3.4 ! 4120
  assign (resid 122 and name HN  ) (resid 124 and name HN  ) 1.8 0.0 2.4 ! 956
  assign (resid 122 and name HD* ) (resid 125 and name HG* ) 1.8 0.0 2.1 ! 3420
  assign (resid 122 and name HA  ) (resid 125 and name HB* ) 1.8 0.0 0.8 ! 1232,1535
  assign (resid 122 and name HN  ) (resid 125 and name HN  ) 1.8 0.0 2.4 ! 1208
  assign (resid 122 and name HA  ) (resid 125 and name HN  ) 1.8 0.0 1.7 ! 221
  assign (resid 122 and name HA  ) (resid 126 and name HN  ) 1.8 0.0 2.4 
  assign (resid 123 and name HN  ) (resid 123 and name HB  ) 1.8 0.0 1.3 ! 972
  assign (resid 123 and name HN  ) (resid 123 and name HG1*) 1.8 0.0 1.3 ! 974,975
  assign (resid 123 and name HN  ) (resid 123 and name HD1*) 1.8 0.0 2.1 ! 976
  assign (resid 123 and name HN  ) (resid 124 and name HN  ) 1.8 0.0 1.5 ! 966
  assign (resid 123 and name HA  ) (resid 124 and name HN  ) 1.8 0.0 1.8 
  assign (resid 123 and name HB  ) (resid 124 and name HN  ) 1.8 0.0 1.6 ! 981
  assign (resid 123 and name HG2*) (resid 124 and name HN  ) 1.8 0.0 1.7 ! 983
  assign (resid 123 and name HG2*) (resid 124 and name HA  ) 1.8 0.0 4.0 ! 1157
  assign (resid 123 and name HB  ) (resid 125 and name HN  ) 1.8 0.0 2.7 ! 483
  assign (resid 123 and name HN  ) (resid 125 and name HN  ) 1.8 0.0 2.7 ! 967
  assign (resid 123 and name HG1*) (resid 126 and name HE* ) 1.8 0.0 1.2 ! 2899,1718
  assign (resid 123 and name HA  ) (resid 126 and name HN  ) 2.4 0.6 0.6 ! 228
  assign (resid 123 and name HA  ) (resid 126 and name HB1 ) 1.8 0.0 2.2 ! lm 
  assign (resid 123 and name HA  ) (resid 126 and name HB2 ) 1.8 0.0 2.2 ! lm 
  assign (resid 123 and name HA  ) (resid 127 and name HN  ) 1.8 0.0 2.4 ! 997
  assign (resid 123 and name HG2*) (resid 127 and name HB1 ) 1.8 0.0 2.7 ! lm        
  assign (resid 123 and name HG2*) (resid 127 and name HB2 ) 1.8 0.0 1.7 ! lm        
  assign (resid 124 and name HN  ) (resid 124 and name HB1 ) 1.8 0.0 1.2 ! 902
  assign (resid 124 and name HN  ) (resid 124 and name HB2 ) 1.8 0.0 1.4 ! 910
  assign (resid 124 and name HA  ) (resid 124 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 124 and name HB2 ) (resid 124 and name HD2*) 1.8 0.0 3.5 ! 1099
  assign (resid 124 and name HN  ) (resid 125 and name HN  ) 1.8 0.0 2.0 ! 977
  assign (resid 124 and name HB1 ) (resid 125 and name HN  ) 1.8 0.0 1.1 ! 478
  assign (resid 124 and name HN  ) (resid 126 and name HN  ) 3.0 1.2 1.2 
  assign (resid 124 and name HA  ) (resid 127 and name HN  ) 3.6 1.4 1.4 
  assign (resid 124 and name HA  ) (resid 127 and name HB1 ) 1.8 0.0 2.3 ! 1021
  assign (resid 125 and name HA  ) (resid 125 and name HB* ) 2.2 0.0 0.3 
  assign (resid 125 and name HA  ) (resid 125 and name HD* ) 2.2 0.0 1.0 ! 969,970 
  assign (resid 125 and name HB* ) (resid 126 and name HN  ) 1.8 0.0 1.4 ! 988
  assign (resid 125 and name HN  ) (resid 126 and name HN  ) 1.8 0.0 1.9 ! 985
  assign (resid 125 and name HA  ) (resid 126 and name HN  ) 1.8 0.0 1.8 
  assign (resid 125 and name HN  ) (resid 127 and name HN  ) 3.0 1.2 1.2 ! 1284
  assign (resid 125 and name HA  ) (resid 128 and name HB* ) 1.8 0.0 0.9 ! 1153
  assign (resid 125 and name HA  ) (resid 128 and name HD* ) 1.8 0.0 1.4 ! 1193
  assign (resid 126 and name HN  ) (resid 126 and name HB* ) 1.8 0.0 1.0 ! 989
  assign (resid 126 and name HA  ) (resid 126 and name HB* ) 1.8 0.0 0.7 ! 1206
  assign (resid 126 and name HA  ) (resid 126 and name HD* ) 1.8 0.0 2.1 ! 2982
  assign (resid 126 and name HB* ) (resid 127 and name HN  ) 1.8 0.0 1.4 ! 1000
  assign (resid 126 and name HN  ) (resid 127 and name HN  ) 1.8 0.0 1.1 ! 994,984
  assign (resid 126 and name HN  ) (resid 128 and name HN  ) 3.0 1.2 1.2 ! 1306
  assign (resid 126 and name HA  ) (resid 128 and name HN  ) 3.1 1.3 1.3 
  assign (resid 126 and name HA  ) (resid 130 and name HN  ) 3.0 1.2 1.2 
  assign (resid 127 and name HN  ) (resid 127 and name HB1 ) 1.8 0.0 1.0 ! 998
  assign (resid 127 and name HB2 ) (resid 128 and name HN  ) 1.8 0.0 1.8 ! 1009
  assign (resid 127 and name HN  ) (resid 128 and name HN  ) 1.8 0.0 1.3 ! 991
  assign (resid 127 and name HA  ) (resid 128 and name HN  ) 2.7 0.9 0.9 
  assign (resid 127 and name HN  ) (resid 129 and name HN  ) 1.8 0.0 1.7 ! 1039,992
  assign (resid 127 and name HA  ) (resid 129 and name HN  ) 3.0 1.2 1.2 
  assign (resid 127 and name HA  ) (resid 130 and name HN  ) 1.8 0.0 2.1 ! 1026
  assign (resid 127 and name HA  ) (resid 131 and name HN  ) 3.0 1.2 1.2 
  assign (resid 128 and name HN  ) (resid 128 and name HB* ) 1.8 0.0 1.1 ! 1008
  assign (resid 128 and name HA  ) (resid 128 and name HB* ) 2.2 0.0 0.3 
  assign (resid 128 and name HA  ) (resid 128 and name HD* ) 1.8 0.0 1.1 ! 63 a
  assign (resid 128 and name HB* ) (resid 128 and name HD* ) 1.8 0.0 0.6 ! 95 a
  assign (resid 128 and name HD* ) (resid 129 and name HN  ) 1.8 0.0 2.8 ! 1014
  assign (resid 128 and name HN  ) (resid 129 and name HN  ) 1.8 0.0 1.2 ! 1004
  assign (resid 128 and name HA  ) (resid 129 and name HN  ) 1.8 0.0 1.8 
  assign (resid 128 and name HB* ) (resid 129 and name HN  ) 1.8 0.0 1.3 ! 1017
  assign (resid 128 and name HN  ) (resid 130 and name HN  ) 3.0 1.2 1.2 ! 1270
  assign (resid 128 and name HA  ) (resid 131 and name HB* ) 1.8 0.0 1.1 ! 717,3584
  assign (resid 128 and name HD* ) (resid 131 and name HB* ) 1.8 0.0 2.5 ! 562
  assign (resid 128 and name HA  ) (resid 131 and name HN  ) 1.8 0.0 2.6 ! 874
  assign (resid 129 and name HN  ) (resid 129 and name HB2 ) 1.8 0.0 1.6 ! 1020
  assign (resid 129 and name HN  ) (resid 129 and name HG* ) 1.8 0.0 1.6 ! 1019,1018
  assign (resid 129 and name HA  ) (resid 129 and name HG* ) 1.8 0.0 0.8 ! 1177,2080
  assign (resid 129 and name HA  ) (resid 129 and name HB1 ) 1.8 0.0 0.8 
  assign (resid 129 and name HN  ) (resid 130 and name HN  ) 1.8 0.0 1.4 ! 1012
  assign (resid 129 and name HN  ) (resid 131 and name HN  ) 1.8 0.0 2.4 ! 871
  assign (resid 129 and name HA  ) (resid 132 and name HB* ) 1.8 0.0 0.6 ! 1062
  assign (resid 130 and name HN  ) (resid 130 and name HB* ) 1.8 0.0 0.9 ! 1028
  assign (resid 130 and name HN  ) (resid 130 and name HG* ) 1.8 0.0 2.6 ! 1027
  assign (resid 130 and name HA  ) (resid 131 and name HN  ) 2.7 0.9 0.9 
  assign (resid 130 and name HN  ) (resid 131 and name HN  ) 1.8 0.0 1.3 ! 870
  assign (resid 130 and name HB* ) (resid 131 and name HN  ) 1.8 0.0 1.3 ! 877
  assign (resid 130 and name HN  ) (resid 132 and name HN  ) 3.0 1.2 1.2 
  assign (resid 130 and name HA  ) (resid 133 and name HN  ) 3.0 1.2 1.2 
  assign (resid 130 and name HG* ) (resid 134 and name HD* ) 1.8 0.0 2.5 ! 2144
  assign (resid 130 and name HE* ) (resid 134 and name HD* ) 1.8 0.0 3.2 !      
  assign (resid 131 and name HN  ) (resid 132 and name HN  ) 2.3 0.5 0.5 
  assign (resid 131 and name HN  ) (resid 133 and name HN  ) 3.0 1.2 1.2 ! 1222
  assign (resid 131 and name HN  ) (resid 131 and name HB* ) 1.8 0.0 1.1 ! 878
  assign (resid 131 and name HB* ) (resid 134 and name HB1 ) 1.8 0.0 2.5 ! 3629
  assign (resid 131 and name HA  ) (resid 134 and name HN  ) 1.8 0.0 2.6 ! 1032
  assign (resid 131 and name HA  ) (resid 134 and name HB1 ) 1.8 0.0 2.2 ! lm  
  assign (resid 131 and name HA  ) (resid 134 and name HB2 ) 1.8 0.0 2.2 ! lm  
  assign (resid 131 and name HA  ) (resid 134 and name HG  ) 1.8 0.0 2.4 ! 2065
  assign (resid 131 and name HA  ) (resid 134 and name HD* ) 1.8 0.0 1.1 ! 1337,2146
  assign (resid 131 and name HA  ) (resid 135 and name HN  ) 1.8 0.0 2.2 
  assign (resid 132 and name HA  ) (resid 132 and name HB* ) 2.2 0.0 0.3 
  assign (resid 132 and name HA  ) (resid 133 and name HN  ) 1.8 0.0 1.8 
  assign (resid 132 and name HN  ) (resid 133 and name HN  ) 2.3 0.5 0.5 
  assign (resid 132 and name HN  ) (resid 134 and name HN  ) 3.0 1.2 1.2 
  assign (resid 132 and name HA  ) (resid 135 and name HN  ) 3.0 1.2 1.2 
  assign (resid 132 and name HA  ) (resid 136 and name HN  ) 3.0 1.2 1.2 
  assign (resid 133 and name HA  ) (resid 133 and name HB2 ) 2.2 0.0 0.3 
  assign (resid 133 and name HN  ) (resid 133 and name HB2 ) 1.8 0.0 1.4 ! 112
  assign (resid 133 and name HB2 ) (resid 134 and name HN  ) 1.8 0.0 2.6 ! 1034
  assign (resid 133 and name HB1 ) (resid 134 and name HN  ) 1.8 0.0 2.2 ! 1033
  assign (resid 133 and name HN  ) (resid 134 and name HN  ) 1.8 0.0 1.2 ! 1030
  assign (resid 133 and name HN  ) (resid 135 and name HN  ) 3.0 1.2 1.2 ! 1128,  as
  assign (resid 133 and name HA  ) (resid 136 and name HB* ) 1.8 0.0 1.0 ! 736,948
  assign (resid 133 and name HA  ) (resid 136 and name HN  ) 2.4 0.6 0.6 ! 199
  assign (resid 134 and name HN  ) (resid 134 and name HB1 ) 1.8 0.0 1.9 ! 1037
  assign (resid 134 and name HN  ) (resid 134 and name HB2 ) 1.8 0.0 1.3 ! 1035
  assign (resid 134 and name HN  ) (resid 134 and name HG  ) 1.8 0.0 1.4 ! 1036
  assign (resid 134 and name HA  ) (resid 134 and name HB1 ) 2.2 0.0 0.3 
  assign (resid 134 and name HB1 ) (resid 134 and name HG  ) 1.8 0.0 1.4 ! 3320
  assign (resid 134 and name HN  ) (resid 135 and name HN  ) 1.8 0.0 1.9 ! 1029
  assign (resid 134 and name HA  ) (resid 135 and name HN  ) 1.8 0.0 1.4 
  assign (resid 134 and name HN  ) (resid 136 and name HN  ) 3.0 1.2 1.2 ! 1256,as
  assign (resid 134 and name HA  ) (resid 137 and name HN  ) 1.8 0.0 1.2 ! 1054
  assign (resid 134 and name HA  ) (resid 137 and name HB2 ) 1.8 0.0 1.3 ! 1042
  assign (resid 134 and name HN  ) (resid 137 and name HN  ) 1.8 0.0 3.2 ! 1359
  assign (resid 134 and name HG  ) (resid 137 and name HB1 ) 1.8 0.0 1.6 ! 903
  assign (resid 134 and name HB1 ) (resid 139 and name HB* ) 1.8 0.0 1.9 ! 3617
  assign (resid 135 and name HA  ) (resid 135 and name HB* ) 2.2 0.0 0.3 
  assign (resid 135 and name HG* ) (resid 135 and name HE  ) 1.8 0.0 1.6 ! 1144,1145
  assign (resid 135 and name HE  ) (resid 135 and name HH2*) 1.8 0.0 2.3 ! 1142
  assign (resid 135 and name HE  ) (resid 135 and name HH11) 1.8 0.0 2.8 ! 1141
  assign (resid 135 and name HN  ) (resid 136 and name HN  ) 1.8 0.0 2.0 ! 1013
  assign (resid 135 and name HA  ) (resid 137 and name HN  ) 2.8 1.0 1.0 
  assign (resid 135 and name HN  ) (resid 137 and name HN  ) 3.0 1.2 1.2 ! 1360
  assign (resid 135 and name HA  ) (resid 138 and name HN  ) 1.8 0.0 1.8 
  assign (resid 136 and name HG* ) (resid 136 and name HD* ) 1.8 0.0 0.7 ! 1547,1545
  assign (resid 136 and name HN  ) (resid 136 and name HB* ) 1.8 0.0 0.9 ! 1045
  assign (resid 136 and name HN  ) (resid 136 and name HG* ) 1.8 0.0 1.2 ! 1046
  assign (resid 136 and name HA  ) (resid 136 and name HB* ) 2.2 0.0 0.3 
  assign (resid 136 and name HN  ) (resid 137 and name HN  ) 1.8 0.0 1.3 ! 1042
  assign (resid 136 and name HA  ) (resid 137 and name HN  ) 1.8 0.0 1.4 
  assign (resid 136 and name HB* ) (resid 137 and name HN  ) 1.8 0.0 1.5 ! 1055
  assign (resid 136 and name HN  ) (resid 138 and name HN  ) 3.0 1.2 1.2 ! 1394
  assign (resid 136 and name HA  ) (resid 138 and name HN  ) 2.8 1.0 1.0 
  assign (resid 137 and name HN  ) (resid 137 and name HB1 ) 1.8 0.0 1.3 ! 1053
  assign (resid 137 and name HA  ) (resid 137 and name HB* ) 2.2 0.0 0.3 
  assign (resid 137 and name HN  ) (resid 138 and name HN  ) 1.8 0.0 1.0 ! 1050,1057
  assign (resid 137 and name HB1 ) (resid 139 and name HD* ) 1.8 0.0 2.2 ! 1203
  assign (resid 137 and name HB2 ) (resid 139 and name HD* ) 1.8 0.0 2.2 ! 596,62a
  assign (resid 137 and name HN  ) (resid 139 and name HN  ) 1.8 0.0 2.4 ! 1048
  assign (resid 138 and name HN  ) (resid 138 and name HA  ) 1.8 0.0 1.0 ! 1060
  assign (resid 138 and name HN  ) (resid 138 and name HB* ) 1.8 0.0 1.9 ! 1061
  assign (resid 138 and name HB* ) (resid 138 and name HE2*) 1.8 0.0 2.2 ! 1123
  assign (resid 138 and name HG* ) (resid 138 and name HE2*) 1.8 0.0 3.4 ! 1126
  assign (resid 138 and name HN  ) (resid 139 and name HN  ) 1.8 0.0 1.5 ! 1062,1056
  assign (resid 138 and name HA  ) (resid 139 and name HN  ) 1.8 0.0 1.4 ! 1067
  assign (resid 138 and name HB* ) (resid 139 and name HN  ) 1.8 0.0 2.8 ! 1070
  assign (resid 139 and name HN  ) (resid 139 and name HB* ) 1.8 0.0 1.5 ! 1069
  assign (resid 139 and name HN  ) (resid 139 and name HD* ) 1.8 0.0 3.9 ! 1065
  assign (resid 139 and name HA  ) (resid 139 and name HB* ) 2.2 0.0 0.3 
  assign (resid 139 and name HA  ) (resid 139 and name HD* ) 1.8 0.0 2.2 !      
!
! HYDROGEN BOND RESTRAINTS FOR HUMAN PROFILIN I
!
  assign (resid   6 and name N   ) (resid   2 and name O   ) 3.0 0.4 0.4 
  assign (resid   6 and name HN  ) (resid   2 and name O   ) 2.0 0.4 0.4 
  assign (resid   7 and name N   ) (resid   3 and name O   ) 3.0 0.4 0.4 
  assign (resid   7 and name HN  ) (resid   3 and name O   ) 2.0 0.4 0.4 
  assign (resid   8 and name N   ) (resid   4 and name O   ) 3.0 0.4 0.4 
  assign (resid   8 and name HN  ) (resid   4 and name O   ) 2.0 0.4 0.4 
  assign (resid   9 and name HN  ) (resid   5 and name O   ) 2.0 0.4 0.4 
  assign (resid   9 and name N   ) (resid   5 and name O   ) 3.0 0.4 0.4 
  assign (resid  11 and name N   ) (resid   7 and name O   ) 3.0 0.4 0.4 
  assign (resid  11 and name HN  ) (resid   7 and name O   ) 2.0 0.4 0.4 
  assign (resid  12 and name HN  ) (resid   8 and name O   ) 2.0 0.4 0.4 
  assign (resid  12 and name N   ) (resid   8 and name O   ) 3.0 0.4 0.4 
  assign (resid  18 and name HN  ) (resid 113 and name O   ) 2.0 0.4 0.4 
  assign (resid  18 and name N   ) (resid 113 and name O   ) 3.0 0.4 0.4 
  assign (resid  20 and name HN  ) (resid 111 and name O   ) 2.0 0.4 0.4 
  assign (resid  20 and name N   ) (resid 111 and name O   ) 3.0 0.4 0.4 
  assign (resid  21 and name N   ) (resid  32 and name O   ) 3.0 0.4 0.4 
  assign (resid  21 and name HN  ) (resid  32 and name O   ) 2.0 0.4 0.4 
  assign (resid  22 and name N   ) (resid 109 and name O   ) 3.0 0.4 0.4 
  assign (resid  22 and name HN  ) (resid 109 and name O   ) 2.0 0.4 0.4 
  assign (resid  32 and name HN  ) (resid  21 and name O   ) 2.0 0.4 0.4 
  assign (resid  32 and name N   ) (resid  21 and name O   ) 3.0 0.4 0.4 
  assign (resid  34 and name HN  ) (resid  19 and name O   ) 2.0 0.4 0.4 
  assign (resid  34 and name N   ) (resid  19 and name O   ) 3.0 0.4 0.4 
  assign (resid  48 and name N   ) (resid  44 and name O   ) 3.0 0.4 0.4 
  assign (resid  48 and name HN  ) (resid  44 and name O   ) 2.0 0.4 0.4 
  assign (resid  49 and name N   ) (resid  45 and name O   ) 3.0 0.4 0.4 
  assign (resid  49 and name HN  ) (resid  45 and name O   ) 2.0 0.4 0.4 
  assign (resid  50 and name N   ) (resid  46 and name O   ) 3.0 0.4 0.4 
  assign (resid  50 and name HN  ) (resid  46 and name O   ) 2.0 0.4 0.4 
  assign (resid  51 and name N   ) (resid  47 and name O   ) 3.0 0.4 0.4 
  assign (resid  51 and name HN  ) (resid  47 and name O   ) 2.0 0.4 0.4 
  assign (resid  63 and name N   ) (resid  70 and name O   ) 3.0 0.4 0.4 
  assign (resid  63 and name HN  ) (resid  70 and name O   ) 2.0 0.4 0.4 
  assign (resid  65 and name HN  ) (resid  68 and name O   ) 2.0 0.4 0.4 
  assign (resid  65 and name N   ) (resid  68 and name O   ) 3.0 0.4 0.4 
  assign (resid  68 and name N   ) (resid  65 and name O   ) 3.0 0.4 0.4 
  assign (resid  68 and name HN  ) (resid  65 and name O   ) 2.0 0.4 0.4 
  assign (resid  70 and name HN  ) (resid  63 and name O   ) 2.0 0.4 0.4 
  assign (resid  70 and name N   ) (resid  63 and name O   ) 3.0 0.4 0.4 
  assign (resid  71 and name N   ) (resid  88 and name O   ) 3.0 0.4 0.4 
  assign (resid  71 and name HN  ) (resid  88 and name O   ) 2.0 0.4 0.4 
  assign (resid  73 and name N   ) (resid  86 and name O   ) 3.0 0.4 0.6 
  assign (resid  73 and name HN  ) (resid  86 and name O   ) 2.0 0.4 0.6 
  assign (resid  85 and name N   ) (resid 102 and name O   ) 3.0 0.4 0.4 
  assign (resid  85 and name HN  ) (resid 102 and name O   ) 2.0 0.4 0.4 
  assign (resid  86 and name N   ) (resid  73 and name O   ) 3.0 0.4 0.6 
  assign (resid  86 and name HN  ) (resid  73 and name O   ) 2.0 0.4 0.6 
  assign (resid  87 and name N   ) (resid 100 and name O   ) 3.0 0.4 0.4 
  assign (resid  87 and name HN  ) (resid 100 and name O   ) 2.0 0.4 0.4 
  assign (resid  88 and name N   ) (resid  71 and name O   ) 3.0 0.4 0.4 
  assign (resid  88 and name HN  ) (resid  71 and name O   ) 2.0 0.4 0.4 
  assign (resid  89 and name N   ) (resid  98 and name O   ) 3.0 0.4 0.4 
  assign (resid  89 and name HN  ) (resid  98 and name O   ) 2.0 0.4 0.4 
  assign (resid  98 and name N   ) (resid  89 and name O   ) 3.0 0.4 0.4 
  assign (resid  98 and name HN  ) (resid  89 and name O   ) 2.0 0.4 0.4 
  assign (resid  99 and name HN  ) (resid 114 and name O   ) 2.0 0.4 0.4 
  assign (resid  99 and name N   ) (resid 114 and name O   ) 3.0 0.4 0.4 
  assign (resid 100 and name N   ) (resid  87 and name O   ) 3.0 0.4 0.4 
  assign (resid 100 and name HN  ) (resid  87 and name O   ) 2.0 0.4 0.4 
  assign (resid 101 and name N   ) (resid 112 and name O   ) 3.0 0.4 0.4 
  assign (resid 101 and name HN  ) (resid 112 and name O   ) 2.0 0.4 0.4 
  assign (resid 102 and name N   ) (resid  85 and name O   ) 3.0 0.4 0.4 
  assign (resid 102 and name HN  ) (resid  85 and name O   ) 2.0 0.4 0.4 
  assign (resid 103 and name N   ) (resid 110 and name O   ) 3.0 0.4 0.4 
  assign (resid 103 and name HN  ) (resid 110 and name O   ) 2.0 0.4 0.4 
  assign (resid 104 and name N   ) (resid  83 and name O   ) 3.0 0.4 0.4 
  assign (resid 104 and name HN  ) (resid  83 and name O   ) 2.0 0.4 0.4 
  assign (resid 105 and name N   ) (resid 108 and name O   ) 3.0 0.4 0.4 
  assign (resid 105 and name HN  ) (resid 108 and name O   ) 2.0 0.4 0.4 
  assign (resid 109 and name N   ) (resid  22 and name O   ) 3.0 0.4 0.4 
  assign (resid 109 and name HN  ) (resid  22 and name O   ) 2.0 0.4 0.4 
  assign (resid 110 and name N   ) (resid 103 and name O   ) 3.0 0.4 0.4 
  assign (resid 110 and name HN  ) (resid 103 and name O   ) 2.0 0.4 0.4 
  assign (resid 111 and name N   ) (resid  20 and name O   ) 3.0 0.4 0.4 
  assign (resid 111 and name HN  ) (resid  20 and name O   ) 2.0 0.4 0.4 
  assign (resid 112 and name N   ) (resid 101 and name O   ) 3.0 0.4 0.4 
  assign (resid 112 and name HN  ) (resid 101 and name O   ) 2.0 0.4 0.4 
  assign (resid 113 and name N   ) (resid  18 and name O   ) 3.0 0.4 0.4 
  assign (resid 113 and name HN  ) (resid  18 and name O   ) 2.0 0.4 0.4 
  assign (resid 114 and name N   ) (resid  99 and name O   ) 3.0 0.4 0.4 
  assign (resid 114 and name HN  ) (resid  99 and name O   ) 2.0 0.4 0.4 
  assign (resid 125 and name N   ) (resid 121 and name O   ) 3.0 0.4 0.4 
  assign (resid 125 and name HN  ) (resid 121 and name O   ) 2.0 0.4 0.4 
  assign (resid 126 and name N   ) (resid 122 and name O   ) 3.0 0.4 0.4 
  assign (resid 126 and name HN  ) (resid 122 and name O   ) 2.0 0.4 0.4 
  assign (resid 127 and name N   ) (resid 123 and name O   ) 3.0 0.4 0.4 
  assign (resid 127 and name HN  ) (resid 123 and name O   ) 2.0 0.4 0.4 
  assign (resid 128 and name N   ) (resid 124 and name O   ) 3.0 0.4 0.4 
  assign (resid 128 and name HN  ) (resid 124 and name O   ) 2.0 0.4 0.4 
  assign (resid 129 and name N   ) (resid 125 and name O   ) 3.0 0.4 0.4 
  assign (resid 129 and name HN  ) (resid 125 and name O   ) 2.0 0.4 0.4 
  assign (resid 130 and name N   ) (resid 126 and name O   ) 3.0 0.4 0.4 
  assign (resid 130 and name HN  ) (resid 126 and name O   ) 2.0 0.4 0.4 
  assign (resid 131 and name N   ) (resid 127 and name O   ) 3.0 0.4 0.4 
  assign (resid 131 and name HN  ) (resid 127 and name O   ) 2.0 0.4 0.4 
  assign (resid 132 and name N   ) (resid 128 and name O   ) 3.0 0.4 0.4 
  assign (resid 132 and name HN  ) (resid 128 and name O   ) 2.0 0.4 0.4 
  assign (resid 133 and name N   ) (resid 129 and name O   ) 3.0 0.4 0.4 
  assign (resid 133 and name HN  ) (resid 129 and name O   ) 2.0 0.4 0.4 
  assign (resid 134 and name N   ) (resid 130 and name O   ) 3.0 0.4 0.4 
  assign (resid 134 and name HN  ) (resid 130 and name O   ) 2.0 0.4 0.4 
  assign (resid 135 and name N   ) (resid 131 and name O   ) 3.0 0.4 0.4 
  assign (resid 135 and name HN  ) (resid 131 and name O   ) 2.0 0.4 0.4 
  assign (resid 136 and name N   ) (resid 132 and name O   ) 3.0 0.4 0.4 
  assign (resid 136 and name HN  ) (resid 132 and name O   ) 2.0 0.4 0.4 
!
! TORSION ANGLE RESTRAINT FOR HUMAN PROFILIN I
!
restraints dihedral reset
! 
!  angle constraints for phi
!
 assign (resid   2 and name c )  (resid   3 and name n ) (resid   3 and name ca)  (resid   3 and name c ) 10.0  -60.0 40.0 2
 assign (resid   3 and name c )  (resid   4 and name n ) (resid   4 and name ca)  (resid   4 and name c ) 10.0  -60.0 40.0 2 
 assign (resid   4 and name c )  (resid   5 and name n ) (resid   5 and name ca)  (resid   5 and name c ) 10.0  -60.0 40.0 2
 assign (resid   5 and name c )  (resid   6 and name n ) (resid   6 and name ca)  (resid   6 and name c ) 10.0  -60.0 40.0 2
 assign (resid   6 and name c )  (resid   7 and name n ) (resid   7 and name ca)  (resid   7 and name c ) 10.0  -60.0 40.0 2 
 assign (resid   7 and name c )  (resid   8 and name n ) (resid   8 and name ca)  (resid   8 and name c ) 10.0  -60.0 40.0 2 
 assign (resid   8 and name c )  (resid   9 and name n ) (resid   9 and name ca)  (resid   9 and name c ) 10.0  -60.0 40.0 2
 assign (resid   9 and name c )  (resid  10 and name n ) (resid  10 and name ca)  (resid  10 and name c ) 10.0  -60.0 40.0 2
 assign (resid  10 and name c )  (resid  11 and name n ) (resid  11 and name ca)  (resid  11 and name c ) 10.0  -60.0 40.0 2 
 assign (resid  11 and name c )  (resid  12 and name n ) (resid  12 and name ca)  (resid  12 and name c ) 10.0  -60.0 40.0 2 
 assign (resid  12 and name c )  (resid  13 and name n ) (resid  13 and name ca)  (resid  13 and name c ) 10.0  -60.0 40.0 2
 assign (resid  13 and name c )  (resid  14 and name n ) (resid  14 and name ca)  (resid  14 and name c ) 10.0   60.0 40.0 2
 assign (resid  14 and name c )  (resid  15 and name n ) (resid  15 and name ca)  (resid  15 and name c ) 10.0 -120.0 40.0 2
 assign (resid  15 and name c )  (resid  16 and name n ) (resid  16 and name ca)  (resid  16 and name c ) 10.0 -120.0 50.0 2 
 assign (resid  16 and name c )  (resid  17 and name n ) (resid  17 and name ca)  (resid  17 and name c ) 10.0 -120.0 50.0 2
 assign (resid  18 and name c )  (resid  19 and name n ) (resid  19 and name ca)  (resid  19 and name c ) 10.0 -120.0 50.0 2
 assign (resid  19 and name c )  (resid  20 and name n ) (resid  20 and name ca)  (resid  20 and name c ) 10.0 -120.0 50.0 2
 assign (resid  20 and name c )  (resid  21 and name n ) (resid  21 and name ca)  (resid  21 and name c ) 10.0 -120.0 50.0 2 
 assign (resid  21 and name c )  (resid  22 and name n ) (resid  22 and name ca)  (resid  22 and name c ) 10.0 -120.0 50.0 2
 assign (resid  23 and name c )  (resid  24 and name n ) (resid  24 and name ca)  (resid  24 and name c ) 10.0  -60.0 40.0 2
 assign (resid  26 and name c )  (resid  27 and name n ) (resid  27 and name ca)  (resid  27 and name c ) 10.0 -120.0 50.0 2
 assign (resid  29 and name c )  (resid  30 and name n ) (resid  30 and name ca)  (resid  30 and name c ) 10.0  -60.0 40.0 2
 assign (resid  30 and name c )  (resid  31 and name n ) (resid  31 and name ca)  (resid  31 and name c ) 10.0 -120.0 50.0 2 
 assign (resid  33 and name c )  (resid  34 and name n ) (resid  34 and name ca)  (resid  34 and name c ) 10.0  -60.0 40.0 2 
 assign (resid  36 and name c )  (resid  37 and name n ) (resid  37 and name ca)  (resid  37 and name c ) 10.0 -120.0 50.0 2
 assign (resid  38 and name c )  (resid  39 and name n ) (resid  39 and name ca)  (resid  39 and name c ) 10.0  -60.0 40.0 2
 assign (resid  39 and name c )  (resid  40 and name n ) (resid  40 and name ca)  (resid  40 and name c ) 10.0  -60.0 40.0 2
 assign (resid  40 and name c )  (resid  41 and name n ) (resid  41 and name ca)  (resid  41 and name c ) 10.0 -120.0 50.0 2
 assign (resid  41 and name c )  (resid  42 and name n ) (resid  42 and name ca)  (resid  42 and name c ) 10.0  -60.0 40.0 2
 assign (resid  42 and name c )  (resid  43 and name n ) (resid  43 and name ca)  (resid  43 and name c ) 10.0 -120.0 50.0 2
 assign (resid  44 and name c )  (resid  45 and name n ) (resid  45 and name ca)  (resid  45 and name c ) 10.0  -60.0 40.0 2
 assign (resid  45 and name c )  (resid  46 and name n ) (resid  46 and name ca)  (resid  46 and name c ) 10.0  -60.0 40.0 2
 assign (resid  48 and name c )  (resid  49 and name n ) (resid  49 and name ca)  (resid  49 and name c ) 10.0  -60.0 40.0 2
 assign (resid  49 and name c )  (resid  50 and name n ) (resid  50 and name ca)  (resid  50 and name c ) 10.0  -60.0 40.0 2
 assign (resid  50 and name c )  (resid  51 and name n ) (resid  51 and name ca)  (resid  51 and name c ) 10.0 -120.0 50.0 2
 assign (resid  52 and name c )  (resid  53 and name n ) (resid  53 and name ca)  (resid  53 and name c ) 10.0  -60.0 40.0 2
 assign (resid  53 and name c )  (resid  54 and name n ) (resid  54 and name ca)  (resid  54 and name c ) 10.0  -60.0 40.0 2
 assign (resid  54 and name c )  (resid  55 and name n ) (resid  55 and name ca)  (resid  55 and name c ) 10.0 -120.0 50.0 2
 assign (resid  56 and name c )  (resid  57 and name n ) (resid  57 and name ca)  (resid  57 and name c ) 10.0  -60.0 40.0 2
 assign (resid  59 and name c )  (resid  60 and name n ) (resid  60 and name ca)  (resid  60 and name c ) 10.0 -120.0 50.0 2
 assign (resid  60 and name c )  (resid  61 and name n ) (resid  61 and name ca)  (resid  61 and name c ) 10.0 -120.0 50.0 2
 assign (resid  63 and name c )  (resid  64 and name n ) (resid  64 and name ca)  (resid  64 and name c ) 10.0 -120.0 50.0 2
 assign (resid  64 and name c )  (resid  65 and name n ) (resid  65 and name ca)  (resid  65 and name c ) 10.0 -120.0 50.0 2
 assign (resid  68 and name c )  (resid  69 and name n ) (resid  69 and name ca)  (resid  69 and name c ) 10.0  -60.0 40.0 2
 assign (resid  69 and name c )  (resid  70 and name n ) (resid  70 and name ca)  (resid  70 and name c ) 10.0 -120.0 50.0 2
 assign (resid  70 and name c )  (resid  71 and name n ) (resid  71 and name ca)  (resid  71 and name c ) 10.0 -120.0 50.0 2 
 assign (resid  71 and name c )  (resid  72 and name n ) (resid  72 and name ca)  (resid  72 and name c ) 10.0  -60.0 40.0 2 
 assign (resid  72 and name c )  (resid  73 and name n ) (resid  73 and name ca)  (resid  73 and name c ) 10.0 -120.0 50.0 2 
 assign (resid  74 and name c )  (resid  75 and name n ) (resid  75 and name ca)  (resid  75 and name c ) 10.0 -120.0 50.0 2
 assign (resid  75 and name c )  (resid  76 and name n ) (resid  76 and name ca)  (resid  76 and name c ) 10.0 -120.0 50.0 2
 assign (resid  76 and name c )  (resid  77 and name n ) (resid  77 and name ca)  (resid  77 and name c ) 10.0  -60.0 40.0 2
 assign (resid  77 and name c )  (resid  78 and name n ) (resid  78 and name ca)  (resid  78 and name c ) 10.0  -80.0 30.0 2
 assign (resid  78 and name c )  (resid  79 and name n ) (resid  79 and name ca)  (resid  79 and name c ) 10.0  -80.0 30.0 2
 assign (resid  79 and name c )  (resid  80 and name n ) (resid  80 and name ca)  (resid  80 and name c ) 10.0  -60.0 40.0 2
 assign (resid  80 and name c )  (resid  81 and name n ) (resid  81 and name ca)  (resid  81 and name c ) 10.0   60.0 40.0 2
 assign (resid  81 and name c )  (resid  82 and name n ) (resid  82 and name ca)  (resid  82 and name c ) 10.0 -120.0 50.0 2
 assign (resid  82 and name c )  (resid  83 and name n ) (resid  83 and name ca)  (resid  83 and name c ) 10.0   60.0 40.0 2
 assign (resid  84 and name c )  (resid  85 and name n ) (resid  85 and name ca)  (resid  85 and name c ) 10.0 -120.0 50.0 2
 assign (resid  86 and name c )  (resid  87 and name n ) (resid  87 and name ca)  (resid  87 and name c ) 10.0 -120.0 50.0 2
 assign (resid  87 and name c )  (resid  88 and name n ) (resid  88 and name ca)  (resid  88 and name c ) 10.0 -120.0 50.0 2
 assign (resid  88 and name c )  (resid  89 and name n ) (resid  89 and name ca)  (resid  89 and name c ) 10.0  -60.0 40.0 2
 assign (resid  89 and name c )  (resid  90 and name n ) (resid  90 and name ca)  (resid  90 and name c ) 10.0 -120.0 50.0 2
 assign (resid  90 and name c )  (resid  91 and name n ) (resid  91 and name ca)  (resid  91 and name c ) 10.0 -120.0 30.0 2 
 assign (resid  91 and name c )  (resid  92 and name n ) (resid  92 and name ca)  (resid  92 and name c ) 10.0 -120.0 50.0 2
 assign (resid  94 and name c )  (resid  95 and name n ) (resid  95 and name ca)  (resid  95 and name c ) 10.0  -60.0 40.0 2
 assign (resid  96 and name c )  (resid  97 and name n ) (resid  97 and name ca)  (resid  97 and name c ) 10.0 -120.0 50.0 2
 assign (resid  97 and name c )  (resid  98 and name n ) (resid  98 and name ca)  (resid  98 and name c ) 10.0 -120.0 50.0 2
 assign (resid 100 and name c )  (resid 101 and name n ) (resid 101 and name ca)  (resid 101 and name c ) 10.0 -120.0 50.0 2
 assign (resid 101 and name c )  (resid 102 and name n ) (resid 102 and name ca)  (resid 102 and name c ) 10.0 -120.0 50.0 2
 assign (resid 102 and name c )  (resid 103 and name n ) (resid 103 and name ca)  (resid 103 and name c ) 10.0 -120.0 50.0 2 
 assign (resid 104 and name c )  (resid 105 and name n ) (resid 105 and name ca)  (resid 105 and name c ) 10.0 -120.0 50.0 2 
 assign (resid 105 and name c )  (resid 106 and name n ) (resid 106 and name ca)  (resid 106 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 106 and name c )  (resid 107 and name n ) (resid 107 and name ca)  (resid 107 and name c ) 10.0 -120.0 50.0 2
 assign (resid 107 and name c )  (resid 108 and name n ) (resid 108 and name ca)  (resid 108 and name c ) 10.0 -120.0 50.0 2
 assign (resid 108 and name c )  (resid 109 and name n ) (resid 109 and name ca)  (resid 109 and name c ) 10.0 -120.0 50.0 2 
 assign (resid 109 and name c )  (resid 110 and name n ) (resid 110 and name ca)  (resid 110 and name c ) 10.0 -120.0 50.0 2 
 assign (resid 110 and name c )  (resid 111 and name n ) (resid 111 and name ca)  (resid 111 and name c ) 10.0 -120.0 50.0 2
 assign (resid 111 and name c )  (resid 112 and name n ) (resid 112 and name ca)  (resid 112 and name c ) 10.0 -120.0 50.0 2
 assign (resid 115 and name c )  (resid 116 and name n ) (resid 116 and name ca)  (resid 116 and name c ) 10.0  -60.0 40.0 2
 assign (resid 117 and name c )  (resid 118 and name n ) (resid 118 and name ca)  (resid 118 and name c ) 10.0  -60.0 40.0 2
 assign (resid 118 and name c )  (resid 119 and name n ) (resid 119 and name ca)  (resid 119 and name c ) 10.0  -60.0 40.0 2
 assign (resid 121 and name c )  (resid 122 and name n ) (resid 122 and name ca)  (resid 122 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 122 and name c )  (resid 123 and name n ) (resid 123 and name ca)  (resid 123 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 123 and name c )  (resid 124 and name n ) (resid 124 and name ca)  (resid 124 and name c ) 10.0  -60.0 40.0 2
 assign (resid 124 and name c )  (resid 125 and name n ) (resid 125 and name ca)  (resid 125 and name c ) 10.0  -60.0 40.0 2
 assign (resid 125 and name c )  (resid 126 and name n ) (resid 126 and name ca)  (resid 126 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 126 and name c )  (resid 127 and name n ) (resid 127 and name ca)  (resid 127 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 127 and name c )  (resid 128 and name n ) (resid 128 and name ca)  (resid 128 and name c ) 10.0  -60.0 40.0 2
 assign (resid 128 and name c )  (resid 129 and name n ) (resid 129 and name ca)  (resid 129 and name c ) 10.0  -60.0 40.0 2
 assign (resid 129 and name c )  (resid 130 and name n ) (resid 130 and name ca)  (resid 130 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 130 and name c )  (resid 131 and name n ) (resid 131 and name ca)  (resid 131 and name c ) 10.0  -60.0 40.0 2
 assign (resid 131 and name c )  (resid 132 and name n ) (resid 132 and name ca)  (resid 132 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 132 and name c )  (resid 133 and name n ) (resid 133 and name ca)  (resid 133 and name c ) 10.0  -60.0 40.0 2
 assign (resid 133 and name c )  (resid 134 and name n ) (resid 134 and name ca)  (resid 134 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 134 and name c )  (resid 135 and name n ) (resid 135 and name ca)  (resid 135 and name c ) 10.0  -60.0 40.0 2
 assign (resid 135 and name c )  (resid 136 and name n ) (resid 136 and name ca)  (resid 136 and name c ) 10.0  -60.0 40.0 2 
 assign (resid 136 and name c )  (resid 137 and name n ) (resid 137 and name ca)  (resid 137 and name c ) 10.0 -120.0 50.0 2
 assign (resid 138 and name c )  (resid 139 and name n ) (resid 139 and name ca)  (resid 139 and name c ) 10.0 -120.0 50.0 2
 assign (resid  12 and name n )  (resid  12 and name ca) (resid  12 and name c )  (resid  13 and name n ) 10.0   30.0 30.0 2
 assign (resid  13 and name n )  (resid  13 and name ca) (resid  13 and name c )  (resid  14 and name n ) 10.0   30.0 30.0 2
 assign (resid  14 and name n )  (resid  14 and name ca) (resid  14 and name c )  (resid  15 and name n ) 10.0   45.0 30.0 2
 assign (resid 115 and name n )  (resid 115 and name ca) (resid 115 and name c )  (resid 116 and name n ) 10.0  160.0 30.0 2
 assign (resid 116 and name n )  (resid 116 and name ca) (resid 116 and name c )  (resid 117 and name n ) 10.0  130.0 30.0 2
 assign (resid 112 and name c )  (resid 113 and name n ) (resid 113 and name ca)  (resid 113 and name c ) 10.0 -120.0 30.0 2
 assign (resid 116 and name c )  (resid 117 and name n ) (resid 117 and name ca)  (resid 117 and name c ) 10.0   90.0 30.0 2
! 
! angle constraints for chi
!
 assign (resid   3 and name n )  (resid   3 and name ca) (resid   3 and name cb)  (resid   3 and name cg)  10.0 -60.0 30.0 2
 assign (resid   4 and name n )  (resid   4 and name ca) (resid   4 and name cb)  (resid   4 and name cg)  10.0   0.0 90.0 2
 assign (resid   6 and name n )  (resid   6 and name ca) (resid   6 and name cb)  (resid   6 and name cg)  10.0   0.0 90.0 2
 assign (resid   7 and name n )  (resid   7 and name ca) (resid   7 and name cb)  (resid   7 and name cg1) 10.0 -60.0 30.0 2
 assign (resid   8 and name n )  (resid   8 and name ca) (resid   8 and name cb)  (resid   8 and name cg)  10.0 -60.0 30.0 2  
 assign (resid  10 and name n )  (resid  10 and name ca) (resid  10 and name cb)  (resid  10 and name cg)  10.0   0.0 90.0 2
 assign (resid  11 and name n )  (resid  11 and name ca) (resid  11 and name cb)  (resid  11 and name cg)  10.0   0.0 90.0 2
 assign (resid  13 and name n )  (resid  13 and name ca) (resid  13 and name cb)  (resid  13 and name cg)  10.0  60.0 30.0 2
 assign (resid  15 and name n )  (resid  15 and name ca) (resid  15 and name cb)  (resid  15 and name og1) 10.0 240.0 90.0 2
 assign (resid  16 and name n )  (resid  16 and name ca) (resid  16 and name cb)  (resid  16 and name sg)  10.0  60.0 30.0 2 !
 assign (resid  17 and name n )  (resid  17 and name ca) (resid  17 and name cb)  (resid  17 and name cg)  10.0 180.0 30.0 2
 assign (resid  18 and name n )  (resid  18 and name ca) (resid  18 and name cb)  (resid  18 and name cg)  10.0 180.0 30.0 2
 assign (resid  21 and name n )  (resid  21 and name ca) (resid  21 and name cb)  (resid  21 and name cg1) 10.0 -60.0 30.0 2
 assign (resid  22 and name n )  (resid  22 and name ca) (resid  22 and name cb)  (resid  22 and name cg1) 10.0 180.0 30.0 2
 assign (resid  24 and name n )  (resid  24 and name ca) (resid  24 and name cb)  (resid  24 and name cg)  10.0  60.0 30.0 2
 assign (resid  26 and name n )  (resid  26 and name ca) (resid  26 and name cb)  (resid  26 and name cg)  10.0  60.0 30.0 2 !
 assign (resid  27 and name n )  (resid  27 and name ca) (resid  27 and name cb)  (resid  27 and name og)  10.0  60.0 30.0 2
 assign (resid  29 and name n )  (resid  29 and name ca) (resid  29 and name cb)  (resid  29 and name og)  10.0  60.0 30.0 2
 assign (resid  30 and name n )  (resid  30 and name ca) (resid  30 and name cb)  (resid  30 and name cg1) 10.0 180.0 30.0 2
 assign (resid  34 and name n )  (resid  34 and name ca) (resid  34 and name cb)  (resid  34 and name cg1) 10.0 180.0 30.0 2
 assign (resid  37 and name n )  (resid  37 and name ca) (resid  37 and name cb)  (resid  37 and name cg)  10.0   0.0 90.0 2
 assign (resid  38 and name n )  (resid  38 and name ca) (resid  38 and name cb)  (resid  38 and name og1) 10.0 -60.0 30.0 2 !
 assign (resid  39 and name n )  (resid  39 and name ca) (resid  39 and name cb)  (resid  39 and name cg)  10.0   0.0 90.0 2
 assign (resid  40 and name n )  (resid  40 and name ca) (resid  40 and name cb)  (resid  40 and name cg1) 10.0  60.0 30.0 2
 assign (resid  41 and name n )  (resid  41 and name ca) (resid  41 and name cb)  (resid  41 and name cg)  10.0 -60.0 30.0 2
 assign (resid  42 and name n )  (resid  42 and name ca) (resid  42 and name cb)  (resid  42 and name cg1) 10.0 -60.0 30.0 2 !
 assign (resid  46 and name n )  (resid  46 and name ca) (resid  46 and name cb)  (resid  46 and name cg)  10.0  60.0 30.0 2 !
 assign (resid  47 and name n )  (resid  47 and name ca) (resid  47 and name cb)  (resid  47 and name cg1) 10.0 180.0 30.0 2 !
 assign (resid  49 and name n )  (resid  49 and name ca) (resid  49 and name cb)  (resid  49 and name cg1) 10.0  60.0 30.0 2
 assign (resid  50 and name n )  (resid  50 and name ca) (resid  50 and name cb)  (resid  50 and name cg)  10.0 -60.0 30.0 2 !
 assign (resid  51 and name n )  (resid  51 and name ca) (resid  51 and name cb)  (resid  51 and name cg1) 10.0 -60.0 30.0 2
 assign (resid  53 and name n )  (resid  53 and name ca) (resid  53 and name cb)  (resid  53 and name cg)  10.0   0.0 90.0 2
 assign (resid  54 and name n )  (resid  54 and name ca) (resid  54 and name cb)  (resid  54 and name cg)  10.0 180.0 30.0 2
 assign (resid  56 and name n )  (resid  56 and name ca) (resid  56 and name cb)  (resid  56 and name og)  10.0 180.0 30.0 2 !
 assign (resid  57 and name n )  (resid  57 and name ca) (resid  57 and name cb)  (resid  57 and name og)  10.0  60.0 30.0 2
 assign (resid  58 and name n )  (resid  58 and name ca) (resid  58 and name cb)  (resid  58 and name cg)  10.0   0.0 90.0 2
 assign (resid  59 and name n )  (resid  59 and name ca) (resid  59 and name cb)  (resid  59 and name cg)  10.0 -60.0 30.0 2
 assign (resid  60 and name n )  (resid  60 and name ca) (resid  60 and name cb)  (resid  60 and name cg1) 10.0 -60.0 30.0 2 !
 assign (resid  61 and name n )  (resid  61 and name ca) (resid  61 and name cb)  (resid  61 and name cg)  10.0  60.0 30.0 2
 assign (resid  63 and name n )  (resid  63 and name ca) (resid  63 and name cb)  (resid  63 and name cg)  10.0   0.0 90.0 2
 assign (resid  64 and name n )  (resid  64 and name ca) (resid  64 and name cb)  (resid  64 and name og1) 10.0  60.0 30.0 2
 assign (resid  65 and name n )  (resid  65 and name ca) (resid  65 and name cb)  (resid  65 and name cg)  10.0  60.0 30.0 2
 assign (resid  70 and name n )  (resid  70 and name ca) (resid  70 and name cb)  (resid  70 and name sg)  10.0  60.0 30.0 2
 assign (resid  71 and name n )  (resid  71 and name ca) (resid  71 and name cb)  (resid  71 and name og)  10.0  60.0 30.0 2
 assign (resid  72 and name n )  (resid  72 and name ca) (resid  72 and name cb)  (resid  72 and name cg1) 10.0 180.0 30.0 2 !
 assign (resid  73 and name n )  (resid  73 and name ca) (resid  73 and name cb)  (resid  73 and name cg1) 10.0 -60.0 30.0 2
 assign (resid  75 and name n )  (resid  75 and name ca) (resid  75 and name cb)  (resid  75 and name cg)  10.0 180.0 30.0 2
! assign (resid  76 and name n )  (resid  76 and name ca) (resid  76 and name cb)  (resid  76 and name og)  10.0 180.0 30.0 2
 assign (resid  77 and name n )  (resid  77 and name ca) (resid  77 and name cb)  (resid  77 and name cg)  10.0 180.0 30.0 2
 assign (resid  79 and name n )  (resid  79 and name ca) (resid  79 and name cb)  (resid  79 and name cg)  10.0  60.0 30.0 2
 assign (resid  80 and name n )  (resid  80 and name ca) (resid  80 and name cb)  (resid  80 and name cg)  10.0 180.0 30.0 2
 assign (resid  82 and name n )  (resid  82 and name ca) (resid  82 and name cb)  (resid  82 and name cg)  10.0 -60.0 30.0 2
 assign (resid  84 and name n )  (resid  84 and name ca) (resid  84 and name cb)  (resid  84 and name og)  10.0  60.0 30.0 2
 assign (resid  85 and name n )  (resid  85 and name ca) (resid  85 and name cb)  (resid  85 and name cg)  10.0 180.0 30.0 2 !
 assign (resid  86 and name n )  (resid  86 and name ca) (resid  86 and name cb)  (resid  86 and name cg)  10.0 -60.0 30.0 2
!assign (resid  87 and name n )  (resid  87 and name ca) (resid  87 and name cb)  (resid  87 and name cg)  10.0  60.0 30.0 2
 assign (resid  88 and name n )  (resid  88 and name ca) (resid  88 and name cb)  (resid  88 and name cg)  10.0   0.0 90.0 2 !
 assign (resid  89 and name n )  (resid  89 and name ca) (resid  89 and name cb)  (resid  89 and name og1) 10.0  60.0 30.0 2
 assign (resid  90 and name n )  (resid  90 and name ca) (resid  90 and name cb)  (resid  90 and name cg)  10.0 -60.0 30.0 2 !
 assign (resid  91 and name n )  (resid  91 and name ca) (resid  91 and name cb)  (resid  91 and name og)  10.0 180.0 30.0 2
 assign (resid  92 and name n )  (resid  92 and name ca) (resid  92 and name cb)  (resid  92 and name og1) 10.0  60.0 30.0 2
 assign (resid  96 and name n )  (resid  96 and name ca) (resid  96 and name cb)  (resid  96 and name cg)  10.0  60.0 30.0 2
 assign (resid  97 and name n )  (resid  97 and name ca) (resid  97 and name cb)  (resid  97 and name og1) 10.0  60.0 30.0 2
 assign (resid  98 and name n )  (resid  98 and name ca) (resid  98 and name cb)  (resid  98 and name cg)  10.0 -60.0 30.0 2
 assign (resid  99 and name n )  (resid  99 and name ca) (resid  99 and name cb)  (resid  99 and name cg)  10.0 -60.0 30.0 2
 assign (resid 100 and name n )  (resid 100 and name ca) (resid 100 and name cb)  (resid 100 and name cg1) 10.0 180.0 30.0 2
 assign (resid 101 and name n )  (resid 101 and name ca) (resid 101 and name cb)  (resid 101 and name og1) 10.0 -60.0 30.0 2
 assign (resid 102 and name n )  (resid 102 and name ca) (resid 102 and name cb)  (resid 102 and name cg1) 10.0 180.0 30.0 2
 assign (resid 103 and name n )  (resid 103 and name ca) (resid 103 and name cb)  (resid 103 and name og1) 10.0  60.0 30.0 2 !
 assign (resid 104 and name n )  (resid 104 and name ca) (resid 104 and name cb)  (resid 104 and name cg)  10.0 180.0 30.0 2
 assign (resid 105 and name n )  (resid 105 and name ca) (resid 105 and name cb)  (resid 105 and name og1) 10.0  60.0 30.0 2 !
 assign (resid 106 and name n )  (resid 106 and name ca) (resid 106 and name cb)  (resid 106 and name cg)  10.0 180.0 30.0 2
 assign (resid 108 and name n )  (resid 108 and name ca) (resid 108 and name cb)  (resid 108 and name og1) 10.0  60.0 30.0 2
 assign (resid 109 and name n )  (resid 109 and name ca) (resid 109 and name cb)  (resid 109 and name cg)  10.0 180.0 30.0 2
 assign (resid 110 and name n )  (resid 110 and name ca) (resid 110 and name cb)  (resid 110 and name cg1) 10.0 180.0 30.0 2
 assign (resid 111 and name n )  (resid 111 and name ca) (resid 111 and name cb)  (resid 111 and name cg)  10.0   0.0 90.0 2
 assign (resid 112 and name n )  (resid 112 and name ca) (resid 112 and name cb)  (resid 112 and name cg)  10.0 180.0 30.0 2
 assign (resid 113 and name n )  (resid 113 and name ca) (resid 113 and name cb)  (resid 113 and name cg)  10.0 180.0 30.0 2
 assign (resid 115 and name n )  (resid 115 and name ca) (resid 115 and name cb)  (resid 115 and name cg)  10.0 -60.0 30.0 2
 assign (resid 116 and name n )  (resid 116 and name ca) (resid 116 and name cb)  (resid 116 and name cg)  10.0 180.0 30.0 2
 assign (resid 118 and name n )  (resid 118 and name ca) (resid 118 and name cb)  (resid 118 and name cg1) 10.0  60.0 30.0 2
 assign (resid 119 and name n )  (resid 119 and name ca) (resid 119 and name cb)  (resid 119 and name cg)  10.0 180.0 30.0 2
 assign (resid 122 and name n )  (resid 122 and name ca) (resid 122 and name cb)  (resid 122 and name cg)  10.0   0.0 90.0 2
 assign (resid 123 and name n )  (resid 123 and name ca) (resid 123 and name cb)  (resid 123 and name cg1) 10.0 -60.0 30.0 2
 assign (resid 124 and name n )  (resid 124 and name ca) (resid 124 and name cb)  (resid 124 and name cg)  10.0 180.0 30.0 2
 assign (resid 125 and name n )  (resid 125 and name ca) (resid 125 and name cb)  (resid 125 and name cg)  10.0   0.0 90.0 2
 assign (resid 126 and name n )  (resid 126 and name ca) (resid 126 and name cb)  (resid 126 and name cg)  10.0   0.0 90.0 2
 assign (resid 127 and name n )  (resid 127 and name ca) (resid 127 and name cb)  (resid 127 and name sg)  10.0 180.0 30.0 2
 assign (resid 128 and name n )  (resid 128 and name ca) (resid 128 and name cb)  (resid 128 and name cg)  10.0 180.0 30.0 2
 assign (resid 129 and name n )  (resid 129 and name ca) (resid 129 and name cb)  (resid 129 and name cg) 10.0   0.0 90.0 2
 assign (resid 130 and name n )  (resid 130 and name ca) (resid 130 and name cb)  (resid 130 and name cg) 10.0 180.0 30.0 2
 assign (resid 132 and name n )  (resid 132 and name ca) (resid 132 and name cb)  (resid 132 and name og) 10.0   0.0 90.0 2 !
 assign (resid 133 and name n )  (resid 133 and name ca) (resid 133 and name cb)  (resid 133 and name cg) 10.0 180.0 30.0 2
 assign (resid 134 and name n )  (resid 134 and name ca) (resid 134 and name cb)  (resid 134 and name cg) 10.0 -60.0 30.0 2
 assign (resid 135 and name n )  (resid 135 and name ca) (resid 135 and name cb)  (resid 135 and name cg) 10.0   0.0 90.0 2
 assign (resid 136 and name n )  (resid 136 and name ca) (resid 136 and name cb)  (resid 136 and name cg) 10.0   0.0 90.0 2
 assign (resid 137 and name n )  (resid 137 and name ca) (resid 137 and name cb)  (resid 137 and name og) 10.0   0.0 90.0 2
end 

  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had 1065 H/Q atoms
  Start of MODEL    1
    1   1H    ALA   1            1H      ALA   1 -21.657  14.307   3.165
    2   2H    ALA   1            3H      ALA   1 -21.855  15.729   4.071
    3   3H    ALA   1            2H      ALA   1 -23.065  15.244   2.980
    4    HA   ALA   1            HA      ALA   1 -21.673  15.658   1.110
    5   1HB   ALA   1           1HB      ALA   1 -22.886  17.579   2.157
    6   2HB   ALA   1           3HB      ALA   1 -21.428  17.950   3.077
    7   3HB   ALA   1           2HB      ALA   1 -21.415  18.067   1.318
    8    H    GLY   2             H      GLY   2 -19.557  17.289   0.755
    9   1HA   GLY   2           2HA      GLY   2 -17.208  17.611   1.134
   10   2HA   GLY   2           1HA      GLY   2 -17.290  16.463   2.477
   11    CH2  TRP   3           CH2      TRP   3 -12.914  11.601   3.623
   12    H    TRP   3             H      TRP   3 -17.902  14.153   1.736
   13    HA   TRP   3            HA      TRP   3 -15.968  13.030   0.076
   14   1HB   TRP   3           2HB      TRP   3 -18.514  12.173   1.118
   15   2HB   TRP   3           1HB      TRP   3 -17.811  11.205  -0.131
   16    HD1  TRP   3           HD1      TRP   3 -18.018   9.640   2.155
   17    HE1  TRP   3           HE1      TRP   3 -16.175   8.967   3.795
   18    HE3  TRP   3           HE3      TRP   3 -14.579  13.369   1.240
   19    HZ2  TRP   3           HZ2      TRP   3 -13.625   9.842   4.608
   20    HZ3  TRP   3           HZ3      TRP   3 -12.458  13.351   2.481
   21    HH2  TRP   3           HH2      TRP   3 -11.977  11.615   4.159
   22    H    ASN   4             H      ASN   4 -19.323  13.912  -0.662
   23    HA   ASN   4            HA      ASN   4 -19.411  13.012  -3.351
   24   1HB   ASN   4           2HB      ASN   4 -20.920  15.257  -1.994
   25   2HB   ASN   4           1HB      ASN   4 -21.295  14.667  -3.612
   26   1HD2  ASN   4          2HD2      ASN   4 -22.684  11.584  -2.465
   27   2HD2  ASN   4          1HD2      ASN   4 -21.958  12.348  -3.795
   28    H    ALA   5             H      ALA   5 -17.955  15.805  -1.990
   29    HA   ALA   5            HA      ALA   5 -17.705  17.422  -4.396
   30   1HB   ALA   5           1HB      ALA   5 -17.388  18.101  -1.863
   31   2HB   ALA   5           3HB      ALA   5 -15.732  17.554  -2.121
   32   3HB   ALA   5           2HB      ALA   5 -16.391  18.865  -3.100
   33    OH   TYR   6            OH      TYR   6 -12.822  17.978   0.549
   34    H    TYR   6             H      TYR   6 -15.742  14.976  -2.717
   35    HA   TYR   6            HA      TYR   6 -13.551  15.177  -4.661
   36   1HB   TYR   6           2HB      TYR   6 -14.072  12.948  -2.672
   37   2HB   TYR   6           1HB      TYR   6 -12.535  13.332  -3.468
   38    HD1  TYR   6           HD1      TYR   6 -11.550  15.675  -3.157
   39    HD2  TYR   6           HD2      TYR   6 -14.758  14.124  -0.842
   40    HE1  TYR   6           HE1      TYR   6 -11.311  17.573  -1.578
   41    HE2  TYR   6           HE2      TYR   6 -14.532  15.955   0.774
   42    HH   TYR   6            HH      TYR   6 -13.277  18.719   0.132
   43    H    ILE   7             H      ILE   7 -16.645  13.892  -4.659
   44    HA   ILE   7            HA      ILE   7 -16.128  11.981  -6.832
   45    HB   ILE   7            HB      ILE   7 -18.582  12.757  -5.316
   46   1HG1  ILE   7          2HG1      ILE   7 -16.820  11.238  -4.338
   47   2HG1  ILE   7          1HG1      ILE   7 -18.416  10.518  -4.442
   48   1HG2  ILE   7          3HG2      ILE   7 -19.137  12.394  -7.702
   49   2HG2  ILE   7          2HG2      ILE   7 -18.352  10.824  -7.609
   50   3HG2  ILE   7          1HG2      ILE   7 -19.802  11.129  -6.658
   51   1HD1  ILE   7          1HD1      ILE   7 -16.833  10.078  -6.848
   52   2HD1  ILE   7          3HD1      ILE   7 -16.039   9.428  -5.412
   53   3HD1  ILE   7          2HD1      ILE   7 -17.669   8.904  -5.839
   54    H    ASP   8             H      ASP   8 -17.123  15.236  -6.136
   55    HA   ASP   8            HA      ASP   8 -18.194  16.007  -8.621
   56   1HB   ASP   8           2HB      ASP   8 -17.320  17.349  -6.197
   57   2HB   ASP   8           1HB      ASP   8 -17.385  18.328  -7.606
   58    H    ASN   9             H      ASN   9 -15.074  15.248  -7.522
   59    HA   ASN   9            HA      ASN   9 -13.425  16.790  -9.140
   60   1HB   ASN   9           2HB      ASN   9 -12.075  15.667  -7.701
   61   2HB   ASN   9           1HB      ASN   9 -13.292  14.614  -7.271
   62   1HD2  ASN   9          2HD2      ASN   9 -11.474  11.735  -8.554
   63   2HD2  ASN   9          1HD2      ASN   9 -12.413  12.408  -7.314
   64    H    LEU  10             H      LEU  10 -14.219  13.511  -9.592
   65    HA   LEU  10            HA      LEU  10 -13.544  12.817 -12.111
   66   1HB   LEU  10           2HB      LEU  10 -16.189  12.135 -10.953
   67   2HB   LEU  10           1HB      LEU  10 -15.323  11.231 -12.181
   68    HG   LEU  10            HG      LEU  10 -14.877  10.017 -10.345
   69   1HD1  LEU  10          1HD1      LEU  10 -12.651  12.045 -10.515
   70   2HD1  LEU  10          3HD1      LEU  10 -12.591  10.733  -9.373
   71   3HD1  LEU  10          2HD1      LEU  10 -12.688  10.391 -11.068
   72   1HD2  LEU  10          1HD2      LEU  10 -15.461  12.475  -8.903
   73   2HD2  LEU  10          3HD2      LEU  10 -15.783  10.847  -8.407
   74   3HD2  LEU  10          2HD2      LEU  10 -14.200  11.573  -8.136
   75    H    MET  11             H      MET  11 -16.262  14.560 -11.041
   76    HA   MET  11            HA      MET  11 -17.459  14.568 -13.707
   77   1HB   MET  11           2HB      MET  11 -18.242  16.118 -11.211
   78   2HB   MET  11           1HB      MET  11 -19.295  15.600 -12.531
   79   1HG   MET  11           2HG      MET  11 -17.805  13.280 -11.117
   80   2HG   MET  11           1HG      MET  11 -19.045  14.136 -10.158
   81   1HE   MET  11           3HE      MET  11 -17.961  12.666 -13.205
   82   2HE   MET  11           2HE      MET  11 -18.924  11.196 -13.108
   83   3HE   MET  11           1HE      MET  11 -19.357  12.446 -14.267
   84    H    ALA  12             H      ALA  12 -15.893  16.903 -11.640
   85    HA   ALA  12            HA      ALA  12 -15.839  19.179 -13.458
   86   1HB   ALA  12           1HB      ALA  12 -14.688  18.652 -10.692
   87   2HB   ALA  12           3HB      ALA  12 -14.527  20.193 -11.553
   88   3HB   ALA  12           2HB      ALA  12 -16.129  19.612 -11.098
   89    H    ASP  13             H      ASP  13 -14.002  16.453 -13.288
   90    HA   ASP  13            HA      ASP  13 -11.243  17.453 -13.291
   91   1HB   ASP  13           2HB      ASP  13 -10.787  15.025 -13.579
   92   2HB   ASP  13           1HB      ASP  13 -11.960  15.342 -12.305
   93    H    GLY  14             H      GLY  14 -13.414  17.018 -15.898
   94   1HA   GLY  14           2HA      GLY  14 -13.026  16.393 -18.194
   95   2HA   GLY  14           1HA      GLY  14 -11.843  17.668 -18.081
   96    H    THR  15             H      THR  15 -11.484  14.545 -16.414
   97    HA   THR  15            HA      THR  15  -9.700  13.350 -18.359
   98    HB   THR  15            HB      THR  15  -8.710  14.325 -15.687
   99    HG1  THR  15           HG1      THR  15  -8.319  15.917 -17.054
  100   1HG2  THR  15          2HG2      THR  15  -7.540  12.407 -17.722
  101   2HG2  THR  15          1HG2      THR  15  -6.591  13.186 -16.438
  102   3HG2  THR  15          3HG2      THR  15  -7.924  12.113 -16.010
  103    H    CYS  16             H      CYS  16 -10.857  13.352 -14.965
  104    HA   CYS  16            HA      CYS  16 -10.877  10.489 -15.141
  105   1HB   CYS  16           2HB      CYS  16 -11.866  10.723 -12.647
  106   2HB   CYS  16           1HB      CYS  16 -10.186  10.514 -13.046
  107    HG   CYS  16            HG      CYS  16  -9.772  12.912 -12.483
  108    H    GLN  17             H      GLN  17 -12.571   9.122 -14.518
  109    HA   GLN  17            HA      GLN  17 -15.076   9.886 -15.811
  110   1HB   GLN  17           2HB      GLN  17 -13.134   8.346 -16.724
  111   2HB   GLN  17           1HB      GLN  17 -13.929   7.138 -15.770
  112   1HG   GLN  17           2HG      GLN  17 -15.521   8.792 -17.655
  113   2HG   GLN  17           1HG      GLN  17 -14.460   7.512 -18.312
  114   1HE2  GLN  17          2HE2      GLN  17 -16.302   4.947 -16.359
  115   2HE2  GLN  17          1HE2      GLN  17 -14.690   5.437 -16.558
  116    H    ASP  18             H      ASP  18 -13.514   7.504 -13.648
  117    HA   ASP  18            HA      ASP  18 -15.969   7.436 -12.003
  118   1HB   ASP  18           2HB      ASP  18 -15.234   5.288 -13.307
  119   2HB   ASP  18           1HB      ASP  18 -14.179   5.088 -11.939
  120    H    ALA  19             H      ALA  19 -15.303   6.473  -9.726
  121    HA   ALA  19            HA      ALA  19 -12.725   7.525  -8.647
  122   1HB   ALA  19           2HB      ALA  19 -15.225   9.061  -8.839
  123   2HB   ALA  19           1HB      ALA  19 -14.515   8.995  -7.209
  124   3HB   ALA  19           3HB      ALA  19 -13.567   9.537  -8.555
  125    H    ALA  20             H      ALA  20 -12.419   6.391  -6.661
  126    HA   ALA  20            HA      ALA  20 -14.965   5.776  -5.210
  127   1HB   ALA  20           2HB      ALA  20 -13.236   3.653  -6.277
  128   2HB   ALA  20           1HB      ALA  20 -13.995   3.404  -4.706
  129   3HB   ALA  20           3HB      ALA  20 -14.981   3.748  -6.120
  130    H    ILE  21             H      ILE  21 -14.733   6.743  -3.452
  131    HA   ILE  21            HA      ILE  21 -12.209   6.511  -1.887
  132    HB   ILE  21            HB      ILE  21 -14.856   7.875  -1.225
  133   1HG1  ILE  21          2HG1      ILE  21 -12.214   8.870  -2.342
  134   2HG1  ILE  21          1HG1      ILE  21 -13.802   8.980  -3.097
  135   1HG2  ILE  21          3HG2      ILE  21 -12.134   7.935   0.161
  136   2HG2  ILE  21          2HG2      ILE  21 -13.501   8.968   0.595
  137   3HG2  ILE  21          1HG2      ILE  21 -13.610   7.215   0.807
  138   1HD1  ILE  21          1HD1      ILE  21 -14.167  10.243  -0.659
  139   2HD1  ILE  21          3HD1      ILE  21 -12.542  10.733  -1.141
  140   3HD1  ILE  21          2HD1      ILE  21 -13.908  11.048  -2.208
  141    H    VAL  22             H      VAL  22 -12.112   4.603  -0.677
  142    HA   VAL  22            HA      VAL  22 -14.701   3.252  -0.061
  143    HB   VAL  22            HB      VAL  22 -12.030   2.015  -0.910
  144   1HG1  VAL  22          2HG1      VAL  22 -13.788   0.716   0.632
  145   2HG1  VAL  22          1HG1      VAL  22 -14.591   0.464  -0.915
  146   3HG1  VAL  22          3HG1      VAL  22 -12.932  -0.105  -0.676
  147   1HG2  VAL  22          3HG2      VAL  22 -13.391   3.298  -2.667
  148   2HG2  VAL  22          2HG2      VAL  22 -12.996   1.616  -3.048
  149   3HG2  VAL  22          1HG2      VAL  22 -14.616   2.039  -2.479
  150    H    GLY  23             H      GLY  23 -14.928   2.977   2.150
  151   1HA   GLY  23           2HA      GLY  23 -12.756   3.151   4.070
  152   2HA   GLY  23           1HA      GLY  23 -14.408   2.633   4.431
  153    OH   TYR  24            OH      TYR  24  -5.413   1.117   5.272
  154    H    TYR  24             H      TYR  24 -11.354   1.562   3.171
  155    HA   TYR  24            HA      TYR  24 -11.991  -1.205   2.775
  156   1HB   TYR  24           2HB      TYR  24  -9.829  -1.320   1.776
  157   2HB   TYR  24           1HB      TYR  24 -10.277   0.337   1.567
  158    HD1  TYR  24           HD1      TYR  24  -9.746   1.715   4.033
  159    HD2  TYR  24           HD2      TYR  24  -7.595  -1.577   2.335
  160    HE1  TYR  24           HE1      TYR  24  -7.755   2.369   5.328
  161    HE2  TYR  24           HE2      TYR  24  -5.591  -0.930   3.603
  162    HH   TYR  24            HH      TYR  24  -5.244   0.423   5.918
  163    H    LYS  25             H      LYS  25 -12.323  -0.246   5.600
  164    HA   LYS  25            HA      LYS  25 -10.238  -1.160   7.266
  165   1HB   LYS  25           2HB      LYS  25 -13.123  -0.679   7.737
  166   2HB   LYS  25           1HB      LYS  25 -12.067  -1.200   9.014
  167   1HG   LYS  25           2HG      LYS  25 -12.068   1.142   9.219
  168   2HG   LYS  25           1HG      LYS  25 -10.582   0.799   8.340
  169   1HD   LYS  25           2HD      LYS  25 -11.442   1.509   6.332
  170   2HD   LYS  25           1HD      LYS  25 -13.114   1.277   6.842
  171   1HE   LYS  25           2HE      LYS  25 -11.239   3.379   7.960
  172   2HE   LYS  25           1HE      LYS  25 -12.497   3.687   6.760
  173   1HZ   LYS  25           2HZ      LYS  25 -14.054   2.619   8.480
  174   2HZ   LYS  25           1HZ      LYS  25 -12.809   2.913   9.597
  175   3HZ   LYS  25           3HZ      LYS  25 -13.519   4.201   8.767
  176    H    ASP  26             H      ASP  26 -11.762  -2.964   8.965
  177    HA   ASP  26            HA      ASP  26 -11.145  -5.538   8.033
  178   1HB   ASP  26           2HB      ASP  26 -13.262  -6.247   9.416
  179   2HB   ASP  26           1HB      ASP  26 -11.837  -5.669  10.244
  180    H    SER  27             H      SER  27 -14.333  -4.026   7.903
  181    HA   SER  27            HA      SER  27 -15.106  -5.698   5.610
  182   1HB   SER  27           2HB      SER  27 -17.358  -4.606   6.176
  183   2HB   SER  27           1HB      SER  27 -16.786  -5.825   7.280
  184    HG   SER  27            HG      SER  27 -17.470  -3.983   8.409
  185    HA   PRO  28            HA      PRO  28 -14.117  -1.992   3.387
  186   1HB   PRO  28           2HB      PRO  28 -14.735  -2.905   0.884
  187   2HB   PRO  28           1HB      PRO  28 -13.219  -3.278   1.730
  188   1HG   PRO  28           2HG      PRO  28 -15.574  -5.022   1.286
  189   2HG   PRO  28           1HG      PRO  28 -13.909  -5.449   1.566
  190   1HD   PRO  28           2HD      PRO  28 -15.977  -5.573   3.431
  191   2HD   PRO  28           1HD      PRO  28 -14.240  -5.728   3.765
  192    H    SER  29             H      SER  29 -15.234  -0.344   2.178
  193    HA   SER  29            HA      SER  29 -18.035  -0.668   1.613
  194   1HB   SER  29           2HB      SER  29 -18.764   1.122   3.137
  195   2HB   SER  29           1HB      SER  29 -18.083  -0.230   4.034
  196    HG   SER  29            HG      SER  29 -17.293   1.874   4.654
  197    H    VAL  30             H      VAL  30 -18.876   1.202   0.520
  198    HA   VAL  30            HA      VAL  30 -16.749   2.655  -0.865
  199    HB   VAL  30            HB      VAL  30 -19.652   2.090  -1.490
  200   1HG1  VAL  30          2HG1      VAL  30 -18.974   4.378  -2.237
  201   2HG1  VAL  30          1HG1      VAL  30 -17.641   3.650  -3.134
  202   3HG1  VAL  30          3HG1      VAL  30 -19.304   3.287  -3.586
  203   1HG2  VAL  30          3HG2      VAL  30 -17.022   0.924  -2.157
  204   2HG2  VAL  30          2HG2      VAL  30 -18.635   0.203  -2.274
  205   3HG2  VAL  30          1HG2      VAL  30 -18.032   1.235  -3.555
  206    CH2  TRP  31           CH2      TRP  31 -13.722   5.915   6.942
  207    H    TRP  31             H      TRP  31 -16.260   4.309   0.515
  208    HA   TRP  31            HA      TRP  31 -18.178   5.786   2.039
  209   1HB   TRP  31           2HB      TRP  31 -15.251   6.085   1.392
  210   2HB   TRP  31           1HB      TRP  31 -16.100   7.437   2.145
  211    HD1  TRP  31           HD1      TRP  31 -17.605   4.209   3.167
  212    HE1  TRP  31           HE1      TRP  31 -16.919   3.586   5.520
  213    HE3  TRP  31           HE3      TRP  31 -13.741   7.507   3.932
  214    HZ2  TRP  31           HZ2      TRP  31 -15.044   4.320   7.505
  215    HZ3  TRP  31           HZ3      TRP  31 -12.558   7.511   6.115
  216    HH2  TRP  31           HH2      TRP  31 -13.194   5.917   7.881
  217    H    ALA  32             H      ALA  32 -17.101   5.970  -1.241
  218    HA   ALA  32            HA      ALA  32 -19.160   7.679  -2.092
  219   1HB   ALA  32           1HB      ALA  32 -16.657   9.175  -1.304
  220   2HB   ALA  32           3HB      ALA  32 -17.729   9.803  -2.577
  221   3HB   ALA  32           2HB      ALA  32 -18.341   9.558  -0.931
  222    H    ALA  33             H      ALA  33 -18.965   6.031  -3.719
  223    HA   ALA  33            HA      ALA  33 -16.831   6.631  -5.684
  224   1HB   ALA  33           1HB      ALA  33 -16.560   4.351  -4.764
  225   2HB   ALA  33           3HB      ALA  33 -18.201   3.968  -5.281
  226   3HB   ALA  33           2HB      ALA  33 -16.963   4.322  -6.481
  227    H    VAL  34             H      VAL  34 -17.554   7.290  -7.632
  228    HA   VAL  34            HA      VAL  34 -20.230   7.995  -8.200
  229    HB   VAL  34            HB      VAL  34 -18.125   7.177 -10.215
  230   1HG1  VAL  34          1HG1      VAL  34 -20.664   8.795 -10.437
  231   2HG1  VAL  34          3HG1      VAL  34 -19.402   8.806 -11.675
  232   3HG1  VAL  34          2HG1      VAL  34 -20.268   7.303 -11.302
  233   1HG2  VAL  34          2HG2      VAL  34 -17.703   9.071  -8.423
  234   2HG2  VAL  34          1HG2      VAL  34 -17.257   9.333 -10.108
  235   3HG2  VAL  34          3HG2      VAL  34 -18.760  10.004  -9.476
  236    HA   PRO  35            HA      PRO  35 -21.660   3.682  -8.491
  237   1HB   PRO  35           2HB      PRO  35 -24.347   4.235  -8.284
  238   2HB   PRO  35           1HB      PRO  35 -23.254   4.088  -6.898
  239   1HG   PRO  35           2HG      PRO  35 -24.405   6.564  -8.121
  240   2HG   PRO  35           1HG      PRO  35 -23.885   6.276  -6.450
  241   1HD   PRO  35           2HD      PRO  35 -22.416   7.689  -8.403
  242   2HD   PRO  35           1HD      PRO  35 -21.770   7.062  -6.873
  243    H    GLY  36             H      GLY  36 -22.725   2.379 -10.041
  244   1HA   GLY  36           2HA      GLY  36 -24.054   2.024 -12.035
  245   2HA   GLY  36           1HA      GLY  36 -23.838   3.723 -12.446
  246    H    LYS  37             H      LYS  37 -20.808   3.124 -11.589
  247    HA   LYS  37            HA      LYS  37 -20.007   2.400 -14.347
  248   1HB   LYS  37           2HB      LYS  37 -18.266   3.447 -12.104
  249   2HB   LYS  37           1HB      LYS  37 -17.865   3.386 -13.819
  250   1HG   LYS  37           2HG      LYS  37 -20.099   5.035 -12.574
  251   2HG   LYS  37           1HG      LYS  37 -18.573   5.667 -13.180
  252   1HD   LYS  37           2HD      LYS  37 -19.351   4.367 -15.385
  253   2HD   LYS  37           1HD      LYS  37 -20.940   4.686 -14.688
  254   1HE   LYS  37           2HE      LYS  37 -20.204   7.111 -14.417
  255   2HE   LYS  37           1HE      LYS  37 -18.802   6.708 -15.405
  256   1HZ   LYS  37           3HZ      LYS  37 -21.116   5.738 -16.692
  257   2HZ   LYS  37           2HZ      LYS  37 -21.386   7.360 -16.261
  258   3HZ   LYS  37           1HZ      LYS  37 -20.044   6.946 -17.214
  259    H    THR  38             H      THR  38 -18.320   1.685 -11.225
  260    HA   THR  38            HA      THR  38 -18.560  -1.154 -11.365
  261    HB   THR  38            HB      THR  38 -16.469   0.069 -13.040
  262    HG1  THR  38           HG1      THR  38 -17.578  -2.502 -13.180
  263   1HG2  THR  38          2HG2      THR  38 -15.857  -2.264 -11.238
  264   2HG2  THR  38          1HG2      THR  38 -15.130  -2.189 -12.842
  265   3HG2  THR  38          3HG2      THR  38 -14.810  -0.899 -11.670
  266    H    PHE  39             H      PHE  39 -16.353   1.474 -10.483
  267    HA   PHE  39            HA      PHE  39 -14.786   0.187  -8.530
  268   1HB   PHE  39           2HB      PHE  39 -15.683   3.020  -8.869
  269   2HB   PHE  39           1HB      PHE  39 -14.696   2.521  -7.518
  270    HD1  PHE  39           HD2      PHE  39 -14.448   1.066 -10.927
  271    HD2  PHE  39           HD1      PHE  39 -12.649   3.686  -8.052
  272    HE1  PHE  39           HE2      PHE  39 -12.417   1.172 -12.297
  273    HE2  PHE  39           HE1      PHE  39 -10.600   3.781  -9.418
  274    HZ   PHE  39            HZ      PHE  39 -10.502   2.499 -11.540
  275    H    VAL  40             H      VAL  40 -17.818   1.913  -8.074
  276    HA   VAL  40            HA      VAL  40 -18.005   1.886  -5.293
  277    HB   VAL  40            HB      VAL  40 -19.588   3.222  -6.468
  278   1HG1  VAL  40          1HG1      VAL  40 -20.016   0.700  -7.979
  279   2HG1  VAL  40          3HG1      VAL  40 -21.346   1.851  -7.879
  280   3HG1  VAL  40          2HG1      VAL  40 -19.793   2.349  -8.566
  281   1HG2  VAL  40          3HG2      VAL  40 -20.417   1.480  -4.496
  282   2HG2  VAL  40          2HG2      VAL  40 -21.414   2.784  -5.151
  283   3HG2  VAL  40          1HG2      VAL  40 -21.583   1.143  -5.779
  284    H    ASN  41             H      ASN  41 -18.405  -0.723  -7.551
  285    HA   ASN  41            HA      ASN  41 -19.804  -2.488  -5.713
  286   1HB   ASN  41           2HB      ASN  41 -18.576  -2.734  -8.436
  287   2HB   ASN  41           1HB      ASN  41 -19.049  -4.152  -7.531
  288   1HD2  ASN  41          2HD2      ASN  41 -21.882  -2.237  -9.516
  289   2HD2  ASN  41          1HD2      ASN  41 -20.221  -2.133  -9.849
  290    H    ILE  42             H      ILE  42 -16.974  -1.232  -5.098
  291    HA   ILE  42            HA      ILE  42 -15.167  -3.404  -5.148
  292    HB   ILE  42            HB      ILE  42 -15.178  -0.616  -4.115
  293   1HG1  ILE  42          2HG1      ILE  42 -12.959  -2.178  -5.439
  294   2HG1  ILE  42          1HG1      ILE  42 -14.323  -1.556  -6.364
  295   1HG2  ILE  42          1HG2      ILE  42 -13.517  -2.792  -2.862
  296   2HG2  ILE  42          3HG2      ILE  42 -12.801  -1.198  -3.107
  297   3HG2  ILE  42          2HG2      ILE  42 -14.246  -1.374  -2.117
  298   1HD1  ILE  42          3HD1      ILE  42 -13.450   0.582  -4.738
  299   2HD1  ILE  42          2HD1      ILE  42 -11.997  -0.163  -5.406
  300   3HD1  ILE  42          1HD1      ILE  42 -13.263   0.419  -6.488
  301    H    THR  43             H      THR  43 -15.182  -5.094  -3.981
  302    HA   THR  43            HA      THR  43 -16.425  -5.302  -1.275
  303    HB   THR  43            HB      THR  43 -16.145  -7.821  -2.017
  304    HG1  THR  43           HG1      THR  43 -14.771  -7.283  -3.774
  305   1HG2  THR  43          3HG2      THR  43 -18.090  -5.797  -2.906
  306   2HG2  THR  43          2HG2      THR  43 -18.141  -7.353  -3.740
  307   3HG2  THR  43          1HG2      THR  43 -18.359  -7.286  -1.992
  308    HA   PRO  44            HA      PRO  44 -12.332  -6.230   0.354
  309   1HB   PRO  44           2HB      PRO  44 -12.437  -8.596   1.602
  310   2HB   PRO  44           1HB      PRO  44 -13.062  -7.109   2.282
  311   1HG   PRO  44           2HG      PRO  44 -14.556  -9.419   1.130
  312   2HG   PRO  44           1HG      PRO  44 -15.084  -8.230   2.333
  313   1HD   PRO  44           2HD      PRO  44 -15.793  -8.229  -0.370
  314   2HD   PRO  44           1HD      PRO  44 -15.993  -6.863   0.721
  315    H    ALA  45             H      ALA  45 -13.441  -8.037  -2.105
  316    HA   ALA  45            HA      ALA  45 -11.219  -9.869  -2.443
  317   1HB   ALA  45           1HB      ALA  45 -13.843  -9.551  -3.529
  318   2HB   ALA  45           3HB      ALA  45 -12.684  -9.506  -4.858
  319   3HB   ALA  45           2HB      ALA  45 -12.730 -10.900  -3.778
  320    H    GLU  46             H      GLU  46 -12.597  -7.324  -4.367
  321    HA   GLU  46            HA      GLU  46 -10.249  -6.779  -5.933
  322   1HB   GLU  46           2HB      GLU  46 -11.488  -4.419  -6.202
  323   2HB   GLU  46           1HB      GLU  46 -12.047  -5.840  -7.054
  324   1HG   GLU  46           2HG      GLU  46 -13.130  -5.439  -4.334
  325   2HG   GLU  46           1HG      GLU  46 -13.593  -4.249  -5.535
  326    H    VAL  47             H      VAL  47 -11.405  -5.604  -2.863
  327    HA   VAL  47            HA      VAL  47  -9.294  -3.665  -2.591
  328    HB   VAL  47            HB      VAL  47 -11.727  -4.241  -1.138
  329   1HG1  VAL  47          3HG1      VAL  47 -10.015  -4.732   0.609
  330   2HG1  VAL  47          2HG1      VAL  47  -9.425  -3.097   0.331
  331   3HG1  VAL  47          1HG1      VAL  47 -11.048  -3.347   0.947
  332   1HG2  VAL  47          3HG2      VAL  47 -11.002  -2.201  -2.526
  333   2HG2  VAL  47          2HG2      VAL  47 -11.796  -1.882  -0.983
  334   3HG2  VAL  47          1HG2      VAL  47 -10.009  -1.779  -1.099
  335    H    GLY  48             H      GLY  48  -9.757  -6.993  -1.887
  336   1HA   GLY  48           2HA      GLY  48  -7.760  -7.338   0.131
  337   2HA   GLY  48           1HA      GLY  48  -8.274  -8.576  -1.014
  338    H    VAL  49             H      VAL  49  -7.606  -6.871  -3.315
  339    HA   VAL  49            HA      VAL  49  -4.696  -7.380  -3.351
  340    HB   VAL  49            HB      VAL  49  -6.136  -8.364  -5.148
  341   1HG1  VAL  49          2HG1      VAL  49  -6.434  -5.437  -5.885
  342   2HG1  VAL  49          1HG1      VAL  49  -6.718  -6.745  -7.023
  343   3HG1  VAL  49          3HG1      VAL  49  -7.717  -6.606  -5.579
  344   1HG2  VAL  49          3HG2      VAL  49  -3.702  -8.027  -5.394
  345   2HG2  VAL  49          2HG2      VAL  49  -4.538  -7.827  -6.933
  346   3HG2  VAL  49          1HG2      VAL  49  -3.997  -6.413  -6.034
  347    H    LEU  50             H      LEU  50  -6.952  -4.777  -3.725
  348    HA   LEU  50            HA      LEU  50  -5.150  -2.722  -4.567
  349   1HB   LEU  50           2HB      LEU  50  -7.817  -2.946  -3.480
  350   2HB   LEU  50           1HB      LEU  50  -7.081  -1.424  -3.267
  351    HG   LEU  50            HG      LEU  50  -7.314  -2.779  -5.924
  352   1HD1  LEU  50          2HD1      LEU  50  -9.237  -0.905  -4.447
  353   2HD1  LEU  50          1HD1      LEU  50  -9.326  -1.247  -6.183
  354   3HD1  LEU  50          3HD1      LEU  50  -9.577  -2.551  -5.028
  355   1HD2  LEU  50          3HD2      LEU  50  -5.727  -0.807  -5.482
  356   2HD2  LEU  50          2HD2      LEU  50  -6.901  -0.577  -6.778
  357   3HD2  LEU  50          1HD2      LEU  50  -7.176   0.159  -5.195
  358    H    VAL  51             H      VAL  51  -5.735  -4.265  -1.578
  359    HA   VAL  51            HA      VAL  51  -3.950  -2.365  -0.151
  360    HB   VAL  51            HB      VAL  51  -5.571  -1.977   1.579
  361   1HG1  VAL  51          2HG1      VAL  51  -6.200  -0.852  -0.496
  362   2HG1  VAL  51          1HG1      VAL  51  -7.191  -2.244  -0.935
  363   3HG1  VAL  51          3HG1      VAL  51  -7.617  -1.261   0.462
  364   1HG2  VAL  51          1HG2      VAL  51  -6.530  -4.650   0.858
  365   2HG2  VAL  51          3HG2      VAL  51  -6.648  -3.805   2.401
  366   3HG2  VAL  51          2HG2      VAL  51  -7.839  -3.514   1.143
  367    H    GLY  52             H      GLY  52  -4.664  -5.615  -0.857
  368   1HA   GLY  52           2HA      GLY  52  -4.195  -7.127   1.390
  369   2HA   GLY  52           1HA      GLY  52  -3.624  -7.586  -0.211
  370    H    LYS  53             H      LYS  53  -2.448  -7.772   2.473
  371    HA   LYS  53            HA      LYS  53  -0.251  -6.031   2.698
  372   1HB   LYS  53           2HB      LYS  53   0.486  -7.412   4.495
  373   2HB   LYS  53           1HB      LYS  53  -1.268  -7.437   4.541
  374   1HG   LYS  53           2HG      LYS  53  -1.034  -9.697   4.609
  375   2HG   LYS  53           1HG      LYS  53  -0.732  -9.557   2.874
  376   1HD   LYS  53           2HD      LYS  53   1.533  -9.866   3.100
  377   2HD   LYS  53           1HD      LYS  53   1.587  -9.080   4.678
  378   1HE   LYS  53           2HE      LYS  53   1.920 -11.281   5.307
  379   2HE   LYS  53           1HE      LYS  53   0.160 -11.188   5.407
  380   1HZ   LYS  53           2HZ      LYS  53   1.462 -11.943   2.876
  381   2HZ   LYS  53           1HZ      LYS  53   1.239 -13.103   4.099
  382   3HZ   LYS  53           3HZ      LYS  53  -0.103 -12.310   3.432
  383    H    ASP  54             H      ASP  54  -0.757  -8.523   0.495
  384    HA   ASP  54            HA      ASP  54   1.566  -9.852   0.065
  385   1HB   ASP  54           2HB      ASP  54  -0.676  -9.863  -1.240
  386   2HB   ASP  54           1HB      ASP  54   0.159  -8.726  -2.293
  387    NH1  ARG  55           NH2      ARG  55   7.070  -8.523   4.833
  388    NH2  ARG  55           NH1      ARG  55   5.033  -8.217   5.762
  389    H    ARG  55             H      ARG  55   3.493  -9.320  -0.691
  390    HA   ARG  55            HA      ARG  55   4.078  -6.539  -1.237
  391   1HB   ARG  55           2HB      ARG  55   5.962  -8.650  -0.199
  392   2HB   ARG  55           1HB      ARG  55   6.287  -6.920  -0.306
  393   1HG   ARG  55           2HG      ARG  55   4.721  -6.410   1.404
  394   2HG   ARG  55           1HG      ARG  55   3.968  -8.001   1.303
  395   1HD   ARG  55           2HD      ARG  55   5.841  -9.070   2.322
  396   2HD   ARG  55           1HD      ARG  55   6.865  -7.650   2.102
  397    HE   ARG  55            HE      ARG  55   4.861  -6.690   3.719
  398   1HH1  ARG  55          1HH2      ARG  55   7.697  -8.413   4.063
  399   2HH1  ARG  55          2HH2      ARG  55   7.379  -8.981   5.667
  400   1HH2  ARG  55          2HH1      ARG  55   4.096  -7.872   5.702
  401   2HH2  ARG  55          1HH1      ARG  55   5.347  -8.671   6.597
  402    H    SER  56             H      SER  56   3.375  -8.620  -3.435
  403    HA   SER  56            HA      SER  56   5.485  -7.779  -5.251
  404   1HB   SER  56           2HB      SER  56   6.767  -9.463  -4.042
  405   2HB   SER  56           1HB      SER  56   5.547 -10.668  -4.430
  406    HG   SER  56            HG      SER  56   7.635 -10.054  -5.846
  407    H    SER  57             H      SER  57   3.072 -10.209  -4.747
  408    HA   SER  57            HA      SER  57   2.582 -11.107  -7.290
  409   1HB   SER  57           2HB      SER  57   0.191 -11.418  -6.556
  410   2HB   SER  57           1HB      SER  57   1.418 -12.116  -5.508
  411    HG   SER  57            HG      SER  57  -0.430 -10.516  -4.761
  412    H    PHE  58             H      PHE  58  -0.187  -9.230  -6.497
  413    HA   PHE  58            HA      PHE  58  -0.873  -8.375  -8.945
  414   1HB   PHE  58           2HB      PHE  58  -2.184  -6.568  -8.014
  415   2HB   PHE  58           1HB      PHE  58  -2.306  -8.032  -7.069
  416    HD1  PHE  58           HD1      PHE  58  -0.914  -4.642  -7.202
  417    HD2  PHE  58           HD2      PHE  58  -1.428  -8.181  -4.834
  418    HE1  PHE  58           HE1      PHE  58  -0.261  -3.380  -5.179
  419    HE2  PHE  58           HE2      PHE  58  -0.759  -6.924  -2.810
  420    HZ   PHE  58            HZ      PHE  58  -0.193  -4.525  -2.984
  421    OH   TYR  59            OH      TYR  59   3.100  -4.187  -2.548
  422    H    TYR  59             H      TYR  59   1.952  -6.884  -7.430
  423    HA   TYR  59            HA      TYR  59   1.796  -4.465  -8.873
  424   1HB   TYR  59           2HB      TYR  59   4.419  -5.757  -8.292
  425   2HB   TYR  59           1HB      TYR  59   4.078  -4.048  -8.511
  426    HD1  TYR  59           HD1      TYR  59   1.802  -3.557  -6.869
  427    HD2  TYR  59           HD2      TYR  59   5.208  -6.032  -6.128
  428    HE1  TYR  59           HE1      TYR  59   1.552  -3.171  -4.425
  429    HE2  TYR  59           HE2      TYR  59   4.956  -5.657  -3.701
  430    HH   TYR  59            HH      TYR  59   2.865  -5.023  -2.141
  431    H    VAL  60             H      VAL  60   2.093  -7.445 -10.201
  432    HA   VAL  60            HA      VAL  60   3.264  -6.343 -12.655
  433    HB   VAL  60            HB      VAL  60   3.747  -8.863 -13.039
  434   1HG1  VAL  60          2HG1      VAL  60   5.173  -6.851 -11.379
  435   2HG1  VAL  60          1HG1      VAL  60   5.850  -8.476 -11.472
  436   3HG1  VAL  60          3HG1      VAL  60   5.629  -7.534 -12.944
  437   1HG2  VAL  60          2HG2      VAL  60   2.498  -9.607 -10.998
  438   2HG2  VAL  60          1HG2      VAL  60   4.175 -10.155 -11.031
  439   3HG2  VAL  60          3HG2      VAL  60   3.716  -8.780 -10.023
  440    H    ASN  61             H      ASN  61   0.684  -8.400 -11.314
  441    HA   ASN  61            HA      ASN  61  -0.327  -8.941 -13.972
  442   1HB   ASN  61           2HB      ASN  61  -2.038 -10.254 -12.814
  443   2HB   ASN  61           1HB      ASN  61  -0.439 -10.751 -12.373
  444   1HD2  ASN  61          2HD2      ASN  61  -1.096 -10.337  -8.990
  445   2HD2  ASN  61          1HD2      ASN  61  -0.225 -11.127 -10.212
  446    H    GLY  62             H      GLY  62  -1.284  -7.058 -11.120
  447   1HA   GLY  62           2HA      GLY  62  -2.243  -4.839 -11.790
  448   2HA   GLY  62           1HA      GLY  62  -3.354  -5.782 -12.766
  449    H    LEU  63             H      LEU  63  -3.972  -3.933 -10.593
  450    HA   LEU  63            HA      LEU  63  -4.880  -5.581  -8.299
  451   1HB   LEU  63           2HB      LEU  63  -5.619  -2.683  -8.916
  452   2HB   LEU  63           1HB      LEU  63  -5.949  -3.505  -7.386
  453    HG   LEU  63            HG      LEU  63  -3.165  -3.111  -8.500
  454   1HD1  LEU  63          1HD1      LEU  63  -4.995  -1.149  -7.454
  455   2HD1  LEU  63          3HD1      LEU  63  -3.769  -1.456  -6.217
  456   3HD1  LEU  63          2HD1      LEU  63  -3.286  -0.945  -7.833
  457   1HD2  LEU  63          1HD2      LEU  63  -4.435  -3.996  -5.909
  458   2HD2  LEU  63          3HD2      LEU  63  -3.250  -4.844  -6.901
  459   3HD2  LEU  63          2HD2      LEU  63  -2.761  -3.428  -5.978
  460    H    THR  64             H      THR  64  -7.462  -4.411  -7.922
  461    HA   THR  64            HA      THR  64  -9.053  -4.934 -10.256
  462    HB   THR  64            HB      THR  64 -10.357  -6.720  -9.007
  463    HG1  THR  64           HG1      THR  64  -9.152  -7.811  -7.423
  464   1HG2  THR  64          3HG2      THR  64  -8.707  -7.055 -10.901
  465   2HG2  THR  64          2HG2      THR  64  -7.513  -7.491  -9.669
  466   3HG2  THR  64          1HG2      THR  64  -8.981  -8.459  -9.872
  467    H    LEU  65             H      LEU  65 -10.679  -3.626 -10.065
  468    HA   LEU  65            HA      LEU  65 -11.668  -2.846  -7.414
  469   1HB   LEU  65           2HB      LEU  65 -11.938  -0.494  -8.572
  470   2HB   LEU  65           1HB      LEU  65 -10.512  -0.931  -7.690
  471    HG   LEU  65            HG      LEU  65  -9.491  -1.686  -9.890
  472   1HD1  LEU  65          3HD1      LEU  65 -12.087  -0.626 -10.815
  473   2HD1  LEU  65          2HD1      LEU  65 -10.683  -0.194 -11.777
  474   3HD1  LEU  65          1HD1      LEU  65 -11.078  -1.883 -11.497
  475   1HD2  LEU  65          2HD2      LEU  65 -10.065   1.082  -8.983
  476   2HD2  LEU  65          1HD2      LEU  65  -8.518   0.287  -9.290
  477   3HD2  LEU  65          3HD2      LEU  65  -9.457   0.928 -10.638
  478    H    GLY  66             H      GLY  66 -13.529  -3.865  -7.518
  479   1HA   GLY  66           2HA      GLY  66 -15.806  -4.116  -8.005
  480   2HA   GLY  66           1HA      GLY  66 -15.629  -2.853  -9.221
  481    H    GLY  67             H      GLY  67 -13.527  -5.657  -9.093
  482   1HA   GLY  67           2HA      GLY  67 -13.429  -7.570 -10.465
  483   2HA   GLY  67           1HA      GLY  67 -14.975  -7.112 -11.176
  484    H    GLN  68             H      GLN  68 -12.754  -4.447 -11.130
  485    HA   GLN  68            HA      GLN  68 -12.191  -4.950 -14.036
  486   1HB   GLN  68           2HB      GLN  68 -13.372  -2.952 -13.958
  487   2HB   GLN  68           1HB      GLN  68 -12.576  -2.491 -12.511
  488   1HG   GLN  68           2HG      GLN  68 -11.862  -1.188 -14.618
  489   2HG   GLN  68           1HG      GLN  68 -10.558  -1.829 -13.627
  490   1HE2  GLN  68          2HE2      GLN  68  -9.287  -3.249 -16.641
  491   2HE2  GLN  68          1HE2      GLN  68  -9.035  -2.111 -15.404
  492    H    LYS  69             H      LYS  69 -10.305  -5.952 -14.149
  493    HA   LYS  69            HA      LYS  69  -8.131  -5.665 -12.332
  494   1HB   LYS  69           2HB      LYS  69  -8.817  -7.356 -14.432
  495   2HB   LYS  69           1HB      LYS  69  -7.381  -6.530 -15.028
  496   1HG   LYS  69           2HG      LYS  69  -6.013  -7.470 -13.450
  497   2HG   LYS  69           1HG      LYS  69  -7.275  -7.484 -12.219
  498   1HD   LYS  69           2HD      LYS  69  -8.143  -9.487 -12.919
  499   2HD   LYS  69           1HD      LYS  69  -7.650  -9.240 -14.590
  500   1HE   LYS  69           2HE      LYS  69  -6.107 -10.857 -13.951
  501   2HE   LYS  69           1HE      LYS  69  -5.203  -9.397 -13.541
  502   1HZ   LYS  69           3HZ      LYS  69  -6.253  -9.608 -11.275
  503   2HZ   LYS  69           2HZ      LYS  69  -6.740 -11.170 -11.734
  504   3HZ   LYS  69           1HZ      LYS  69  -5.089 -10.777 -11.669
  505    H    CYS  70             H      CYS  70  -7.048  -3.712 -12.091
  506    HA   CYS  70            HA      CYS  70  -6.301  -2.229 -14.629
  507   1HB   CYS  70           2HB      CYS  70  -5.700  -0.397 -12.975
  508   2HB   CYS  70           1HB      CYS  70  -7.403  -0.730 -13.142
  509    HG   CYS  70            HG      CYS  70  -6.332  -0.605 -10.547
  510    H    SER  71             H      SER  71  -3.960  -1.063 -13.731
  511    HA   SER  71            HA      SER  71  -2.270  -3.330 -12.837
  512   1HB   SER  71           2HB      SER  71  -0.767  -2.974 -14.696
  513   2HB   SER  71           1HB      SER  71  -2.385  -3.440 -15.206
  514    HG   SER  71            HG      SER  71  -1.043  -1.023 -15.469
  515    H    VAL  72             H      VAL  72  -1.372  -2.473 -11.094
  516    HA   VAL  72            HA      VAL  72  -0.621   0.130 -10.490
  517    HB   VAL  72            HB      VAL  72   1.079  -2.206  -9.809
  518   1HG1  VAL  72          2HG1      VAL  72   1.091   0.547  -9.102
  519   2HG1  VAL  72          1HG1      VAL  72   0.628  -0.374  -7.688
  520   3HG1  VAL  72          3HG1      VAL  72   2.138  -0.734  -8.495
  521   1HG2  VAL  72          2HG2      VAL  72  -1.601  -1.401  -8.775
  522   2HG2  VAL  72          1HG2      VAL  72  -1.046  -3.002  -9.245
  523   3HG2  VAL  72          3HG2      VAL  72  -0.472  -2.277  -7.764
  524    H    ILE  73             H      ILE  73   0.689   1.459 -11.275
  525    HA   ILE  73            HA      ILE  73   3.124   0.615 -12.566
  526    HB   ILE  73            HB      ILE  73   1.152   2.517 -13.700
  527   1HG1  ILE  73          2HG1      ILE  73   2.461   0.267 -15.188
  528   2HG1  ILE  73          1HG1      ILE  73   1.149  -0.110 -14.080
  529   1HG2  ILE  73          3HG2      ILE  73   4.059   2.217 -14.245
  530   2HG2  ILE  73          2HG2      ILE  73   2.984   2.647 -15.575
  531   3HG2  ILE  73          1HG2      ILE  73   3.103   3.693 -14.162
  532   1HD1  ILE  73          3HD1      ILE  73  -0.358   1.425 -15.351
  533   2HD1  ILE  73          2HD1      ILE  73   0.959   1.794 -16.459
  534   3HD1  ILE  73          1HD1      ILE  73   0.276   0.145 -16.420
  535    NH1  ARG  74           NH1      ARG  74   9.014   4.400 -11.228
  536    NH2  ARG  74           NH2      ARG  74   8.173   6.273 -12.162
  537    H    ARG  74             H      ARG  74   3.672   1.128 -10.429
  538    HA   ARG  74            HA      ARG  74   5.333   2.521  -9.292
  539   1HB   ARG  74           2HB      ARG  74   4.568   4.540 -10.798
  540   2HB   ARG  74           1HB      ARG  74   3.412   4.846  -9.500
  541   1HG   ARG  74           2HG      ARG  74   5.411   6.150  -9.062
  542   2HG   ARG  74           1HG      ARG  74   5.330   4.843  -7.882
  543   1HD   ARG  74           2HD      ARG  74   7.421   4.271  -8.512
  544   2HD   ARG  74           1HD      ARG  74   6.740   3.754 -10.055
  545    HE   ARG  74            HE      ARG  74   7.545   6.603  -9.691
  546   1HH1  ARG  74          2HH1      ARG  74   9.076   3.771 -10.454
  547   2HH1  ARG  74          1HH1      ARG  74   9.535   4.221 -12.060
  548   1HH2  ARG  74          1HH2      ARG  74   7.595   7.086 -12.106
  549   2HH2  ARG  74          2HH2      ARG  74   8.687   6.082 -13.001
  550    H    ASP  75             H      ASP  75   4.262   0.774  -7.970
  551    HA   ASP  75            HA      ASP  75   2.001   1.484  -6.419
  552   1HB   ASP  75           2HB      ASP  75   2.036  -0.808  -6.429
  553   2HB   ASP  75           1HB      ASP  75   3.742  -0.863  -6.444
  554    H    SER  76             H      SER  76   1.998   3.161  -5.186
  555    HA   SER  76            HA      SER  76   4.011   3.227  -3.001
  556   1HB   SER  76           2HB      SER  76   3.545   5.467  -5.002
  557   2HB   SER  76           1HB      SER  76   4.100   5.795  -3.373
  558    HG   SER  76            HG      SER  76   5.956   5.453  -4.352
  559    H    LEU  77             H      LEU  77   1.279   2.398  -3.157
  560    HA   LEU  77            HA      LEU  77  -0.616   4.402  -2.172
  561   1HB   LEU  77           2HB      LEU  77  -0.917   2.060  -3.308
  562   2HB   LEU  77           1HB      LEU  77  -0.822   1.429  -1.693
  563    HG   LEU  77            HG      LEU  77  -2.801   2.633  -1.062
  564   1HD1  LEU  77          2HD1      LEU  77  -2.198   4.144  -3.547
  565   2HD1  LEU  77          1HD1      LEU  77  -3.906   3.865  -3.213
  566   3HD1  LEU  77          3HD1      LEU  77  -2.902   4.716  -2.041
  567   1HD2  LEU  77          2HD2      LEU  77  -2.993   1.341  -3.808
  568   2HD2  LEU  77          1HD2      LEU  77  -3.213   0.555  -2.237
  569   3HD2  LEU  77          3HD2      LEU  77  -4.404   1.727  -2.805
  570    H    LEU  78             H      LEU  78   1.926   2.658  -0.650
  571    HA   LEU  78            HA      LEU  78   0.684   3.216   1.927
  572   1HB   LEU  78           2HB      LEU  78   2.894   1.445   1.270
  573   2HB   LEU  78           1HB      LEU  78   2.313   1.673   2.883
  574    HG   LEU  78            HG      LEU  78   0.335   0.958   0.733
  575   1HD1  LEU  78          2HD1      LEU  78   2.166  -1.060   2.056
  576   2HD1  LEU  78          1HD1      LEU  78   0.675  -1.470   1.184
  577   3HD1  LEU  78          3HD1      LEU  78   2.037  -0.724   0.330
  578   1HD2  LEU  78          1HD2      LEU  78   0.637   0.489   3.701
  579   2HD2  LEU  78          3HD2      LEU  78  -0.628   1.381   2.853
  580   3HD2  LEU  78          2HD2      LEU  78  -0.569  -0.381   2.744
  581    H    GLN  79             H      GLN  79   1.263   4.921   2.892
  582    HA   GLN  79            HA      GLN  79   2.618   6.994   2.075
  583   1HB   GLN  79           2HB      GLN  79   2.435   7.904   4.353
  584   2HB   GLN  79           1HB      GLN  79   0.951   7.094   3.861
  585   1HG   GLN  79           2HG      GLN  79   2.656   5.126   5.067
  586   2HG   GLN  79           1HG      GLN  79   2.609   6.527   6.137
  587   1HE2  GLN  79          2HE2      GLN  79  -0.873   6.168   6.890
  588   2HE2  GLN  79          1HE2      GLN  79   0.424   7.262   6.881
  589    H    ASP  80             H      ASP  80   4.441   6.065   1.294
  590    HA   ASP  80            HA      ASP  80   6.753   6.007   3.183
  591   1HB   ASP  80           2HB      ASP  80   6.571   4.117   1.486
  592   2HB   ASP  80           1HB      ASP  80   6.683   5.327   0.211
  593    H    GLY  81             H      GLY  81   4.922   8.306   2.236
  594   1HA   GLY  81           2HA      GLY  81   5.502  10.625   1.989
  595   2HA   GLY  81           1HA      GLY  81   6.981  10.122   1.152
  596    H    GLU  82             H      GLU  82   3.875   8.517   0.446
  597    HA   GLU  82            HA      GLU  82   3.509  10.003  -2.038
  598   1HB   GLU  82           2HB      GLU  82   4.585   7.295  -1.731
  599   2HB   GLU  82           1HB      GLU  82   3.491   7.605  -3.034
  600   1HG   GLU  82           2HG      GLU  82   5.347   8.200  -4.167
  601   2HG   GLU  82           1HG      GLU  82   5.120   9.735  -3.315
  602    H    PHE  83             H      PHE  83   2.481   6.910  -0.633
  603    HA   PHE  83            HA      PHE  83   0.458   5.775  -0.649
  604   1HB   PHE  83           2HB      PHE  83  -1.588   7.544  -0.515
  605   2HB   PHE  83           1HB      PHE  83  -0.831   6.746   0.795
  606    HD1  PHE  83           HD1      PHE  83   0.987   7.885   2.043
  607    HD2  PHE  83           HD2      PHE  83  -1.406   9.887  -0.895
  608    HE1  PHE  83           HE1      PHE  83   1.734  10.084   2.947
  609    HE2  PHE  83           HE2      PHE  83  -0.671  12.091  -0.002
  610    HZ   PHE  83            HZ      PHE  83   0.899  12.189   1.918
  611    H    SER  84             H      SER  84   1.345   7.292  -3.375
  612    HA   SER  84            HA      SER  84  -1.319   7.016  -4.724
  613   1HB   SER  84           2HB      SER  84  -0.112   8.243  -6.608
  614   2HB   SER  84           1HB      SER  84  -0.458   9.179  -5.153
  615    HG   SER  84            HG      SER  84   1.701   9.469  -5.822
  616    H    MET  85             H      MET  85  -1.569   5.723  -6.405
  617    HA   MET  85            HA      MET  85   0.712   3.952  -7.226
  618   1HB   MET  85           2HB      MET  85  -0.958   3.123  -5.401
  619   2HB   MET  85           1HB      MET  85  -2.057   2.997  -6.731
  620   1HG   MET  85           2HG      MET  85  -1.153   1.101  -7.430
  621   2HG   MET  85           1HG      MET  85   0.451   1.784  -7.381
  622   1HE   MET  85           3HE      MET  85  -1.535  -0.652  -6.665
  623   2HE   MET  85           2HE      MET  85  -0.077  -1.524  -6.070
  624   3HE   MET  85           1HE      MET  85  -1.444  -1.212  -4.971
  625    H    ASP  86             H      ASP  86   0.814   3.923  -9.537
  626    HA   ASP  86            HA      ASP  86  -1.550   5.071 -10.963
  627   1HB   ASP  86           2HB      ASP  86   1.274   4.567 -11.535
  628   2HB   ASP  86           1HB      ASP  86   0.170   4.568 -12.886
  629    H    LEU  87             H      LEU  87  -2.929   3.104 -10.525
  630    HA   LEU  87            HA      LEU  87  -2.070   0.806 -12.096
  631   1HB   LEU  87           2HB      LEU  87  -4.265  -0.263 -11.089
  632   2HB   LEU  87           1HB      LEU  87  -2.755  -0.285 -10.244
  633    HG   LEU  87            HG      LEU  87  -4.616   0.291  -8.764
  634   1HD1  LEU  87          3HD1      LEU  87  -2.203   1.691  -9.006
  635   2HD1  LEU  87          2HD1      LEU  87  -3.440   2.876  -8.590
  636   3HD1  LEU  87          1HD1      LEU  87  -3.194   1.466  -7.568
  637   1HD2  LEU  87          3HD2      LEU  87  -5.705   1.588 -10.813
  638   2HD2  LEU  87          2HD2      LEU  87  -6.118   1.948  -9.157
  639   3HD2  LEU  87          1HD2      LEU  87  -4.959   2.962 -10.008
  640    NH1  ARG  88           NH1      ARG  88   0.305   3.969 -18.655
  641    NH2  ARG  88           NH2      ARG  88   1.272   2.372 -19.926
  642    H    ARG  88             H      ARG  88  -2.501   0.787 -14.100
  643    HA   ARG  88            HA      ARG  88  -4.953   2.209 -15.010
  644   1HB   ARG  88           2HB      ARG  88  -3.790   2.949 -16.876
  645   2HB   ARG  88           1HB      ARG  88  -2.468   2.793 -15.760
  646   1HG   ARG  88           2HG      ARG  88  -1.718   0.709 -16.801
  647   2HG   ARG  88           1HG      ARG  88  -3.204   0.552 -17.768
  648   1HD   ARG  88           2HD      ARG  88  -2.346   1.842 -19.370
  649   2HD   ARG  88           1HD      ARG  88  -2.036   3.171 -18.207
  650    HE   ARG  88            HE      ARG  88  -0.055   0.968 -18.224
  651   1HH1  ARG  88          2HH1      ARG  88  -0.372   4.239 -17.970
  652   2HH1  ARG  88          1HH1      ARG  88   0.920   4.654 -19.047
  653   1HH2  ARG  88          1HH2      ARG  88   1.338   1.415 -20.211
  654   2HH2  ARG  88          2HH2      ARG  88   1.881   3.056 -20.324
  655    H    THR  89             H      THR  89  -6.295   1.395 -16.572
  656    HA   THR  89            HA      THR  89  -6.665  -1.479 -16.625
  657    HB   THR  89            HB      THR  89  -8.581  -1.033 -17.917
  658    HG1  THR  89           HG1      THR  89  -8.437   0.092 -19.633
  659   1HG2  THR  89          3HG2      THR  89  -8.243   0.535 -15.731
  660   2HG2  THR  89          2HG2      THR  89  -8.580   1.752 -16.971
  661   3HG2  THR  89          1HG2      THR  89  -9.748   0.459 -16.654
  662    H    LYS  90             H      LYS  90  -5.099  -2.657 -17.776
  663    HA   LYS  90            HA      LYS  90  -3.903  -1.380 -20.067
  664   1HB   LYS  90           2HB      LYS  90  -3.015  -4.091 -19.292
  665   2HB   LYS  90           1HB      LYS  90  -2.123  -2.654 -19.757
  666   1HG   LYS  90           2HG      LYS  90  -2.763  -1.669 -17.513
  667   2HG   LYS  90           1HG      LYS  90  -3.101  -3.348 -17.038
  668   1HD   LYS  90           2HD      LYS  90  -0.549  -2.911 -18.551
  669   2HD   LYS  90           1HD      LYS  90  -0.579  -2.254 -16.929
  670   1HE   LYS  90           2HE      LYS  90  -0.369  -4.318 -16.015
  671   2HE   LYS  90           1HE      LYS  90  -1.726  -4.925 -16.952
  672   1HZ   LYS  90           1HZ      LYS  90   0.687  -4.496 -18.486
  673   2HZ   LYS  90           3HZ      LYS  90   0.833  -5.680 -17.281
  674   3HZ   LYS  90           2HZ      LYS  90  -0.373  -5.824 -18.467
  675    H    SER  91             H      SER  91  -4.047  -2.311 -22.093
  676    HA   SER  91            HA      SER  91  -6.490  -3.870 -22.570
  677   1HB   SER  91           2HB      SER  91  -6.483  -2.147 -24.098
  678   2HB   SER  91           1HB      SER  91  -4.766  -2.087 -24.187
  679    HG   SER  91            HG      SER  91  -4.753  -3.542 -25.751
  680    H    THR  92             H      THR  92  -6.459  -5.488 -24.405
  681    HA   THR  92            HA      THR  92  -3.986  -7.080 -24.699
  682    HB   THR  92            HB      THR  92  -4.909  -9.130 -23.739
  683    HG1  THR  92           HG1      THR  92  -6.961  -9.297 -23.412
  684   1HG2  THR  92          1HG2      THR  92  -3.753  -7.453 -22.246
  685   2HG2  THR  92          3HG2      THR  92  -5.349  -6.896 -21.749
  686   3HG2  THR  92          2HG2      THR  92  -4.843  -8.556 -21.411
  687    H    GLY  93             H      GLY  93  -4.086  -7.253 -26.919
  688   1HA   GLY  93           2HA      GLY  93  -4.894  -8.467 -28.863
  689   2HA   GLY  93           1HA      GLY  93  -6.485  -8.561 -28.110
  690    H    GLY  94             H      GLY  94  -4.369  -5.724 -28.629
  691   1HA   GLY  94           2HA      GLY  94  -4.681  -3.781 -29.921
  692   2HA   GLY  94           1HA      GLY  94  -5.911  -4.648 -30.833
  693    H    ALA  95             H      ALA  95  -6.218  -4.447 -27.348
  694    HA   ALA  95            HA      ALA  95  -8.732  -2.902 -27.642
  695   1HB   ALA  95           1HB      ALA  95  -7.925  -4.885 -25.887
  696   2HB   ALA  95           3HB      ALA  95  -7.788  -3.424 -24.899
  697   3HB   ALA  95           2HB      ALA  95  -9.327  -3.839 -25.670
  698    HA   PRO  96            HA      PRO  96  -7.095   0.920 -26.214
  699   1HB   PRO  96           2HB      PRO  96  -9.335   2.002 -25.124
  700   2HB   PRO  96           1HB      PRO  96  -9.190   1.690 -26.865
  701   1HG   PRO  96           2HG      PRO  96 -10.821   0.227 -24.851
  702   2HG   PRO  96           1HG      PRO  96 -11.024   0.309 -26.598
  703   1HD   PRO  96           2HD      PRO  96  -9.807  -1.820 -25.100
  704   2HD   PRO  96           1HD      PRO  96  -9.989  -1.675 -26.861
  705    H    THR  97             H      THR  97  -6.020   1.722 -24.388
  706    HA   THR  97            HA      THR  97  -6.556   0.362 -21.769
  707    HB   THR  97            HB      THR  97  -4.407   1.390 -21.037
  708    HG1  THR  97           HG1      THR  97  -3.741   3.052 -22.103
  709   1HG2  THR  97          1HG2      THR  97  -4.739  -0.657 -22.881
  710   2HG2  THR  97          3HG2      THR  97  -3.491   0.357 -23.609
  711   3HG2  THR  97          2HG2      THR  97  -3.262  -0.286 -21.980
  712    H    PHE  98             H      PHE  98  -6.251   1.821 -19.907
  713    HA   PHE  98            HA      PHE  98  -7.083   4.625 -20.057
  714   1HB   PHE  98           2HB      PHE  98  -8.816   2.402 -19.024
  715   2HB   PHE  98           1HB      PHE  98  -8.982   4.076 -18.558
  716    HD1  PHE  98           HD1      PHE  98  -8.910   5.856 -20.607
  717    HD2  PHE  98           HD2      PHE  98 -10.019   1.699 -20.934
  718    HE1  PHE  98           HE1      PHE  98 -10.105   6.376 -22.685
  719    HE2  PHE  98           HE2      PHE  98 -11.209   2.203 -23.056
  720    HZ   PHE  98            HZ      PHE  98 -11.248   4.506 -23.951
  721    H    ASN  99             H      ASN  99  -7.214   5.397 -17.651
  722    HA   ASN  99            HA      ASN  99  -5.349   3.746 -16.057
  723   1HB   ASN  99           2HB      ASN  99  -4.687   6.654 -16.203
  724   2HB   ASN  99           1HB      ASN  99  -3.629   5.276 -15.880
  725   1HD2  ASN  99          2HD2      ASN  99  -2.394   5.498 -19.146
  726   2HD2  ASN  99          1HD2      ASN  99  -2.076   5.418 -17.481
  727    H    VAL 100             H      VAL 100  -5.178   4.247 -13.874
  728    HA   VAL 100            HA      VAL 100  -7.289   5.927 -12.649
  729    HB   VAL 100            HB      VAL 100  -6.568   3.131 -11.665
  730   1HG1  VAL 100          2HG1      VAL 100  -7.698   5.014 -10.271
  731   2HG1  VAL 100          1HG1      VAL 100  -9.136   4.542 -11.161
  732   3HG1  VAL 100          3HG1      VAL 100  -8.290   3.365 -10.177
  733   1HG2  VAL 100          1HG2      VAL 100  -8.878   3.948 -13.486
  734   2HG2  VAL 100          3HG2      VAL 100  -7.559   2.850 -13.906
  735   3HG2  VAL 100          2HG2      VAL 100  -8.742   2.384 -12.685
  736    H    THR 101             H      THR 101  -6.451   6.911 -10.759
  737    HA   THR 101            HA      THR 101  -3.734   6.067  -9.862
  738    HB   THR 101            HB      THR 101  -5.134   8.790  -9.686
  739    HG1  THR 101           HG1      THR 101  -2.661   8.012 -10.835
  740   1HG2  THR 101          1HG2      THR 101  -3.884   8.126  -7.573
  741   2HG2  THR 101          3HG2      THR 101  -2.416   8.033  -8.547
  742   3HG2  THR 101          2HG2      THR 101  -3.259   9.564  -8.354
  743    H    VAL 102             H      VAL 102  -3.745   5.350  -7.796
  744    HA   VAL 102            HA      VAL 102  -6.255   5.630  -6.278
  745    HB   VAL 102            HB      VAL 102  -4.616   3.219  -7.024
  746   1HG1  VAL 102          1HG1      VAL 102  -6.055   3.649  -4.393
  747   2HG1  VAL 102          3HG1      VAL 102  -6.149   2.066  -5.166
  748   3HG1  VAL 102          2HG1      VAL 102  -4.581   2.731  -4.712
  749   1HG2  VAL 102          2HG2      VAL 102  -7.522   3.914  -6.823
  750   2HG2  VAL 102          1HG2      VAL 102  -6.577   3.675  -8.270
  751   3HG2  VAL 102          3HG2      VAL 102  -6.935   2.310  -7.221
  752    H    THR 103             H      THR 103  -5.940   6.676  -4.496
  753    HA   THR 103            HA      THR 103  -3.269   6.718  -3.290
  754    HB   THR 103            HB      THR 103  -4.147   8.777  -2.070
  755    HG1  THR 103           HG1      THR 103  -5.849   9.788  -3.383
  756   1HG2  THR 103          1HG2      THR 103  -2.671   8.566  -4.242
  757   2HG2  THR 103          3HG2      THR 103  -4.094   9.262  -5.037
  758   3HG2  THR 103          2HG2      THR 103  -3.283  10.135  -3.728
  759    H    LYS 104             H      LYS 104  -3.263   6.739  -0.866
  760    HA   LYS 104            HA      LYS 104  -5.660   5.543   0.397
  761   1HB   LYS 104           2HB      LYS 104  -4.309   3.633  -0.290
  762   2HB   LYS 104           1HB      LYS 104  -2.879   4.339   0.440
  763   1HG   LYS 104           2HG      LYS 104  -3.389   3.349   2.410
  764   2HG   LYS 104           1HG      LYS 104  -4.898   4.249   2.463
  765   1HD   LYS 104           2HD      LYS 104  -5.897   2.224   2.340
  766   2HD   LYS 104           1HD      LYS 104  -5.480   2.291   0.636
  767   1HE   LYS 104           2HE      LYS 104  -3.480   1.260   2.626
  768   2HE   LYS 104           1HE      LYS 104  -4.748   0.199   2.014
  769   1HZ   LYS 104           1HZ      LYS 104  -3.950   1.150  -0.265
  770   2HZ   LYS 104           3HZ      LYS 104  -2.511   1.437   0.588
  771   3HZ   LYS 104           2HZ      LYS 104  -3.126  -0.143   0.472
  772    H    THR 105             H      THR 105  -5.899   6.076   2.509
  773    HA   THR 105            HA      THR 105  -3.837   7.910   3.684
  774    HB   THR 105            HB      THR 105  -5.623   8.900   4.997
  775    HG1  THR 105           HG1      THR 105  -7.272   7.756   5.488
  776   1HG2  THR 105          2HG2      THR 105  -5.649   8.877   2.148
  777   2HG2  THR 105          1HG2      THR 105  -7.329   8.865   2.693
  778   3HG2  THR 105          3HG2      THR 105  -6.236  10.149   3.226
  779    H    ASP 106             H      ASP 106  -5.220   7.466   6.400
  780    HA   ASP 106            HA      ASP 106  -3.776   4.967   7.060
  781   1HB   ASP 106           2HB      ASP 106  -3.561   7.193   8.323
  782   2HB   ASP 106           1HB      ASP 106  -5.110   6.778   9.047
  783    H    LYS 107             H      LYS 107  -7.024   6.075   6.562
  784    HA   LYS 107            HA      LYS 107  -8.079   3.483   7.630
  785   1HB   LYS 107           2HB      LYS 107  -8.803   6.237   8.395
  786   2HB   LYS 107           1HB      LYS 107 -10.175   5.192   8.052
  787   1HG   LYS 107           2HG      LYS 107  -9.596   3.681   9.711
  788   2HG   LYS 107           1HG      LYS 107  -7.941   4.270   9.808
  789   1HD   LYS 107           2HD      LYS 107  -9.129   5.110  11.742
  790   2HD   LYS 107           1HD      LYS 107  -8.852   6.463  10.644
  791   1HE   LYS 107           2HE      LYS 107 -11.138   6.138   9.712
  792   2HE   LYS 107           1HE      LYS 107 -11.414   4.861  10.895
  793   1HZ   LYS 107           3HZ      LYS 107 -10.511   7.508  11.797
  794   2HZ   LYS 107           2HZ      LYS 107 -12.149   7.273  11.412
  795   3HZ   LYS 107           1HZ      LYS 107 -11.416   6.342  12.631
  796    H    THR 108             H      THR 108  -7.812   5.405   4.895
  797    HA   THR 108            HA      THR 108 -10.356   4.327   3.823
  798    HB   THR 108            HB      THR 108 -10.743   6.389   2.683
  799    HG1  THR 108           HG1      THR 108  -8.873   7.215   2.063
  800   1HG2  THR 108          1HG2      THR 108 -10.852   6.089   5.418
  801   2HG2  THR 108          3HG2      THR 108  -9.827   7.538   5.265
  802   3HG2  THR 108          2HG2      THR 108 -11.431   7.531   4.545
  803    H    LEU 109             H      LEU 109 -10.295   4.337   1.427
  804    HA   LEU 109            HA      LEU 109  -7.653   3.774   0.255
  805   1HB   LEU 109           2HB      LEU 109  -9.332   1.816   0.979
  806   2HB   LEU 109           1HB      LEU 109 -10.044   2.158  -0.578
  807    HG   LEU 109            HG      LEU 109  -7.561   0.699   0.085
  808   1HD1  LEU 109          2HD1      LEU 109  -9.769   0.142  -1.251
  809   2HD1  LEU 109          1HD1      LEU 109  -8.867   0.818  -2.600
  810   3HD1  LEU 109          3HD1      LEU 109  -8.234  -0.568  -1.727
  811   1HD2  LEU 109          3HD2      LEU 109  -6.579   2.793  -0.817
  812   2HD2  LEU 109          2HD2      LEU 109  -6.306   1.402  -1.847
  813   3HD2  LEU 109          1HD2      LEU 109  -7.538   2.580  -2.264
  814    H    VAL 110             H      VAL 110  -7.815   5.928  -0.837
  815    HA   VAL 110            HA      VAL 110 -10.282   6.458  -2.312
  816    HB   VAL 110            HB      VAL 110  -7.750   8.009  -1.708
  817   1HG1  VAL 110          1HG1      VAL 110  -9.589   8.509  -4.046
  818   2HG1  VAL 110          3HG1      VAL 110  -8.685   9.819  -3.298
  819   3HG1  VAL 110          2HG1      VAL 110  -7.836   8.469  -4.047
  820   1HG2  VAL 110          1HG2      VAL 110 -10.624   8.112  -1.103
  821   2HG2  VAL 110          3HG2      VAL 110  -9.270   8.851  -0.241
  822   3HG2  VAL 110          2HG2      VAL 110  -9.997   9.687  -1.625
  823    H    LEU 111             H      LEU 111 -10.490   6.392  -4.480
  824    HA   LEU 111            HA      LEU 111  -8.200   5.497  -6.094
  825   1HB   LEU 111           2HB      LEU 111 -10.982   4.543  -6.777
  826   2HB   LEU 111           1HB      LEU 111  -9.443   3.863  -7.281
  827    HG   LEU 111            HG      LEU 111 -10.536   3.759  -4.476
  828   1HD1  LEU 111          3HD1      LEU 111 -11.693   2.379  -6.325
  829   2HD1  LEU 111          2HD1      LEU 111 -10.199   1.424  -6.355
  830   3HD1  LEU 111          1HD1      LEU 111 -11.165   1.531  -4.875
  831   1HD2  LEU 111          2HD2      LEU 111  -8.011   3.693  -4.899
  832   2HD2  LEU 111          1HD2      LEU 111  -8.717   2.449  -3.892
  833   3HD2  LEU 111          3HD2      LEU 111  -8.316   2.092  -5.570
  834    H    LEU 112             H      LEU 112  -8.410   6.225  -8.286
  835    HA   LEU 112            HA      LEU 112 -10.420   8.311  -8.781
  836   1HB   LEU 112           2HB      LEU 112  -8.305   9.434  -8.044
  837   2HB   LEU 112           1HB      LEU 112  -7.448   8.519  -9.246
  838    HG   LEU 112            HG      LEU 112  -8.422   9.709 -11.054
  839   1HD1  LEU 112          2HD1      LEU 112 -10.573  10.123  -9.192
  840   2HD1  LEU 112          1HD1      LEU 112 -10.146  11.604 -10.040
  841   3HD1  LEU 112          3HD1      LEU 112 -10.582  10.163 -10.946
  842   1HD2  LEU 112          2HD2      LEU 112  -6.919  10.984  -9.183
  843   2HD2  LEU 112          1HD2      LEU 112  -7.346  11.660 -10.758
  844   3HD2  LEU 112          3HD2      LEU 112  -8.296  12.065  -9.325
  845    H    MET 113             H      MET 113 -11.435   7.268 -10.376
  846    HA   MET 113            HA      MET 113  -9.737   5.834 -12.414
  847   1HB   MET 113           2HB      MET 113 -11.938   4.870 -11.427
  848   2HB   MET 113           1HB      MET 113 -12.698   5.968 -12.553
  849   1HG   MET 113           2HG      MET 113 -10.913   4.893 -14.226
  850   2HG   MET 113           1HG      MET 113 -11.083   3.542 -13.127
  851   1HE   MET 113           1HE      MET 113 -11.737   2.589 -15.652
  852   2HE   MET 113           3HE      MET 113 -12.327   1.730 -14.220
  853   3HE   MET 113           2HE      MET 113 -13.397   2.001 -15.593
  854    H    GLY 114             H      GLY 114  -9.711   6.410 -14.531
  855   1HA   GLY 114           2HA      GLY 114 -11.321   8.597 -15.450
  856   2HA   GLY 114           1HA      GLY 114  -9.696   9.070 -15.124
  857    H    LYS 115             H      LYS 115 -11.585   8.631 -17.635
  858    HA   LYS 115            HA      LYS 115  -9.456   7.664 -19.180
  859   1HB   LYS 115           2HB      LYS 115 -12.227   6.807 -19.428
  860   2HB   LYS 115           1HB      LYS 115 -10.909   6.083 -20.193
  861   1HG   LYS 115           2HG      LYS 115 -10.313   4.893 -18.231
  862   2HG   LYS 115           1HG      LYS 115 -11.188   5.952 -17.216
  863   1HD   LYS 115           2HD      LYS 115 -12.322   3.731 -17.549
  864   2HD   LYS 115           1HD      LYS 115 -13.306   5.121 -17.986
  865   1HE   LYS 115           2HE      LYS 115 -11.746   4.227 -20.263
  866   2HE   LYS 115           1HE      LYS 115 -12.706   2.903 -19.617
  867   1HZ   LYS 115           1HZ      LYS 115 -14.575   4.642 -19.591
  868   2HZ   LYS 115           3HZ      LYS 115 -13.598   5.506 -20.673
  869   3HZ   LYS 115           2HZ      LYS 115 -14.136   3.947 -21.078
  870    H    GLU 116             H      GLU 116  -9.273   9.466 -20.606
  871    HA   GLU 116            HA      GLU 116 -11.178   9.390 -22.803
  872   1HB   GLU 116           2HB      GLU 116 -10.778  11.592 -21.486
  873   2HB   GLU 116           1HB      GLU 116  -9.359  11.643 -22.460
  874   1HG   GLU 116           2HG      GLU 116 -10.577  11.716 -24.500
  875   2HG   GLU 116           1HG      GLU 116 -12.061  11.202 -23.698
  876    H    GLY 117             H      GLY 117  -9.504   7.442 -23.597
  877   1HA   GLY 117           2HA      GLY 117  -7.276   6.788 -24.376
  878   2HA   GLY 117           1HA      GLY 117  -7.168   8.469 -24.919
  879    H    VAL 118             H      VAL 118  -7.705   8.643 -21.525
  880    HA   VAL 118            HA      VAL 118  -6.046  10.229 -20.530
  881    HB   VAL 118            HB      VAL 118  -7.742   9.335 -19.205
  882   1HG1  VAL 118          2HG1      VAL 118  -6.742   6.834 -20.041
  883   2HG1  VAL 118          1HG1      VAL 118  -6.463   6.887 -18.311
  884   3HG1  VAL 118          3HG1      VAL 118  -8.076   7.135 -18.928
  885   1HG2  VAL 118          2HG2      VAL 118  -5.030   9.695 -18.192
  886   2HG2  VAL 118          1HG2      VAL 118  -6.543   9.950 -17.341
  887   3HG2  VAL 118          3HG2      VAL 118  -5.753   8.362 -17.265
  888    H    HIS 119             H      HIS 119  -4.185  10.665 -20.042
  889    HA   HIS 119            HA      HIS 119  -1.851   9.157 -20.842
  890   1HB   HIS 119           2HB      HIS 119  -2.118  11.674 -20.820
  891   2HB   HIS 119           1HB      HIS 119  -2.043  11.624 -19.051
  892    HD1  HIS 119           HD1      HIS 119   0.148  13.226 -20.131
  893    HD2  HIS 119           HD2      HIS 119   0.484   9.066 -20.040
  894    HE1  HIS 119           HE1      HIS 119   2.618  12.701 -20.331
  895    H    GLY 120             H      GLY 120  -3.082  10.266 -17.663
  896   1HA   GLY 120           2HA      GLY 120  -3.232   8.690 -15.758
  897   2HA   GLY 120           1HA      GLY 120  -1.757   7.923 -16.359
  898    H    GLY 121             H      GLY 121  -1.923  11.408 -16.458
  899   1HA   GLY 121           2HA      GLY 121  -0.057  11.565 -14.110
  900   2HA   GLY 121           1HA      GLY 121   0.096  12.595 -15.531
  901    H    LEU 122             H      LEU 122  -2.694  13.112 -15.851
  902    HA   LEU 122            HA      LEU 122  -3.079  15.276 -13.902
  903   1HB   LEU 122           2HB      LEU 122  -5.270  14.463 -15.816
  904   2HB   LEU 122           1HB      LEU 122  -4.751  16.072 -15.350
  905    HG   LEU 122            HG      LEU 122  -2.538  15.131 -16.652
  906   1HD1  LEU 122          2HD1      LEU 122  -4.553  13.291 -17.316
  907   2HD1  LEU 122          1HD1      LEU 122  -4.424  14.355 -18.721
  908   3HD1  LEU 122          3HD1      LEU 122  -3.000  13.495 -18.130
  909   1HD2  LEU 122          2HD2      LEU 122  -4.225  17.226 -16.908
  910   2HD2  LEU 122          1HD2      LEU 122  -2.966  16.867 -18.090
  911   3HD2  LEU 122          3HD2      LEU 122  -4.623  16.344 -18.384
  912    H    ILE 123             H      ILE 123  -4.108  11.966 -14.318
  913    HA   ILE 123            HA      ILE 123  -6.387  12.169 -12.456
  914    HB   ILE 123            HB      ILE 123  -4.882   9.889 -13.753
  915   1HG1  ILE 123          2HG1      ILE 123  -7.723  10.971 -14.090
  916   2HG1  ILE 123          1HG1      ILE 123  -6.411  11.115 -15.259
  917   1HG2  ILE 123          3HG2      ILE 123  -6.457   9.773 -11.324
  918   2HG2  ILE 123          2HG2      ILE 123  -7.319   8.910 -12.596
  919   3HG2  ILE 123          1HG2      ILE 123  -5.674   8.440 -12.175
  920   1HD1  ILE 123          3HD1      ILE 123  -6.324   8.593 -15.354
  921   2HD1  ILE 123          2HD1      ILE 123  -7.788   8.567 -14.363
  922   3HD1  ILE 123          1HD1      ILE 123  -7.826   9.299 -15.967
  923    H    ASN 124             H      ASN 124  -2.977  11.206 -12.591
  924    HA   ASN 124            HA      ASN 124  -2.666  10.315  -9.926
  925   1HB   ASN 124           2HB      ASN 124  -0.960   9.996 -11.708
  926   2HB   ASN 124           1HB      ASN 124  -0.653  11.732 -11.674
  927   1HD2  ASN 124          2HD2      ASN 124   1.548   9.596  -9.268
  928   2HD2  ASN 124          1HD2      ASN 124   0.939   9.145 -10.783
  929    H    LYS 125             H      LYS 125  -2.897  13.466 -11.437
  930    HA   LYS 125            HA      LYS 125  -1.951  14.929  -9.002
  931   1HB   LYS 125           2HB      LYS 125  -2.003  16.816 -10.385
  932   2HB   LYS 125           1HB      LYS 125  -1.980  15.593 -11.649
  933   1HG   LYS 125           2HG      LYS 125  -3.719  16.886 -12.411
  934   2HG   LYS 125           1HG      LYS 125  -4.604  15.801 -11.373
  935   1HD   LYS 125           2HD      LYS 125  -5.406  17.777 -10.545
  936   2HD   LYS 125           1HD      LYS 125  -3.985  17.559  -9.512
  937   1HE   LYS 125           2HE      LYS 125  -2.729  19.149 -10.677
  938   2HE   LYS 125           1HE      LYS 125  -3.687  18.978 -12.146
  939   1HZ   LYS 125           3HZ      LYS 125  -5.131  19.931  -9.806
  940   2HZ   LYS 125           2HZ      LYS 125  -3.969  20.997 -10.432
  941   3HZ   LYS 125           1HZ      LYS 125  -5.226  20.434 -11.422
  942    H    LYS 126             H      LYS 126  -5.014  14.048 -10.508
  943    HA   LYS 126            HA      LYS 126  -6.686  15.567  -8.651
  944   1HB   LYS 126           2HB      LYS 126  -7.206  13.646 -10.899
  945   2HB   LYS 126           1HB      LYS 126  -8.513  14.078  -9.788
  946   1HG   LYS 126           2HG      LYS 126  -8.098  16.479 -10.212
  947   2HG   LYS 126           1HG      LYS 126  -6.798  16.061 -11.327
  948   1HD   LYS 126           2HD      LYS 126  -9.631  15.078 -11.686
  949   2HD   LYS 126           1HD      LYS 126  -9.048  16.585 -12.394
  950   1HE   LYS 126           2HE      LYS 126  -7.396  14.138 -12.816
  951   2HE   LYS 126           1HE      LYS 126  -8.901  14.270 -13.721
  952   1HZ   LYS 126           1HZ      LYS 126  -7.084  16.576 -13.621
  953   2HZ   LYS 126           3HZ      LYS 126  -6.714  15.288 -14.660
  954   3HZ   LYS 126           2HZ      LYS 126  -8.185  16.125 -14.832
  955    H    CYS 127             H      CYS 127  -5.144  12.517  -8.426
  956    HA   CYS 127            HA      CYS 127  -7.085  11.430  -6.476
  957   1HB   CYS 127           2HB      CYS 127  -5.574  10.066  -8.227
  958   2HB   CYS 127           1HB      CYS 127  -4.439  10.150  -6.910
  959    HG   CYS 127            HG      CYS 127  -7.303   9.103  -6.306
  960    OH   TYR 128            OH      TYR 128   2.797  14.209  -2.734
  961    H    TYR 128             H      TYR 128  -3.942  12.917  -6.831
  962    HA   TYR 128            HA      TYR 128  -2.966  12.613  -4.150
  963   1HB   TYR 128           2HB      TYR 128  -1.972  13.535  -6.489
  964   2HB   TYR 128           1HB      TYR 128  -2.446  15.075  -5.796
  965    HD1  TYR 128           HD1      TYR 128  -1.665  13.307  -2.911
  966    HD2  TYR 128           HD2      TYR 128   0.221  14.864  -6.461
  967    HE1  TYR 128           HE1      TYR 128   0.502  13.384  -1.713
  968    HE2  TYR 128           HE2      TYR 128   2.396  14.941  -5.244
  969    HH   TYR 128            HH      TYR 128   3.128  13.309  -2.662
  970    H    GLU 129             H      GLU 129  -5.169  14.860  -5.820
  971    HA   GLU 129            HA      GLU 129  -5.430  16.663  -3.477
  972   1HB   GLU 129           2HB      GLU 129  -6.727  16.547  -6.202
  973   2HB   GLU 129           1HB      GLU 129  -7.284  17.669  -4.958
  974   1HG   GLU 129           2HG      GLU 129  -4.863  18.443  -4.744
  975   2HG   GLU 129           1HG      GLU 129  -4.533  17.523  -6.211
  976    H    MET 130             H      MET 130  -7.289  14.064  -5.023
  977    HA   MET 130            HA      MET 130  -9.750  14.267  -3.554
  978   1HB   MET 130           2HB      MET 130  -8.854  12.669  -5.561
  979   2HB   MET 130           1HB      MET 130  -8.592  11.565  -4.221
  980   1HG   MET 130           2HG      MET 130 -11.048  12.022  -3.576
  981   2HG   MET 130           1HG      MET 130 -11.215  12.770  -5.185
  982   1HE   MET 130           3HE      MET 130 -12.982  10.940  -4.340
  983   2HE   MET 130           2HE      MET 130 -13.135  10.619  -6.064
  984   3HE   MET 130           1HE      MET 130 -12.942   9.276  -4.942
  985    H    ALA 131             H      ALA 131  -6.712  12.581  -2.909
  986    HA   ALA 131            HA      ALA 131  -7.426  11.654  -0.240
  987   1HB   ALA 131           3HB      ALA 131  -4.856  11.595  -1.881
  988   2HB   ALA 131           2HB      ALA 131  -4.948  11.027  -0.196
  989   3HB   ALA 131           1HB      ALA 131  -5.914  10.236  -1.439
  990    H    SER 132             H      SER 132  -6.055  14.543  -1.645
  991    HA   SER 132            HA      SER 132  -4.503  15.467   0.570
  992   1HB   SER 132           2HB      SER 132  -6.000  16.940  -1.601
  993   2HB   SER 132           1HB      SER 132  -5.174  17.808  -0.319
  994    HG   SER 132            HG      SER 132  -3.279  16.597  -0.937
  995    H    HIS 133             H      HIS 133  -7.982  15.405  -0.141
  996    HA   HIS 133            HA      HIS 133  -8.649  16.988   2.235
  997   1HB   HIS 133           2HB      HIS 133 -10.189  16.787   0.225
  998   2HB   HIS 133           1HB      HIS 133 -10.565  15.143   0.781
  999    HD1  HIS 133           HD1      HIS 133 -10.237  18.548   2.498
 1000    HD2  HIS 133           HD2      HIS 133 -12.789  15.263   2.404
 1001    HE1  HIS 133           HE1      HIS 133 -12.108  19.046   4.127
 1002    H    LEU 134             H      LEU 134  -8.614  13.510   1.272
 1003    HA   LEU 134            HA      LEU 134  -9.553  12.608   3.867
 1004   1HB   LEU 134           2HB      LEU 134  -8.036  11.280   1.645
 1005   2HB   LEU 134           1HB      LEU 134  -8.452  10.431   3.132
 1006    HG   LEU 134            HG      LEU 134 -10.806  11.737   2.420
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.234  11.042   0.031
 1008   2HD1  LEU 134          2HD1      LEU 134 -10.918  10.533   0.019
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.512  12.231   0.234
 1010   1HD2  LEU 134          2HD2      LEU 134  -9.967   9.160   3.049
 1011   2HD2  LEU 134          1HD2      LEU 134 -11.634   9.640   2.734
 1012   3HD2  LEU 134          3HD2      LEU 134 -10.648   8.977   1.434
 1013    NH1  ARG 135           NH2      ARG 135  -0.690  10.529   4.980
 1014    NH2  ARG 135           NH1      ARG 135   0.182  12.612   5.118
 1015    H    ARG 135             H      ARG 135  -6.623  13.967   3.000
 1016    HA   ARG 135            HA      ARG 135  -5.093  12.734   5.196
 1017   1HB   ARG 135           2HB      ARG 135  -4.403  14.780   3.064
 1018   2HB   ARG 135           1HB      ARG 135  -3.316  14.407   4.394
 1019   1HG   ARG 135           2HG      ARG 135  -4.391  12.366   2.423
 1020   2HG   ARG 135           1HG      ARG 135  -2.788  13.090   2.341
 1021   1HD   ARG 135           2HD      ARG 135  -3.877  11.325   4.553
 1022   2HD   ARG 135           1HD      ARG 135  -2.587  10.933   3.425
 1023    HE   ARG 135            HE      ARG 135  -2.301  13.109   5.461
 1024   1HH1  ARG 135          1HH2      ARG 135  -1.485   9.926   4.897
 1025   2HH1  ARG 135          2HH2      ARG 135   0.229  10.140   5.040
 1026   1HH2  ARG 135          2HH1      ARG 135   0.059  13.604   5.142
 1027   2HH2  ARG 135          1HH1      ARG 135   1.100  12.220   5.186
 1028    NH1  ARG 136           NH1      ARG 136  -4.055  21.985   5.758
 1029    NH2  ARG 136           NH2      ARG 136  -5.655  22.270   7.333
 1030    H    ARG 136             H      ARG 136  -6.708  15.702   4.179
 1031    HA   ARG 136            HA      ARG 136  -6.141  17.094   6.685
 1032   1HB   ARG 136           2HB      ARG 136  -8.013  17.736   4.393
 1033   2HB   ARG 136           1HB      ARG 136  -7.706  18.809   5.761
 1034   1HG   ARG 136           2HG      ARG 136  -5.145  18.118   4.831
 1035   2HG   ARG 136           1HG      ARG 136  -6.093  18.369   3.368
 1036   1HD   ARG 136           2HD      ARG 136  -5.146  20.497   3.997
 1037   2HD   ARG 136           1HD      ARG 136  -6.875  20.560   4.337
 1038    HE   ARG 136            HE      ARG 136  -5.853  19.743   6.740
 1039   1HH1  ARG 136          2HH1      ARG 136  -3.645  21.439   5.028
 1040   2HH1  ARG 136          1HH1      ARG 136  -3.650  22.864   6.012
 1041   1HH2  ARG 136          1HH2      ARG 136  -6.470  21.939   7.813
 1042   2HH2  ARG 136          2HH2      ARG 136  -5.253  23.152   7.580
 1043    H    SER 137             H      SER 137  -8.112  14.564   5.798
 1044    HA   SER 137            HA      SER 137 -10.486  15.240   7.353
 1045   1HB   SER 137           2HB      SER 137 -11.364  13.204   6.467
 1046   2HB   SER 137           1HB      SER 137 -10.348  13.787   5.175
 1047    HG   SER 137            HG      SER 137 -10.067  11.532   5.741
 1048    H    GLN 138             H      GLN 138  -7.353  13.802   7.878
 1049    HA   GLN 138            HA      GLN 138  -6.343  12.958   9.812
 1050   1HB   GLN 138           2HB      GLN 138  -8.555  14.529  10.802
 1051   2HB   GLN 138           1HB      GLN 138  -8.413  13.069  11.783
 1052   1HG   GLN 138           2HG      GLN 138  -5.900  13.576  11.910
 1053   2HG   GLN 138           1HG      GLN 138  -6.295  15.165  11.256
 1054   1HE2  GLN 138          2HE2      GLN 138  -7.127  14.319  15.145
 1055   2HE2  GLN 138          1HE2      GLN 138  -6.461  13.143  14.119
 1056    OH   TYR 139            OH      TYR 139 -14.802  11.811   8.902
 1057    H    TYR 139             H      TYR 139  -8.273  11.400   7.980
 1058    HA   TYR 139            HA      TYR 139  -9.181   9.232   9.770
 1059   1HB   TYR 139           2HB      TYR 139  -9.432   9.666   6.770
 1060   2HB   TYR 139           1HB      TYR 139  -9.982   8.202   7.581
 1061    HD1  TYR 139           HD1      TYR 139 -10.973   9.725  10.188
 1062    HD2  TYR 139           HD2      TYR 139 -11.635  10.332   5.978
 1063    HE1  TYR 139           HE1      TYR 139 -13.129  10.820  10.684
 1064    HE2  TYR 139           HE2      TYR 139 -13.795  11.435   6.489
 1065    HH   TYR 139            HH      TYR 139 -15.422  11.135   9.189
   
  Start of MODEL           2
 Raw file had 1065 H/Q atoms
  Start of MODEL    2
    1   1H    ALA   1            2H      ALA   1 -19.781  15.175   4.762
    2   2H    ALA   1            1H      ALA   1 -21.434  14.878   5.027
    3   3H    ALA   1            3H      ALA   1 -20.669  14.237   3.658
    4    HA   ALA   1            HA      ALA   1 -21.824  16.050   2.818
    5   1HB   ALA   1           2HB      ALA   1 -22.026  16.873   5.358
    6   2HB   ALA   1           1HB      ALA   1 -20.735  17.959   4.839
    7   3HB   ALA   1           3HB      ALA   1 -22.287  17.974   4.005
    8    H    GLY   2             H      GLY   2 -18.988  14.985   2.751
    9   1HA   GLY   2           2HA      GLY   2 -17.782  17.278   1.276
   10   2HA   GLY   2           1HA      GLY   2 -16.807  16.449   2.487
   11    CH2  TRP   3           CH2      TRP   3 -12.997  11.339   3.645
   12    H    TRP   3             H      TRP   3 -17.795  13.782   1.909
   13    HA   TRP   3            HA      TRP   3 -16.017  12.767   0.103
   14   1HB   TRP   3           2HB      TRP   3 -18.581  11.887   1.044
   15   2HB   TRP   3           1HB      TRP   3 -17.812  10.980  -0.221
   16    HD1  TRP   3           HD1      TRP   3 -18.054   9.334   2.056
   17    HE1  TRP   3           HE1      TRP   3 -16.216   8.655   3.696
   18    HE3  TRP   3           HE3      TRP   3 -14.632  13.153   1.284
   19    HZ2  TRP   3           HZ2      TRP   3 -13.698   9.545   4.570
   20    HZ3  TRP   3           HZ3      TRP   3 -12.546  13.129   2.559
   21    HH2  TRP   3           HH2      TRP   3 -12.071  11.349   4.199
   22    H    ASN   4             H      ASN   4 -19.386  13.638  -0.715
   23    HA   ASN   4            HA      ASN   4 -19.318  12.866  -3.450
   24   1HB   ASN   4           2HB      ASN   4 -21.240  14.447  -3.741
   25   2HB   ASN   4           1HB      ASN   4 -21.423  13.378  -2.349
   26   1HD2  ASN   4          2HD2      ASN   4 -21.832  16.129  -0.202
   27   2HD2  ASN   4          1HD2      ASN   4 -22.283  14.549  -0.629
   28    H    ALA   5             H      ALA   5 -17.992  15.659  -1.954
   29    HA   ALA   5            HA      ALA   5 -17.687  17.292  -4.364
   30   1HB   ALA   5           2HB      ALA   5 -16.937  17.506  -1.502
   31   2HB   ALA   5           1HB      ALA   5 -15.739  18.186  -2.601
   32   3HB   ALA   5           3HB      ALA   5 -17.402  18.772  -2.638
   33    OH   TYR   6            OH      TYR   6 -13.231  17.658   1.324
   34    H    TYR   6             H      TYR   6 -15.734  14.954  -2.489
   35    HA   TYR   6            HA      TYR   6 -13.419  15.210  -4.276
   36   1HB   TYR   6           2HB      TYR   6 -13.992  12.915  -2.387
   37   2HB   TYR   6           1HB      TYR   6 -12.422  13.413  -3.026
   38    HD1  TYR   6           HD1      TYR   6 -11.601  15.797  -2.500
   39    HD2  TYR   6           HD2      TYR   6 -14.863  13.924  -0.575
   40    HE1  TYR   6           HE1      TYR   6 -11.562  17.548  -0.736
   41    HE2  TYR   6           HE2      TYR   6 -14.828  15.597   1.219
   42    HH   TYR   6            HH      TYR   6 -13.096  18.503   0.892
   43    H    ILE   7             H      ILE   7 -16.476  13.859  -4.539
   44    HA   ILE   7            HA      ILE   7 -15.721  11.913  -6.617
   45    HB   ILE   7            HB      ILE   7 -18.273  12.577  -5.216
   46   1HG1  ILE   7          2HG1      ILE   7 -16.503  10.882  -4.476
   47   2HG1  ILE   7          1HG1      ILE   7 -18.160  10.295  -4.554
   48   1HG2  ILE   7          3HG2      ILE   7 -17.959  11.512  -7.955
   49   2HG2  ILE   7          2HG2      ILE   7 -19.127  10.696  -6.911
   50   3HG2  ILE   7          1HG2      ILE   7 -19.303  12.418  -7.258
   51   1HD1  ILE   7          3HD1      ILE   7 -16.733  10.005  -7.080
   52   2HD1  ILE   7          2HD1      ILE   7 -15.951   9.139  -5.765
   53   3HD1  ILE   7          1HD1      ILE   7 -17.632   8.806  -6.162
   54    H    ASP   8             H      ASP   8 -16.928  15.145  -6.059
   55    HA   ASP   8            HA      ASP   8 -17.732  15.849  -8.668
   56   1HB   ASP   8           2HB      ASP   8 -17.178  17.240  -6.168
   57   2HB   ASP   8           1HB      ASP   8 -17.143  18.209  -7.586
   58    H    ASN   9             H      ASN   9 -14.739  15.304  -7.194
   59    HA   ASN   9            HA      ASN   9 -12.895  16.821  -8.556
   60   1HB   ASN   9           2HB      ASN   9 -11.753  15.544  -7.081
   61   2HB   ASN   9           1HB      ASN   9 -13.036  14.551  -6.831
   62   1HD2  ASN   9          2HD2      ASN   9 -11.370  11.580  -8.309
   63   2HD2  ASN   9          1HD2      ASN   9 -12.500  12.200  -7.186
   64    H    LEU  10             H      LEU  10 -14.450  14.019  -9.339
   65    HA   LEU  10            HA      LEU  10 -13.140  13.284 -11.728
   66   1HB   LEU  10           2HB      LEU  10 -15.766  12.586 -10.542
   67   2HB   LEU  10           1HB      LEU  10 -15.115  11.795 -11.939
   68    HG   LEU  10            HG      LEU  10 -14.446  10.398 -10.394
   69   1HD1  LEU  10          1HD1      LEU  10 -12.351  11.124 -11.390
   70   2HD1  LEU  10          3HD1      LEU  10 -12.200  12.387 -10.183
   71   3HD1  LEU  10          2HD1      LEU  10 -12.086  10.709  -9.711
   72   1HD2  LEU  10          2HD2      LEU  10 -14.282  12.666  -8.411
   73   2HD2  LEU  10          1HD2      LEU  10 -15.503  11.432  -8.457
   74   3HD2  LEU  10          3HD2      LEU  10 -13.858  11.071  -7.992
   75    H    MET  11             H      MET  11 -15.989  14.830 -10.795
   76    HA   MET  11            HA      MET  11 -16.947  14.920 -13.523
   77   1HB   MET  11           2HB      MET  11 -17.812  16.402 -11.010
   78   2HB   MET  11           1HB      MET  11 -18.786  16.141 -12.465
   79   1HG   MET  11           2HG      MET  11 -17.563  13.604 -11.072
   80   2HG   MET  11           1HG      MET  11 -19.033  14.379 -10.387
   81   1HE   MET  11           2HE      MET  11 -17.225  12.690 -12.843
   82   2HE   MET  11           1HE      MET  11 -18.387  11.520 -13.463
   83   3HE   MET  11           3HE      MET  11 -18.010  12.979 -14.393
   84    H    ALA  12             H      ALA  12 -14.901  16.915 -11.537
   85    HA   ALA  12            HA      ALA  12 -14.820  19.229 -13.258
   86   1HB   ALA  12           2HB      ALA  12 -13.474  18.451 -10.694
   87   2HB   ALA  12           1HB      ALA  12 -12.984  19.897 -11.599
   88   3HB   ALA  12           3HB      ALA  12 -14.634  19.764 -10.988
   89    H    ASP  13             H      ASP  13 -12.742  16.455 -12.749
   90    HA   ASP  13            HA      ASP  13 -10.328  17.509 -13.936
   91   1HB   ASP  13           2HB      ASP  13  -9.757  14.882 -14.124
   92   2HB   ASP  13           1HB      ASP  13  -9.659  15.761 -12.621
   93    H    GLY  14             H      GLY  14 -13.046  16.645 -15.719
   94   1HA   GLY  14           2HA      GLY  14 -13.286  15.750 -17.982
   95   2HA   GLY  14           1HA      GLY  14 -12.228  17.126 -18.280
   96    H    THR  15             H      THR  15 -11.288  14.198 -16.585
   97    HA   THR  15            HA      THR  15  -9.631  13.115 -18.744
   98    HB   THR  15            HB      THR  15  -8.632  14.095 -16.096
   99    HG1  THR  15           HG1      THR  15  -7.505  15.428 -17.304
  100   1HG2  THR  15          1HG2      THR  15  -7.462  12.090 -18.014
  101   2HG2  THR  15          3HG2      THR  15  -6.493  12.934 -16.783
  102   3HG2  THR  15          2HG2      THR  15  -7.836  11.883 -16.301
  103    H    CYS  16             H      CYS  16 -10.896  12.866 -15.520
  104    HA   CYS  16            HA      CYS  16 -10.371  10.109 -15.134
  105   1HB   CYS  16           2HB      CYS  16 -11.418  10.549 -13.047
  106   2HB   CYS  16           1HB      CYS  16 -11.097  12.164 -13.531
  107    HG   CYS  16            HG      CYS  16 -13.878  10.842 -13.976
  108    H    GLN  17             H      GLN  17 -12.679   8.947 -14.524
  109    HA   GLN  17            HA      GLN  17 -14.737   9.242 -16.523
  110   1HB   GLN  17           2HB      GLN  17 -12.887   7.676 -17.388
  111   2HB   GLN  17           1HB      GLN  17 -13.535   6.532 -16.226
  112   1HG   GLN  17           2HG      GLN  17 -15.535   7.917 -17.922
  113   2HG   GLN  17           1HG      GLN  17 -14.488   6.779 -18.754
  114   1HE2  GLN  17          2HE2      GLN  17 -17.511   4.993 -17.340
  115   2HE2  GLN  17          1HE2      GLN  17 -17.328   6.348 -18.344
  116    H    ASP  18             H      ASP  18 -13.327   7.361 -13.883
  117    HA   ASP  18            HA      ASP  18 -15.900   7.401 -12.444
  118   1HB   ASP  18           2HB      ASP  18 -15.234   5.118 -13.558
  119   2HB   ASP  18           1HB      ASP  18 -14.245   4.971 -12.124
  120    H    ALA  19             H      ALA  19 -15.259   6.435 -10.044
  121    HA   ALA  19            HA      ALA  19 -12.674   7.456  -9.011
  122   1HB   ALA  19           2HB      ALA  19 -15.088   9.095  -9.284
  123   2HB   ALA  19           1HB      ALA  19 -14.354   9.059  -7.653
  124   3HB   ALA  19           3HB      ALA  19 -13.371   9.471  -9.041
  125    H    ALA  20             H      ALA  20 -12.381   6.336  -6.984
  126    HA   ALA  20            HA      ALA  20 -14.954   5.776  -5.536
  127   1HB   ALA  20           3HB      ALA  20 -13.092   3.658  -6.451
  128   2HB   ALA  20           2HB      ALA  20 -14.103   3.422  -5.012
  129   3HB   ALA  20           1HB      ALA  20 -14.841   3.761  -6.588
  130    H    ILE  21             H      ILE  21 -14.742   6.655  -3.672
  131    HA   ILE  21            HA      ILE  21 -12.216   6.443  -2.137
  132    HB   ILE  21            HB      ILE  21 -14.884   7.691  -1.349
  133   1HG1  ILE  21          2HG1      ILE  21 -12.352   8.809  -2.600
  134   2HG1  ILE  21          1HG1      ILE  21 -13.994   8.915  -3.222
  135   1HG2  ILE  21          3HG2      ILE  21 -12.092   7.714  -0.108
  136   2HG2  ILE  21          2HG2      ILE  21 -13.386   8.803   0.411
  137   3HG2  ILE  21          1HG2      ILE  21 -13.560   7.054   0.611
  138   1HD1  ILE  21          3HD1      ILE  21 -14.241  10.082  -0.750
  139   2HD1  ILE  21          2HD1      ILE  21 -12.624  10.582  -1.247
  140   3HD1  ILE  21          1HD1      ILE  21 -14.016  10.958  -2.265
  141    H    VAL  22             H      VAL  22 -12.104   4.695  -0.623
  142    HA   VAL  22            HA      VAL  22 -14.657   3.182  -0.244
  143    HB   VAL  22            HB      VAL  22 -11.945   2.005  -0.915
  144   1HG1  VAL  22          1HG1      VAL  22 -13.956   0.758   0.423
  145   2HG1  VAL  22          3HG1      VAL  22 -14.430   0.428  -1.242
  146   3HG1  VAL  22          2HG1      VAL  22 -12.841  -0.079  -0.656
  147   1HG2  VAL  22          3HG2      VAL  22 -13.013   3.292  -2.791
  148   2HG2  VAL  22          2HG2      VAL  22 -12.893   1.561  -3.129
  149   3HG2  VAL  22          1HG2      VAL  22 -14.436   2.257  -2.638
  150    H    GLY  23             H      GLY  23 -15.038   3.208   2.020
  151   1HA   GLY  23           2HA      GLY  23 -12.942   3.335   4.030
  152   2HA   GLY  23           1HA      GLY  23 -14.629   2.889   4.339
  153    OH   TYR  24            OH      TYR  24  -5.606   1.335   5.077
  154    H    TYR  24             H      TYR  24 -11.550   1.671   3.309
  155    HA   TYR  24            HA      TYR  24 -12.334  -1.093   3.083
  156   1HB   TYR  24           2HB      TYR  24 -10.191  -1.430   2.129
  157   2HB   TYR  24           1HB      TYR  24 -10.606   0.197   1.644
  158    HD1  TYR  24           HD2      TYR  24 -10.060   1.610   4.361
  159    HD2  TYR  24           HD1      TYR  24  -7.845  -1.315   2.138
  160    HE1  TYR  24           HE2      TYR  24  -8.007   2.351   5.476
  161    HE2  TYR  24           HE1      TYR  24  -5.780  -0.585   3.255
  162    HH   TYR  24            HH      TYR  24  -5.487   0.781   5.853
  163    H    LYS  25             H      LYS  25 -12.637   0.003   5.812
  164    HA   LYS  25            HA      LYS  25 -10.509  -0.730   7.533
  165   1HB   LYS  25           2HB      LYS  25 -13.414  -0.348   7.943
  166   2HB   LYS  25           1HB      LYS  25 -12.382  -0.820   9.258
  167   1HG   LYS  25           2HG      LYS  25 -12.447   1.528   9.402
  168   2HG   LYS  25           1HG      LYS  25 -10.919   1.180   8.593
  169   1HD   LYS  25           2HD      LYS  25 -11.763   1.746   6.493
  170   2HD   LYS  25           1HD      LYS  25 -13.437   1.656   7.043
  171   1HE   LYS  25           2HE      LYS  25 -11.399   3.668   7.987
  172   2HE   LYS  25           1HE      LYS  25 -12.680   3.983   6.829
  173   1HZ   LYS  25           2HZ      LYS  25 -14.191   3.055   8.698
  174   2HZ   LYS  25           1HZ      LYS  25 -12.885   3.446   9.710
  175   3HZ   LYS  25           3HZ      LYS  25 -13.637   4.656   8.800
  176    H    ASP  26             H      ASP  26 -11.906  -2.531   9.323
  177    HA   ASP  26            HA      ASP  26 -11.106  -5.104   8.561
  178   1HB   ASP  26           2HB      ASP  26 -13.221  -5.873   9.917
  179   2HB   ASP  26           1HB      ASP  26 -11.859  -5.168  10.749
  180    H    SER  27             H      SER  27 -14.370  -3.812   8.225
  181    HA   SER  27            HA      SER  27 -14.907  -5.640   5.977
  182   1HB   SER  27           2HB      SER  27 -17.259  -4.731   6.395
  183   2HB   SER  27           1HB      SER  27 -16.640  -5.842   7.585
  184    HG   SER  27            HG      SER  27 -17.578  -3.478   8.037
  185    HA   PRO  28            HA      PRO  28 -14.110  -1.876   3.709
  186   1HB   PRO  28           2HB      PRO  28 -14.333  -2.953   1.205
  187   2HB   PRO  28           1HB      PRO  28 -12.883  -3.085   2.216
  188   1HG   PRO  28           2HG      PRO  28 -14.900  -5.153   1.600
  189   2HG   PRO  28           1HG      PRO  28 -13.244  -5.332   2.114
  190   1HD   PRO  28           2HD      PRO  28 -15.538  -5.644   3.699
  191   2HD   PRO  28           1HD      PRO  28 -13.851  -5.613   4.255
  192    H    SER  29             H      SER  29 -15.252  -0.461   2.241
  193    HA   SER  29            HA      SER  29 -17.859  -1.068   1.274
  194   1HB   SER  29           2HB      SER  29 -19.101   0.519   2.697
  195   2HB   SER  29           1HB      SER  29 -18.430  -0.799   3.652
  196    HG   SER  29            HG      SER  29 -16.709   0.578   4.211
  197    H    VAL  30             H      VAL  30 -18.700   0.700   0.040
  198    HA   VAL  30            HA      VAL  30 -16.580   2.412  -0.965
  199    HB   VAL  30            HB      VAL  30 -19.376   1.725  -1.828
  200   1HG1  VAL  30          2HG1      VAL  30 -18.886   4.131  -2.373
  201   2HG1  VAL  30          1HG1      VAL  30 -17.434   3.595  -3.220
  202   3HG1  VAL  30          3HG1      VAL  30 -19.023   3.110  -3.806
  203   1HG2  VAL  30          2HG2      VAL  30 -17.501   0.118  -2.104
  204   2HG2  VAL  30          1HG2      VAL  30 -18.137   0.669  -3.631
  205   3HG2  VAL  30          3HG2      VAL  30 -16.633   1.333  -3.038
  206    CH2  TRP  31           CH2      TRP  31 -13.826   6.153   6.766
  207    H    TRP  31             H      TRP  31 -16.231   4.103   0.338
  208    HA   TRP  31            HA      TRP  31 -18.206   5.465   1.879
  209   1HB   TRP  31           2HB      TRP  31 -15.308   5.815   1.255
  210   2HB   TRP  31           1HB      TRP  31 -16.175   7.206   1.906
  211    HD1  TRP  31           HD1      TRP  31 -17.610   3.985   3.114
  212    HE1  TRP  31           HE1      TRP  31 -16.911   3.550   5.505
  213    HE3  TRP  31           HE3      TRP  31 -13.932   7.501   3.646
  214    HZ2  TRP  31           HZ2      TRP  31 -15.074   4.540   7.455
  215    HZ3  TRP  31           HZ3      TRP  31 -12.738   7.730   5.801
  216    HH2  TRP  31           HH2      TRP  31 -13.296   6.255   7.701
  217    H    ALA  32             H      ALA  32 -16.993   5.835  -1.369
  218    HA   ALA  32            HA      ALA  32 -19.141   7.481  -2.209
  219   1HB   ALA  32           2HB      ALA  32 -16.636   9.010  -1.454
  220   2HB   ALA  32           1HB      ALA  32 -17.862   9.662  -2.572
  221   3HB   ALA  32           3HB      ALA  32 -18.292   9.276  -0.899
  222    H    ALA  33             H      ALA  33 -18.867   5.873  -3.867
  223    HA   ALA  33            HA      ALA  33 -16.770   6.574  -5.848
  224   1HB   ALA  33           3HB      ALA  33 -18.185   3.908  -5.486
  225   2HB   ALA  33           2HB      ALA  33 -16.982   4.276  -6.724
  226   3HB   ALA  33           1HB      ALA  33 -16.513   4.246  -5.024
  227    H    VAL  34             H      VAL  34 -17.537   7.240  -7.797
  228    HA   VAL  34            HA      VAL  34 -20.121   8.159  -8.288
  229    HB   VAL  34            HB      VAL  34 -18.279   6.989 -10.423
  230   1HG1  VAL  34          2HG1      VAL  34 -20.834   7.899 -10.728
  231   2HG1  VAL  34          1HG1      VAL  34 -19.930   9.420 -10.913
  232   3HG1  VAL  34          3HG1      VAL  34 -19.594   8.037 -11.971
  233   1HG2  VAL  34          3HG2      VAL  34 -18.340   9.714  -9.059
  234   2HG2  VAL  34          2HG2      VAL  34 -16.997   8.570  -9.109
  235   3HG2  VAL  34          1HG2      VAL  34 -17.489   9.406 -10.576
  236    HA   PRO  35            HA      PRO  35 -22.009   4.011  -8.140
  237   1HB   PRO  35           2HB      PRO  35 -24.605   4.888  -7.844
  238   2HB   PRO  35           1HB      PRO  35 -23.459   4.701  -6.504
  239   1HG   PRO  35           2HG      PRO  35 -24.351   7.211  -7.886
  240   2HG   PRO  35           1HG      PRO  35 -23.865   6.973  -6.197
  241   1HD   PRO  35           2HD      PRO  35 -22.225   8.104  -8.156
  242   2HD   PRO  35           1HD      PRO  35 -21.631   7.354  -6.658
  243    H    GLY  36             H      GLY  36 -22.564   2.795  -9.838
  244   1HA   GLY  36           2HA      GLY  36 -24.326   2.537 -11.665
  245   2HA   GLY  36           1HA      GLY  36 -23.797   4.133 -12.206
  246    H    LYS  37             H      LYS  37 -20.913   3.414 -11.471
  247    HA   LYS  37            HA      LYS  37 -20.329   2.112 -14.059
  248   1HB   LYS  37           2HB      LYS  37 -18.446   3.406 -12.074
  249   2HB   LYS  37           1HB      LYS  37 -18.006   2.835 -13.683
  250   1HG   LYS  37           2HG      LYS  37 -19.939   5.089 -13.007
  251   2HG   LYS  37           1HG      LYS  37 -18.409   5.225 -13.861
  252   1HD   LYS  37           2HD      LYS  37 -19.343   3.833 -15.711
  253   2HD   LYS  37           1HD      LYS  37 -20.891   3.801 -14.869
  254   1HE   LYS  37           2HE      LYS  37 -19.481   6.336 -15.742
  255   2HE   LYS  37           1HE      LYS  37 -20.786   5.561 -16.641
  256   1HZ   LYS  37           1HZ      LYS  37 -21.954   5.707 -14.303
  257   2HZ   LYS  37           3HZ      LYS  37 -20.880   7.003 -14.094
  258   3HZ   LYS  37           2HZ      LYS  37 -21.982   7.015 -15.389
  259    H    THR  38             H      THR  38 -18.014   1.602 -11.368
  260    HA   THR  38            HA      THR  38 -18.777  -1.258 -11.212
  261    HB   THR  38            HB      THR  38 -16.503  -0.199 -12.760
  262    HG1  THR  38           HG1      THR  38 -17.955  -2.596 -12.964
  263   1HG2  THR  38          2HG2      THR  38 -16.306  -2.814 -11.264
  264   2HG2  THR  38          1HG2      THR  38 -15.236  -2.348 -12.580
  265   3HG2  THR  38          3HG2      THR  38 -15.232  -1.434 -11.072
  266    H    PHE  39             H      PHE  39 -16.384   1.181 -10.163
  267    HA   PHE  39            HA      PHE  39 -15.117  -0.306  -8.097
  268   1HB   PHE  39           2HB      PHE  39 -15.714   2.629  -8.245
  269   2HB   PHE  39           1HB      PHE  39 -14.621   1.872  -7.092
  270    HD1  PHE  39           HD2      PHE  39 -14.294  -0.037 -10.042
  271    HD2  PHE  39           HD1      PHE  39 -13.231   3.781  -8.402
  272    HE1  PHE  39           HE2      PHE  39 -12.452   0.143 -11.667
  273    HE2  PHE  39           HE1      PHE  39 -11.370   3.967 -10.018
  274    HZ   PHE  39            HZ      PHE  39 -10.998   2.126 -11.655
  275    H    VAL  40             H      VAL  40 -18.006   1.672  -7.914
  276    HA   VAL  40            HA      VAL  40 -18.412   1.729  -5.154
  277    HB   VAL  40            HB      VAL  40 -19.792   3.164  -6.452
  278   1HG1  VAL  40          3HG1      VAL  40 -20.478   0.650  -7.960
  279   2HG1  VAL  40          2HG1      VAL  40 -21.473   2.103  -8.080
  280   3HG1  VAL  40          1HG1      VAL  40 -19.774   2.155  -8.573
  281   1HG2  VAL  40          1HG2      VAL  40 -20.886   1.489  -4.566
  282   2HG2  VAL  40          3HG2      VAL  40 -21.736   2.857  -5.292
  283   3HG2  VAL  40          2HG2      VAL  40 -21.971   1.231  -5.934
  284    H    ASN  41             H      ASN  41 -18.748  -0.898  -7.389
  285    HA   ASN  41            HA      ASN  41 -20.297  -2.547  -5.546
  286   1HB   ASN  41           2HB      ASN  41 -19.312  -2.796  -8.356
  287   2HB   ASN  41           1HB      ASN  41 -19.764  -4.224  -7.451
  288   1HD2  ASN  41          2HD2      ASN  41 -23.234  -3.532  -7.512
  289   2HD2  ASN  41          1HD2      ASN  41 -22.013  -4.507  -6.850
  290    H    ILE  42             H      ILE  42 -17.521  -1.519  -4.868
  291    HA   ILE  42            HA      ILE  42 -15.670  -3.666  -5.181
  292    HB   ILE  42            HB      ILE  42 -15.752  -1.011  -3.764
  293   1HG1  ILE  42          2HG1      ILE  42 -13.382  -2.195  -5.168
  294   2HG1  ILE  42          1HG1      ILE  42 -14.811  -1.806  -6.127
  295   1HG2  ILE  42          3HG2      ILE  42 -14.904  -2.542  -1.972
  296   2HG2  ILE  42          2HG2      ILE  42 -13.630  -3.080  -3.059
  297   3HG2  ILE  42          1HG2      ILE  42 -13.679  -1.405  -2.518
  298   1HD1  ILE  42          3HD1      ILE  42 -14.624   0.471  -4.691
  299   2HD1  ILE  42          2HD1      ILE  42 -12.920   0.014  -4.726
  300   3HD1  ILE  42          1HD1      ILE  42 -13.801   0.251  -6.242
  301    H    THR  43             H      THR  43 -14.737  -4.703  -3.234
  302    HA   THR  43            HA      THR  43 -16.369  -5.393  -0.884
  303    HB   THR  43            HB      THR  43 -16.210  -7.851  -1.634
  304    HG1  THR  43           HG1      THR  43 -15.471  -8.318  -3.527
  305   1HG2  THR  43          3HG2      THR  43 -18.264  -6.401  -1.868
  306   2HG2  THR  43          2HG2      THR  43 -17.751  -6.123  -3.532
  307   3HG2  THR  43          1HG2      THR  43 -18.167  -7.752  -3.000
  308    HA   PRO  44            HA      PRO  44 -12.232  -6.243   0.681
  309   1HB   PRO  44           2HB      PRO  44 -12.305  -8.638   1.899
  310   2HB   PRO  44           1HB      PRO  44 -12.926  -7.173   2.621
  311   1HG   PRO  44           2HG      PRO  44 -14.433  -9.452   1.400
  312   2HG   PRO  44           1HG      PRO  44 -14.941  -8.335   2.680
  313   1HD   PRO  44           2HD      PRO  44 -15.763  -8.175   0.030
  314   2HD   PRO  44           1HD      PRO  44 -15.846  -6.832   1.168
  315    H    ALA  45             H      ALA  45 -13.386  -8.079  -1.757
  316    HA   ALA  45            HA      ALA  45 -11.098  -9.845  -2.149
  317   1HB   ALA  45           2HB      ALA  45 -13.723  -9.390  -3.468
  318   2HB   ALA  45           1HB      ALA  45 -12.426 -10.105  -4.430
  319   3HB   ALA  45           3HB      ALA  45 -12.982 -10.915  -2.966
  320    H    GLU  46             H      GLU  46 -12.741  -7.521  -4.159
  321    HA   GLU  46            HA      GLU  46 -10.497  -6.931  -5.872
  322   1HB   GLU  46           2HB      GLU  46 -11.847  -4.635  -6.135
  323   2HB   GLU  46           1HB      GLU  46 -12.393  -6.096  -6.912
  324   1HG   GLU  46           2HG      GLU  46 -13.368  -5.726  -4.167
  325   2HG   GLU  46           1HG      GLU  46 -13.889  -4.475  -5.283
  326    H    VAL  47             H      VAL  47 -11.480  -5.658  -2.757
  327    HA   VAL  47            HA      VAL  47  -9.400  -3.625  -2.669
  328    HB   VAL  47            HB      VAL  47 -11.738  -4.240  -1.061
  329   1HG1  VAL  47          1HG1      VAL  47 -10.003  -4.616   0.628
  330   2HG1  VAL  47          3HG1      VAL  47  -9.372  -3.028   0.211
  331   3HG1  VAL  47          2HG1      VAL  47 -10.971  -3.166   0.924
  332   1HG2  VAL  47          3HG2      VAL  47 -11.231  -2.218  -2.533
  333   2HG2  VAL  47          2HG2      VAL  47 -11.890  -1.886  -0.927
  334   3HG2  VAL  47          1HG2      VAL  47 -10.133  -1.720  -1.216
  335    H    GLY  48             H      GLY  48  -9.817  -6.934  -1.779
  336   1HA   GLY  48           2HA      GLY  48  -7.769  -7.265   0.154
  337   2HA   GLY  48           1HA      GLY  48  -8.296  -8.507  -0.971
  338    H    VAL  49             H      VAL  49  -7.661  -6.800  -3.293
  339    HA   VAL  49            HA      VAL  49  -4.751  -7.312  -3.359
  340    HB   VAL  49            HB      VAL  49  -6.113  -8.342  -5.155
  341   1HG1  VAL  49          2HG1      VAL  49  -6.664  -5.442  -5.822
  342   2HG1  VAL  49          1HG1      VAL  49  -6.845  -6.735  -7.001
  343   3HG1  VAL  49          3HG1      VAL  49  -7.838  -6.725  -5.544
  344   1HG2  VAL  49          3HG2      VAL  49  -4.108  -6.225  -5.983
  345   2HG2  VAL  49          2HG2      VAL  49  -3.755  -7.886  -5.524
  346   3HG2  VAL  49          1HG2      VAL  49  -4.642  -7.554  -7.012
  347    H    LEU  50             H      LEU  50  -7.017  -4.706  -3.779
  348    HA   LEU  50            HA      LEU  50  -5.181  -2.647  -4.576
  349   1HB   LEU  50           2HB      LEU  50  -7.898  -2.849  -3.554
  350   2HB   LEU  50           1HB      LEU  50  -7.144  -1.341  -3.330
  351    HG   LEU  50            HG      LEU  50  -7.244  -2.654  -6.006
  352   1HD1  LEU  50          3HD1      LEU  50  -9.388  -1.271  -4.408
  353   2HD1  LEU  50          2HD1      LEU  50  -9.234  -0.813  -6.112
  354   3HD1  LEU  50          1HD1      LEU  50  -9.545  -2.494  -5.684
  355   1HD2  LEU  50          1HD2      LEU  50  -5.762  -0.625  -5.423
  356   2HD2  LEU  50          3HD2      LEU  50  -6.858  -0.415  -6.786
  357   3HD2  LEU  50          2HD2      LEU  50  -7.262   0.273  -5.212
  358    H    VAL  51             H      VAL  51  -5.718  -4.238  -1.636
  359    HA   VAL  51            HA      VAL  51  -4.101  -2.257  -0.129
  360    HB   VAL  51            HB      VAL  51  -5.844  -1.777   1.432
  361   1HG1  VAL  51          1HG1      VAL  51  -7.338  -2.494  -1.091
  362   2HG1  VAL  51          3HG1      VAL  51  -8.036  -1.601   0.245
  363   3HG1  VAL  51          2HG1      VAL  51  -6.686  -0.922  -0.646
  364   1HG2  VAL  51          3HG2      VAL  51  -6.719  -4.580   0.908
  365   2HG2  VAL  51          2HG2      VAL  51  -6.602  -3.709   2.436
  366   3HG2  VAL  51          1HG2      VAL  51  -7.985  -3.434   1.370
  367    H    GLY  52             H      GLY  52  -4.730  -5.526  -0.839
  368   1HA   GLY  52           2HA      GLY  52  -4.383  -7.033   1.411
  369   2HA   GLY  52           1HA      GLY  52  -3.682  -7.469  -0.143
  370    H    LYS  53             H      LYS  53  -2.853  -7.332   2.822
  371    HA   LYS  53            HA      LYS  53  -0.639  -5.681   3.145
  372   1HB   LYS  53           2HB      LYS  53   0.165  -7.376   4.818
  373   2HB   LYS  53           1HB      LYS  53  -1.506  -6.864   5.054
  374   1HG   LYS  53           2HG      LYS  53  -1.850  -9.130   5.158
  375   2HG   LYS  53           1HG      LYS  53  -1.942  -8.953   3.411
  376   1HD   LYS  53           2HD      LYS  53  -0.124 -10.261   3.127
  377   2HD   LYS  53           1HD      LYS  53   0.831  -9.208   4.173
  378   1HE   LYS  53           2HE      LYS  53  -1.085 -11.295   5.257
  379   2HE   LYS  53           1HE      LYS  53   0.625 -11.626   4.960
  380   1HZ   LYS  53           2HZ      LYS  53   1.155  -9.728   6.418
  381   2HZ   LYS  53           1HZ      LYS  53  -0.499  -9.562   6.775
  382   3HZ   LYS  53           3HZ      LYS  53   0.329 -10.971   7.232
  383    H    ASP  54             H      ASP  54  -0.975  -8.405   1.096
  384    HA   ASP  54            HA      ASP  54   1.508  -9.495   0.809
  385   1HB   ASP  54           2HB      ASP  54  -0.739  -9.903  -0.461
  386   2HB   ASP  54           1HB      ASP  54  -0.007  -8.843  -1.645
  387    NH1  ARG  55           NH1      ARG  55   6.054 -11.240   0.967
  388    NH2  ARG  55           NH2      ARG  55   6.576 -11.170   3.164
  389    H    ARG  55             H      ARG  55   3.360  -8.681   0.188
  390    HA   ARG  55            HA      ARG  55   3.517  -5.992  -0.878
  391   1HB   ARG  55           2HB      ARG  55   5.702  -5.828   0.249
  392   2HB   ARG  55           1HB      ARG  55   4.436  -6.276   1.390
  393   1HG   ARG  55           2HG      ARG  55   5.511  -8.681   0.199
  394   2HG   ARG  55           1HG      ARG  55   6.841  -7.702   0.816
  395   1HD   ARG  55           2HD      ARG  55   6.325  -8.243   2.945
  396   2HD   ARG  55           1HD      ARG  55   4.657  -7.720   2.729
  397    HE   ARG  55            HE      ARG  55   4.051  -9.986   2.454
  398   1HH1  ARG  55          2HH1      ARG  55   5.522 -10.903   0.192
  399   2HH1  ARG  55          1HH1      ARG  55   6.723 -11.971   0.834
  400   1HH2  ARG  55          1HH2      ARG  55   6.444 -10.781   4.076
  401   2HH2  ARG  55          2HH2      ARG  55   7.248 -11.900   3.026
  402    H    SER  56             H      SER  56   3.287  -8.394  -2.649
  403    HA   SER  56            HA      SER  56   5.466  -7.692  -4.440
  404   1HB   SER  56           2HB      SER  56   6.596  -9.094  -2.667
  405   2HB   SER  56           1HB      SER  56   5.725 -10.469  -3.336
  406    HG   SER  56            HG      SER  56   6.700  -9.968  -5.356
  407    H    SER  57             H      SER  57   2.602  -9.433  -3.925
  408    HA   SER  57            HA      SER  57   2.730 -11.017  -6.318
  409   1HB   SER  57           2HB      SER  57   0.254 -11.374  -5.771
  410   2HB   SER  57           1HB      SER  57   1.443 -12.012  -4.646
  411    HG   SER  57            HG      SER  57  -0.414 -10.646  -3.835
  412    H    PHE  58             H      PHE  58  -0.164  -9.200  -5.858
  413    HA   PHE  58            HA      PHE  58  -0.743  -8.568  -8.448
  414   1HB   PHE  58           2HB      PHE  58  -1.991  -6.551  -7.666
  415   2HB   PHE  58           1HB      PHE  58  -2.353  -8.056  -6.856
  416    HD1  PHE  58           HD2      PHE  58  -1.523  -8.489  -4.552
  417    HD2  PHE  58           HD1      PHE  58  -0.981  -4.700  -6.516
  418    HE1  PHE  58           HE2      PHE  58  -1.069  -7.412  -2.370
  419    HE2  PHE  58           HE1      PHE  58  -0.538  -3.637  -4.316
  420    HZ   PHE  58            HZ      PHE  58  -0.577  -4.996  -2.256
  421    OH   TYR  59            OH      TYR  59   2.044  -3.356  -2.222
  422    H    TYR  59             H      TYR  59   1.900  -6.933  -6.796
  423    HA   TYR  59            HA      TYR  59   1.919  -4.612  -8.383
  424   1HB   TYR  59           2HB      TYR  59   4.349  -5.976  -7.267
  425   2HB   TYR  59           1HB      TYR  59   4.249  -4.307  -7.816
  426    HD1  TYR  59           HD1      TYR  59   1.850  -3.256  -6.773
  427    HD2  TYR  59           HD2      TYR  59   4.556  -6.013  -4.937
  428    HE1  TYR  59           HE1      TYR  59   1.132  -2.459  -4.534
  429    HE2  TYR  59           HE2      TYR  59   3.838  -5.231  -2.696
  430    HH   TYR  59            HH      TYR  59   2.612  -2.625  -1.972
  431    H    VAL  60             H      VAL  60   2.172  -7.619  -9.599
  432    HA   VAL  60            HA      VAL  60   3.659  -6.682 -11.939
  433    HB   VAL  60            HB      VAL  60   3.943  -9.315 -12.167
  434   1HG1  VAL  60          2HG1      VAL  60   5.704  -7.540 -12.058
  435   2HG1  VAL  60          1HG1      VAL  60   5.625  -7.645 -10.298
  436   3HG1  VAL  60          3HG1      VAL  60   6.173  -9.033 -11.241
  437   1HG2  VAL  60          3HG2      VAL  60   2.677  -9.752 -10.033
  438   2HG2  VAL  60          2HG2      VAL  60   4.318 -10.403 -10.011
  439   3HG2  VAL  60          1HG2      VAL  60   3.953  -8.893  -9.164
  440    H    ASN  61             H      ASN  61   0.801  -8.479 -10.774
  441    HA   ASN  61            HA      ASN  61  -0.017  -8.983 -13.511
  442   1HB   ASN  61           2HB      ASN  61  -1.940 -10.150 -12.416
  443   2HB   ASN  61           1HB      ASN  61  -0.386 -10.829 -12.081
  444   1HD2  ASN  61          2HD2      ASN  61  -0.696 -10.485  -8.655
  445   2HD2  ASN  61          1HD2      ASN  61   0.169 -11.127  -9.965
  446    H    GLY  62             H      GLY  62  -1.299  -7.219 -10.656
  447   1HA   GLY  62           2HA      GLY  62  -2.085  -4.900 -11.370
  448   2HA   GLY  62           1HA      GLY  62  -3.125  -5.798 -12.476
  449    H    LEU  63             H      LEU  63  -3.986  -4.032 -10.345
  450    HA   LEU  63            HA      LEU  63  -4.990  -5.682  -8.132
  451   1HB   LEU  63           2HB      LEU  63  -5.839  -2.842  -8.782
  452   2HB   LEU  63           1HB      LEU  63  -5.977  -3.659  -7.226
  453    HG   LEU  63            HG      LEU  63  -3.362  -3.000  -8.599
  454   1HD1  LEU  63          3HD1      LEU  63  -5.117  -1.210  -7.477
  455   2HD1  LEU  63          2HD1      LEU  63  -4.158  -1.675  -6.067
  456   3HD1  LEU  63          1HD1      LEU  63  -3.366  -0.998  -7.495
  457   1HD2  LEU  63          1HD2      LEU  63  -4.173  -4.158  -5.931
  458   2HD2  LEU  63          3HD2      LEU  63  -3.104  -4.868  -7.143
  459   3HD2  LEU  63          2HD2      LEU  63  -2.575  -3.461  -6.217
  460    H    THR  64             H      THR  64  -7.585  -4.512  -7.840
  461    HA   THR  64            HA      THR  64  -9.168  -5.023 -10.199
  462    HB   THR  64            HB      THR  64 -10.461  -6.872  -9.067
  463    HG1  THR  64           HG1      THR  64  -9.378  -7.957  -7.414
  464   1HG2  THR  64          1HG2      THR  64  -8.713  -7.154 -10.866
  465   2HG2  THR  64          3HG2      THR  64  -7.581  -7.607  -9.586
  466   3HG2  THR  64          2HG2      THR  64  -9.034  -8.579  -9.881
  467    H    LEU  65             H      LEU  65 -10.722  -3.616  -9.957
  468    HA   LEU  65            HA      LEU  65 -11.925  -3.222  -7.308
  469   1HB   LEU  65           2HB      LEU  65 -12.144  -0.731  -8.053
  470   2HB   LEU  65           1HB      LEU  65 -10.809  -1.316  -7.131
  471    HG   LEU  65            HG      LEU  65 -10.727  -1.125 -10.132
  472   1HD1  LEU  65          2HD1      LEU  65 -11.097   1.074  -8.775
  473   2HD1  LEU  65          1HD1      LEU  65  -9.446   0.819  -8.212
  474   3HD1  LEU  65          3HD1      LEU  65  -9.768   1.026  -9.933
  475   1HD2  LEU  65          1HD2      LEU  65  -8.929  -2.051  -7.992
  476   2HD2  LEU  65          3HD2      LEU  65  -8.823  -2.317  -9.731
  477   3HD2  LEU  65          2HD2      LEU  65  -8.175  -0.837  -9.026
  478    H    GLY  66             H      GLY  66 -13.827  -3.977  -7.504
  479   1HA   GLY  66           2HA      GLY  66 -16.079  -4.067  -8.142
  480   2HA   GLY  66           1HA      GLY  66 -15.733  -2.857  -9.383
  481    H    GLY  67             H      GLY  67 -13.578  -5.595  -9.206
  482   1HA   GLY  67           2HA      GLY  67 -13.502  -7.596 -10.480
  483   2HA   GLY  67           1HA      GLY  67 -15.017  -7.133 -11.264
  484    H    GLN  68             H      GLN  68 -12.712  -4.524 -11.063
  485    HA   GLN  68            HA      GLN  68 -12.120  -4.920 -13.973
  486   1HB   GLN  68           2HB      GLN  68 -13.248  -2.862 -13.617
  487   2HB   GLN  68           1HB      GLN  68 -12.171  -2.500 -12.317
  488   1HG   GLN  68           2HG      GLN  68 -11.734  -1.296 -14.594
  489   2HG   GLN  68           1HG      GLN  68 -10.353  -1.948 -13.725
  490   1HE2  GLN  68          2HE2      GLN  68  -9.417  -3.785 -16.603
  491   2HE2  GLN  68          1HE2      GLN  68  -8.942  -2.757 -15.337
  492    H    LYS  69             H      LYS  69 -10.307  -6.128 -14.010
  493    HA   LYS  69            HA      LYS  69  -8.126  -5.886 -12.232
  494   1HB   LYS  69           2HB      LYS  69  -8.896  -7.665 -14.151
  495   2HB   LYS  69           1HB      LYS  69  -7.565  -6.844 -14.966
  496   1HG   LYS  69           2HG      LYS  69  -5.998  -7.659 -13.521
  497   2HG   LYS  69           1HG      LYS  69  -7.097  -7.605 -12.141
  498   1HD   LYS  69           2HD      LYS  69  -8.248  -9.570 -12.893
  499   2HD   LYS  69           1HD      LYS  69  -7.336  -9.584 -14.399
  500   1HE   LYS  69           2HE      LYS  69  -6.162 -11.170 -13.124
  501   2HE   LYS  69           1HE      LYS  69  -5.227  -9.701 -12.829
  502   1HZ   LYS  69           3HZ      LYS  69  -7.442 -10.623 -11.079
  503   2HZ   LYS  69           2HZ      LYS  69  -5.807 -10.997 -10.801
  504   3HZ   LYS  69           1HZ      LYS  69  -6.331  -9.381 -10.768
  505    H    CYS  70             H      CYS  70  -7.071  -3.943 -12.032
  506    HA   CYS  70            HA      CYS  70  -6.238  -2.585 -14.608
  507   1HB   CYS  70           2HB      CYS  70  -5.672  -0.688 -13.022
  508   2HB   CYS  70           1HB      CYS  70  -7.382  -1.019 -13.194
  509    HG   CYS  70            HG      CYS  70  -5.764  -2.004 -10.713
  510    H    SER  71             H      SER  71  -3.953  -1.606 -14.117
  511    HA   SER  71            HA      SER  71  -2.313  -3.718 -12.826
  512   1HB   SER  71           2HB      SER  71  -0.806  -3.642 -14.682
  513   2HB   SER  71           1HB      SER  71  -2.446  -3.952 -15.237
  514    HG   SER  71            HG      SER  71  -0.820  -1.770 -15.631
  515    H    VAL  72             H      VAL  72  -1.377  -2.756 -11.165
  516    HA   VAL  72            HA      VAL  72  -0.725  -0.093 -10.713
  517    HB   VAL  72            HB      VAL  72   1.045  -2.333  -9.868
  518   1HG1  VAL  72          2HG1      VAL  72   0.803   0.490  -9.232
  519   2HG1  VAL  72          1HG1      VAL  72   0.674  -0.515  -7.805
  520   3HG1  VAL  72          3HG1      VAL  72   2.097  -0.637  -8.819
  521   1HG2  VAL  72          2HG2      VAL  72  -1.641  -1.521  -8.854
  522   2HG2  VAL  72          1HG2      VAL  72  -1.075  -3.133  -9.269
  523   3HG2  VAL  72          3HG2      VAL  72  -0.479  -2.339  -7.825
  524    H    ILE  73             H      ILE  73   0.540   1.230 -11.592
  525    HA   ILE  73            HA      ILE  73   3.001   0.371 -12.825
  526    HB   ILE  73            HB      ILE  73   1.012   2.188 -14.061
  527   1HG1  ILE  73          2HG1      ILE  73   2.330  -0.214 -15.313
  528   2HG1  ILE  73          1HG1      ILE  73   0.914  -0.409 -14.298
  529   1HG2  ILE  73          1HG2      ILE  73   3.744   2.562 -14.194
  530   2HG2  ILE  73          3HG2      ILE  73   3.391   1.630 -15.646
  531   3HG2  ILE  73          2HG2      ILE  73   2.583   3.172 -15.369
  532   1HD1  ILE  73          3HD1      ILE  73  -0.288   1.245 -15.855
  533   2HD1  ILE  73          2HD1      ILE  73   1.103   1.102 -16.921
  534   3HD1  ILE  73          1HD1      ILE  73   0.100  -0.325 -16.597
  535    NH1  ARG  74           NH2      ARG  74   8.477   7.615  -9.987
  536    NH2  ARG  74           NH1      ARG  74   7.154   9.359  -9.410
  537    H    ARG  74             H      ARG  74   3.583   1.024 -10.744
  538    HA   ARG  74            HA      ARG  74   5.239   2.530  -9.756
  539   1HB   ARG  74           2HB      ARG  74   4.651   4.427 -11.304
  540   2HB   ARG  74           1HB      ARG  74   3.203   4.718 -10.343
  541   1HG   ARG  74           2HG      ARG  74   4.370   5.760  -8.701
  542   2HG   ARG  74           1HG      ARG  74   5.622   4.520  -8.695
  543   1HD   ARG  74           2HD      ARG  74   6.857   5.586 -10.397
  544   2HD   ARG  74           1HD      ARG  74   5.472   6.540 -10.932
  545    HE   ARG  74            HE      ARG  74   5.954   7.346  -8.294
  546   1HH1  ARG  74          1HH2      ARG  74   8.625   6.630 -10.068
  547   2HH1  ARG  74          2HH2      ARG  74   9.197   8.253 -10.262
  548   1HH2  ARG  74          2HH1      ARG  74   6.287   9.708  -9.053
  549   2HH2  ARG  74          1HH1      ARG  74   7.876   9.995  -9.679
  550    H    ASP  75             H      ASP  75   4.274   0.869  -8.270
  551    HA   ASP  75            HA      ASP  75   2.045   1.636  -6.693
  552   1HB   ASP  75           2HB      ASP  75   2.109  -0.630  -6.541
  553   2HB   ASP  75           1HB      ASP  75   3.814  -0.681  -6.647
  554    H    SER  76             H      SER  76   2.091   3.480  -5.757
  555    HA   SER  76            HA      SER  76   4.235   3.902  -3.680
  556   1HB   SER  76           2HB      SER  76   3.877   5.539  -5.891
  557   2HB   SER  76           1HB      SER  76   2.927   6.347  -4.661
  558    HG   SER  76            HG      SER  76   5.590   5.440  -4.327
  559    H    LEU  77             H      LEU  77   1.032   3.215  -4.200
  560    HA   LEU  77            HA      LEU  77  -0.758   4.718  -2.718
  561   1HB   LEU  77           2HB      LEU  77  -1.069   2.496  -3.927
  562   2HB   LEU  77           1HB      LEU  77  -0.409   1.685  -2.526
  563    HG   LEU  77            HG      LEU  77  -2.730   3.545  -2.204
  564   1HD1  LEU  77          1HD1      LEU  77  -2.914   1.700  -4.159
  565   2HD1  LEU  77          3HD1      LEU  77  -3.175   0.626  -2.767
  566   3HD1  LEU  77          2HD1      LEU  77  -4.262   1.989  -3.028
  567   1HD2  LEU  77          3HD2      LEU  77  -1.563   1.116  -0.836
  568   2HD2  LEU  77          2HD2      LEU  77  -1.906   2.702  -0.147
  569   3HD2  LEU  77          1HD2      LEU  77  -3.227   1.606  -0.539
  570    H    LEU  78             H      LEU  78   1.896   2.802  -1.384
  571    HA   LEU  78            HA      LEU  78   0.888   3.528   1.247
  572   1HB   LEU  78           2HB      LEU  78   2.989   1.669   0.477
  573   2HB   LEU  78           1HB      LEU  78   2.545   1.955   2.124
  574    HG   LEU  78            HG      LEU  78   0.345   1.305   0.187
  575   1HD1  LEU  78          2HD1      LEU  78   2.249  -0.372  -0.227
  576   2HD1  LEU  78          1HD1      LEU  78   1.920  -0.960   1.403
  577   3HD1  LEU  78          3HD1      LEU  78   0.648  -1.035   0.170
  578   1HD2  LEU  78          3HD2      LEU  78   0.053   1.814   2.655
  579   2HD2  LEU  78          2HD2      LEU  78  -0.680   0.298   2.106
  580   3HD2  LEU  78          1HD2      LEU  78   0.856   0.278   2.987
  581    H    GLN  79             H      GLN  79   1.631   5.166   2.249
  582    HA   GLN  79            HA      GLN  79   2.875   7.259   1.324
  583   1HB   GLN  79           2HB      GLN  79   3.033   8.086   3.665
  584   2HB   GLN  79           1HB      GLN  79   1.462   7.375   3.301
  585   1HG   GLN  79           2HG      GLN  79   3.440   5.434   4.303
  586   2HG   GLN  79           1HG      GLN  79   3.024   6.695   5.461
  587   1HE2  GLN  79          2HE2      GLN  79   0.379   3.754   4.743
  588   2HE2  GLN  79          1HE2      GLN  79   1.968   3.721   4.151
  589    H    ASP  80             H      ASP  80   4.564   6.372   0.284
  590    HA   ASP  80            HA      ASP  80   7.109   6.214   1.831
  591   1HB   ASP  80           2HB      ASP  80   6.691   4.406   0.100
  592   2HB   ASP  80           1HB      ASP  80   6.605   5.671  -1.128
  593    H    GLY  81             H      GLY  81   5.203   8.566   1.239
  594   1HA   GLY  81           2HA      GLY  81   5.787  10.890   1.034
  595   2HA   GLY  81           1HA      GLY  81   7.130  10.417  -0.020
  596    H    GLU  82             H      GLU  82   4.090   8.715  -0.552
  597    HA   GLU  82            HA      GLU  82   3.351  10.444  -2.791
  598   1HB   GLU  82           2HB      GLU  82   4.486   7.755  -2.862
  599   2HB   GLU  82           1HB      GLU  82   3.229   8.127  -3.984
  600   1HG   GLU  82           2HG      GLU  82   5.140   8.643  -5.203
  601   2HG   GLU  82           1HG      GLU  82   4.622  10.222  -4.579
  602    H    PHE  83             H      PHE  83   2.496   7.283  -1.339
  603    HA   PHE  83            HA      PHE  83   0.485   6.094  -1.390
  604   1HB   PHE  83           2HB      PHE  83  -1.540   7.642  -0.682
  605   2HB   PHE  83           1HB      PHE  83  -0.447   6.891   0.402
  606    HD1  PHE  83           HD1      PHE  83   1.258   8.174   1.546
  607    HD2  PHE  83           HD2      PHE  83  -1.472  10.037  -1.172
  608    HE1  PHE  83           HE1      PHE  83   1.935  10.400   2.425
  609    HE2  PHE  83           HE2      PHE  83  -0.807  12.278  -0.306
  610    HZ   PHE  83            HZ      PHE  83   0.894  12.458   1.494
  611    H    SER  84             H      SER  84   1.078   6.589  -3.847
  612    HA   SER  84            HA      SER  84  -1.525   6.994  -5.221
  613   1HB   SER  84           2HB      SER  84  -0.229   8.311  -7.010
  614   2HB   SER  84           1HB      SER  84  -0.618   9.179  -5.524
  615    HG   SER  84            HG      SER  84   1.833   8.243  -6.498
  616    H    MET  85             H      MET  85  -1.743   5.570  -6.831
  617    HA   MET  85            HA      MET  85   0.624   3.914  -7.651
  618   1HB   MET  85           2HB      MET  85  -0.969   3.116  -5.763
  619   2HB   MET  85           1HB      MET  85  -2.069   2.858  -7.048
  620   1HG   MET  85           2HG      MET  85  -1.111   0.953  -7.630
  621   2HG   MET  85           1HG      MET  85   0.462   1.700  -7.672
  622   1HE   MET  85           3HE      MET  85  -1.528  -0.698  -6.675
  623   2HE   MET  85           2HE      MET  85  -0.008  -1.510  -6.157
  624   3HE   MET  85           1HE      MET  85  -1.278  -1.158  -4.963
  625    H    ASP  86             H      ASP  86   0.690   3.796  -9.952
  626    HA   ASP  86            HA      ASP  86  -1.726   4.807 -11.365
  627   1HB   ASP  86           2HB      ASP  86   1.101   4.337 -11.937
  628   2HB   ASP  86           1HB      ASP  86  -0.007   4.276 -13.281
  629    H    LEU  87             H      LEU  87  -3.006   2.790 -10.771
  630    HA   LEU  87            HA      LEU  87  -2.173   0.492 -12.357
  631   1HB   LEU  87           2HB      LEU  87  -4.256  -0.610 -11.232
  632   2HB   LEU  87           1HB      LEU  87  -2.721  -0.561 -10.443
  633    HG   LEU  87            HG      LEU  87  -4.587  -0.016  -8.933
  634   1HD1  LEU  87          1HD1      LEU  87  -2.201   1.459  -9.264
  635   2HD1  LEU  87          3HD1      LEU  87  -3.466   2.566  -8.732
  636   3HD1  LEU  87          2HD1      LEU  87  -3.104   1.123  -7.788
  637   1HD2  LEU  87          3HD2      LEU  87  -5.816   1.184 -10.895
  638   2HD2  LEU  87          2HD2      LEU  87  -6.036   1.748  -9.254
  639   3HD2  LEU  87          1HD2      LEU  87  -4.942   2.603 -10.329
  640    NH1  ARG  88           NH1      ARG  88   0.114   3.385 -17.865
  641    NH2  ARG  88           NH2      ARG  88   0.884   2.437 -19.763
  642    H    ARG  88             H      ARG  88  -2.750   0.316 -14.291
  643    HA   ARG  88            HA      ARG  88  -5.341   1.615 -15.122
  644   1HB   ARG  88           2HB      ARG  88  -4.375   2.326 -17.129
  645   2HB   ARG  88           1HB      ARG  88  -3.031   2.468 -16.015
  646   1HG   ARG  88           2HG      ARG  88  -2.065   0.354 -16.855
  647   2HG   ARG  88           1HG      ARG  88  -3.478   0.067 -17.891
  648   1HD   ARG  88           2HD      ARG  88  -2.661   1.413 -19.490
  649   2HD   ARG  88           1HD      ARG  88  -2.394   2.747 -18.325
  650    HE   ARG  88            HE      ARG  88  -0.416   0.508 -18.505
  651   1HH1  ARG  88          2HH1      ARG  88  -0.501   3.369 -17.077
  652   2HH1  ARG  88          1HH1      ARG  88   0.759   4.141 -17.980
  653   1HH2  ARG  88          1HH2      ARG  88   0.862   1.694 -20.432
  654   2HH2  ARG  88          2HH2      ARG  88   1.523   3.195 -19.879
  655    H    THR  89             H      THR  89  -6.847   0.565 -16.237
  656    HA   THR  89            HA      THR  89  -6.974  -2.281 -16.452
  657    HB   THR  89            HB      THR  89  -9.024  -1.898 -17.617
  658    HG1  THR  89           HG1      THR  89  -9.108  -0.628 -19.204
  659   1HG2  THR  89          3HG2      THR  89  -8.565  -0.462 -15.334
  660   2HG2  THR  89          2HG2      THR  89  -9.186   0.771 -16.439
  661   3HG2  THR  89          1HG2      THR  89 -10.152  -0.669 -16.078
  662    H    LYS  90             H      LYS  90  -5.060  -3.004 -17.594
  663    HA   LYS  90            HA      LYS  90  -4.319  -1.760 -20.046
  664   1HB   LYS  90           2HB      LYS  90  -3.161  -4.408 -19.410
  665   2HB   LYS  90           1HB      LYS  90  -2.409  -2.920 -19.942
  666   1HG   LYS  90           2HG      LYS  90  -2.763  -2.006 -17.630
  667   2HG   LYS  90           1HG      LYS  90  -3.102  -3.679 -17.135
  668   1HD   LYS  90           2HD      LYS  90  -0.554  -2.648 -18.501
  669   2HD   LYS  90           1HD      LYS  90  -0.658  -3.311 -16.896
  670   1HE   LYS  90           2HE      LYS  90  -1.051  -4.833 -19.483
  671   2HE   LYS  90           1HE      LYS  90   0.277  -5.026 -18.345
  672   1HZ   LYS  90           3HZ      LYS  90  -2.566  -5.523 -17.632
  673   2HZ   LYS  90           2HZ      LYS  90  -1.521  -6.738 -18.189
  674   3HZ   LYS  90           1HZ      LYS  90  -1.189  -5.930 -16.729
  675    H    SER  91             H      SER  91  -4.254  -2.904 -22.029
  676    HA   SER  91            HA      SER  91  -5.895  -5.332 -22.343
  677   1HB   SER  91           2HB      SER  91  -7.277  -3.150 -22.628
  678   2HB   SER  91           1HB      SER  91  -6.527  -3.081 -24.191
  679    HG   SER  91            HG      SER  91  -8.230  -5.025 -23.067
  680    H    THR  92             H      THR  92  -5.998  -5.588 -25.026
  681    HA   THR  92            HA      THR  92  -3.336  -4.961 -26.187
  682    HB   THR  92            HB      THR  92  -2.795  -7.351 -26.605
  683    HG1  THR  92           HG1      THR  92  -4.908  -8.159 -26.409
  684   1HG2  THR  92          2HG2      THR  92  -1.964  -6.047 -24.590
  685   2HG2  THR  92          1HG2      THR  92  -3.241  -6.834 -23.660
  686   3HG2  THR  92          3HG2      THR  92  -1.965  -7.802 -24.405
  687    H    GLY  93             H      GLY  93  -3.135  -6.213 -28.395
  688   1HA   GLY  93           2HA      GLY  93  -3.957  -6.478 -30.576
  689   2HA   GLY  93           1HA      GLY  93  -5.472  -7.002 -29.839
  690    H    GLY  94             H      GLY  94  -3.736  -3.883 -29.690
  691   1HA   GLY  94           2HA      GLY  94  -4.448  -1.694 -30.198
  692   2HA   GLY  94           1HA      GLY  94  -5.498  -2.424 -31.417
  693    H    ALA  95             H      ALA  95  -5.790  -3.461 -28.093
  694    HA   ALA  95            HA      ALA  95  -8.590  -2.692 -27.966
  695   1HB   ALA  95           1HB      ALA  95  -6.641  -4.027 -26.131
  696   2HB   ALA  95           3HB      ALA  95  -8.099  -3.322 -25.430
  697   3HB   ALA  95           2HB      ALA  95  -8.228  -4.571 -26.676
  698    HA   PRO  96            HA      PRO  96  -8.145   1.116 -25.859
  699   1HB   PRO  96           2HB      PRO  96 -10.539   1.252 -24.644
  700   2HB   PRO  96           1HB      PRO  96 -10.387   1.315 -26.408
  701   1HG   PRO  96           2HG      PRO  96 -11.420  -0.919 -24.717
  702   2HG   PRO  96           1HG      PRO  96 -11.718  -0.587 -26.429
  703   1HD   PRO  96           2HD      PRO  96  -9.851  -2.465 -25.327
  704   2HD   PRO  96           1HD      PRO  96 -10.139  -2.079 -27.034
  705    H    THR  97             H      THR  97  -6.943   1.436 -24.062
  706    HA   THR  97            HA      THR  97  -7.420  -0.257 -21.618
  707    HB   THR  97            HB      THR  97  -5.271   0.786 -20.819
  708    HG1  THR  97           HG1      THR  97  -5.082   2.670 -21.834
  709   1HG2  THR  97          1HG2      THR  97  -5.528  -1.283 -22.473
  710   2HG2  THR  97          3HG2      THR  97  -4.641  -0.208 -23.561
  711   3HG2  THR  97          2HG2      THR  97  -3.938  -0.659 -22.001
  712    H    PHE  98             H      PHE  98  -7.160   1.079 -19.574
  713    HA   PHE  98            HA      PHE  98  -8.176   3.820 -19.693
  714   1HB   PHE  98           2HB      PHE  98  -9.576   1.606 -18.145
  715   2HB   PHE  98           1HB      PHE  98 -10.019   3.314 -18.130
  716    HD1  PHE  98           HD1      PHE  98 -10.202   4.364 -20.622
  717    HD2  PHE  98           HD2      PHE  98 -10.843   0.236 -19.636
  718    HE1  PHE  98           HE1      PHE  98 -11.511   4.089 -22.698
  719    HE2  PHE  98           HE2      PHE  98 -12.163  -0.056 -21.741
  720    HZ   PHE  98            HZ      PHE  98 -12.500   1.882 -23.250
  721    H    ASN  99             H      ASN  99  -7.425   5.020 -17.843
  722    HA   ASN  99            HA      ASN  99  -5.576   3.390 -16.140
  723   1HB   ASN  99           2HB      ASN  99  -5.013   6.306 -16.641
  724   2HB   ASN  99           1HB      ASN  99  -3.897   5.013 -16.189
  725   1HD2  ASN  99          2HD2      ASN  99  -2.845   4.975 -19.546
  726   2HD2  ASN  99          1HD2      ASN  99  -2.436   5.303 -17.929
  727    H    VAL 100             H      VAL 100  -5.371   3.826 -14.023
  728    HA   VAL 100            HA      VAL 100  -7.333   5.642 -12.728
  729    HB   VAL 100            HB      VAL 100  -6.620   2.866 -11.682
  730   1HG1  VAL 100          1HG1      VAL 100  -7.730   4.859 -10.366
  731   2HG1  VAL 100          3HG1      VAL 100  -9.187   4.296 -11.172
  732   3HG1  VAL 100          2HG1      VAL 100  -8.275   3.205 -10.139
  733   1HG2  VAL 100          2HG2      VAL 100  -8.373   3.558 -13.945
  734   2HG2  VAL 100          1HG2      VAL 100  -7.831   1.974 -13.394
  735   3HG2  VAL 100          3HG2      VAL 100  -9.252   2.721 -12.662
  736    H    THR 101             H      THR 101  -6.407   6.687 -10.935
  737    HA   THR 101            HA      THR 101  -3.717   5.768 -10.047
  738    HB   THR 101            HB      THR 101  -4.901   8.586  -9.858
  739    HG1  THR 101           HG1      THR 101  -4.028   8.846 -11.738
  740   1HG2  THR 101          3HG2      THR 101  -2.701   7.214  -8.507
  741   2HG2  THR 101          2HG2      THR 101  -2.146   8.638  -9.387
  742   3HG2  THR 101          1HG2      THR 101  -3.420   8.794  -8.172
  743    H    VAL 102             H      VAL 102  -3.873   4.943  -8.086
  744    HA   VAL 102            HA      VAL 102  -6.278   5.507  -6.483
  745    HB   VAL 102            HB      VAL 102  -4.645   3.055  -7.069
  746   1HG1  VAL 102          2HG1      VAL 102  -6.160   3.661  -4.536
  747   2HG1  VAL 102          1HG1      VAL 102  -6.256   2.033  -5.213
  748   3HG1  VAL 102          3HG1      VAL 102  -4.703   2.713  -4.768
  749   1HG2  VAL 102          3HG2      VAL 102  -7.552   3.759  -7.006
  750   2HG2  VAL 102          2HG2      VAL 102  -6.557   3.482  -8.415
  751   3HG2  VAL 102          1HG2      VAL 102  -6.941   2.148  -7.332
  752    H    THR 103             H      THR 103  -5.954   6.576  -4.675
  753    HA   THR 103            HA      THR 103  -3.225   6.715  -3.565
  754    HB   THR 103            HB      THR 103  -4.147   8.725  -2.290
  755    HG1  THR 103           HG1      THR 103  -5.968   9.658  -3.349
  756   1HG2  THR 103          2HG2      THR 103  -3.411   8.443  -5.126
  757   2HG2  THR 103          1HG2      THR 103  -4.255   9.947  -4.743
  758   3HG2  THR 103          3HG2      THR 103  -2.766   9.521  -3.884
  759    H    LYS 104             H      LYS 104  -3.317   7.234  -1.095
  760    HA   LYS 104            HA      LYS 104  -5.288   5.470   0.287
  761   1HB   LYS 104           2HB      LYS 104  -3.408   4.075  -0.390
  762   2HB   LYS 104           1HB      LYS 104  -2.297   5.209   0.339
  763   1HG   LYS 104           2HG      LYS 104  -2.530   3.382   1.874
  764   2HG   LYS 104           1HG      LYS 104  -3.393   4.745   2.561
  765   1HD   LYS 104           2HD      LYS 104  -5.326   3.598   2.557
  766   2HD   LYS 104           1HD      LYS 104  -5.160   3.273   0.833
  767   1HE   LYS 104           2HE      LYS 104  -5.224   1.176   2.115
  768   2HE   LYS 104           1HE      LYS 104  -3.678   1.368   1.330
  769   1HZ   LYS 104           1HZ      LYS 104  -3.965   2.433   4.037
  770   2HZ   LYS 104           3HZ      LYS 104  -3.853   0.749   3.860
  771   3HZ   LYS 104           2HZ      LYS 104  -2.610   1.745   3.277
  772    H    THR 105             H      THR 105  -5.353   5.723   2.545
  773    HA   THR 105            HA      THR 105  -3.864   8.011   3.754
  774    HB   THR 105            HB      THR 105  -5.870   8.746   4.927
  775    HG1  THR 105           HG1      THR 105  -7.476   7.451   5.179
  776   1HG2  THR 105          1HG2      THR 105  -5.828   8.566   1.996
  777   2HG2  THR 105          3HG2      THR 105  -7.428   8.827   2.658
  778   3HG2  THR 105          2HG2      THR 105  -6.132   9.955   3.027
  779    H    ASP 106             H      ASP 106  -5.420   7.329   6.347
  780    HA   ASP 106            HA      ASP 106  -3.846   4.903   7.011
  781   1HB   ASP 106           2HB      ASP 106  -3.805   7.145   8.336
  782   2HB   ASP 106           1HB      ASP 106  -5.250   6.486   9.086
  783    H    LYS 107             H      LYS 107  -7.132   5.982   6.557
  784    HA   LYS 107            HA      LYS 107  -8.103   3.264   7.294
  785   1HB   LYS 107           2HB      LYS 107  -9.869   5.515   8.187
  786   2HB   LYS 107           1HB      LYS 107  -9.654   3.916   8.888
  787   1HG   LYS 107           2HG      LYS 107  -7.365   4.670   9.684
  788   2HG   LYS 107           1HG      LYS 107  -7.798   6.300   9.172
  789   1HD   LYS 107           2HD      LYS 107  -9.304   4.624  11.211
  790   2HD   LYS 107           1HD      LYS 107  -8.263   5.998  11.576
  791   1HE   LYS 107           2HE      LYS 107 -10.077   7.329  11.367
  792   2HE   LYS 107           1HE      LYS 107 -10.090   6.949   9.646
  793   1HZ   LYS 107           2HZ      LYS 107 -11.289   5.074  11.574
  794   2HZ   LYS 107           1HZ      LYS 107 -12.164   6.443  11.078
  795   3HZ   LYS 107           3HZ      LYS 107 -11.655   5.301   9.931
  796    H    THR 108             H      THR 108  -7.802   5.121   4.789
  797    HA   THR 108            HA      THR 108 -10.464   4.441   3.690
  798    HB   THR 108            HB      THR 108 -10.884   6.586   2.771
  799    HG1  THR 108           HG1      THR 108  -8.895   7.156   2.028
  800   1HG2  THR 108          2HG2      THR 108 -11.077   6.299   5.345
  801   2HG2  THR 108          1HG2      THR 108  -9.648   7.340   5.418
  802   3HG2  THR 108          3HG2      THR 108 -11.136   7.942   4.688
  803    H    LEU 109             H      LEU 109 -10.368   4.121   1.430
  804    HA   LEU 109            HA      LEU 109  -7.661   3.745   0.240
  805   1HB   LEU 109           2HB      LEU 109  -9.407   1.813   1.020
  806   2HB   LEU 109           1HB      LEU 109 -10.016   2.079  -0.595
  807    HG   LEU 109            HG      LEU 109  -8.181   0.264   0.015
  808   1HD1  LEU 109          2HD1      LEU 109  -8.904   1.678  -2.407
  809   2HD1  LEU 109          1HD1      LEU 109  -7.408   0.746  -2.504
  810   3HD1  LEU 109          3HD1      LEU 109  -8.918  -0.048  -2.038
  811   1HD2  LEU 109          2HD2      LEU 109  -6.472   1.840   0.709
  812   2HD2  LEU 109          1HD2      LEU 109  -5.955   0.918  -0.697
  813   3HD2  LEU 109          3HD2      LEU 109  -6.506   2.583  -0.888
  814    H    VAL 110             H      VAL 110  -7.748   5.823  -1.066
  815    HA   VAL 110            HA      VAL 110 -10.284   6.341  -2.484
  816    HB   VAL 110            HB      VAL 110  -7.715   7.883  -1.989
  817   1HG1  VAL 110          2HG1      VAL 110  -9.631   8.316  -4.261
  818   2HG1  VAL 110          1HG1      VAL 110  -8.829   9.693  -3.514
  819   3HG1  VAL 110          3HG1      VAL 110  -7.880   8.415  -4.270
  820   1HG2  VAL 110          2HG2      VAL 110 -10.216   7.866  -0.794
  821   2HG2  VAL 110          1HG2      VAL 110  -9.067   9.210  -0.690
  822   3HG2  VAL 110          3HG2      VAL 110 -10.363   9.236  -1.907
  823    H    LEU 111             H      LEU 111 -10.465   6.400  -4.716
  824    HA   LEU 111            HA      LEU 111  -8.235   5.386  -6.344
  825   1HB   LEU 111           2HB      LEU 111 -11.050   4.532  -7.031
  826   2HB   LEU 111           1HB      LEU 111  -9.529   3.778  -7.498
  827    HG   LEU 111            HG      LEU 111 -10.544   3.800  -4.657
  828   1HD1  LEU 111          3HD1      LEU 111 -11.652   2.367  -6.823
  829   2HD1  LEU 111          2HD1      LEU 111 -10.667   1.197  -5.943
  830   3HD1  LEU 111          1HD1      LEU 111 -11.950   2.085  -5.109
  831   1HD2  LEU 111          2HD2      LEU 111  -8.125   3.425  -5.065
  832   2HD2  LEU 111          1HD2      LEU 111  -8.923   2.066  -4.306
  833   3HD2  LEU 111          3HD2      LEU 111  -8.551   2.006  -6.022
  834    H    LEU 112             H      LEU 112  -8.330   6.170  -8.480
  835    HA   LEU 112            HA      LEU 112 -10.257   8.339  -9.018
  836   1HB   LEU 112           2HB      LEU 112  -7.830   9.016  -8.315
  837   2HB   LEU 112           1HB      LEU 112  -7.392   8.462  -9.899
  838    HG   LEU 112            HG      LEU 112  -7.715  10.697 -10.379
  839   1HD1  LEU 112          2HD1      LEU 112 -10.555   9.626 -10.522
  840   2HD1  LEU 112          1HD1      LEU 112 -10.049  11.178 -11.203
  841   3HD1  LEU 112          3HD1      LEU 112  -9.370   9.676 -11.834
  842   1HD2  LEU 112          1HD2      LEU 112  -9.643  10.641  -8.082
  843   2HD2  LEU 112          3HD2      LEU 112  -8.098  11.482  -8.203
  844   3HD2  LEU 112          2HD2      LEU 112  -9.488  12.047  -9.136
  845    H    MET 113             H      MET 113 -11.410   7.293 -10.601
  846    HA   MET 113            HA      MET 113  -9.799   5.603 -12.473
  847   1HB   MET 113           2HB      MET 113 -12.134   5.003 -11.514
  848   2HB   MET 113           1HB      MET 113 -12.707   6.009 -12.793
  849   1HG   MET 113           2HG      MET 113 -10.709   4.340 -13.926
  850   2HG   MET 113           1HG      MET 113 -11.790   3.328 -13.003
  851   1HE   MET 113           1HE      MET 113 -13.618   2.253 -13.961
  852   2HE   MET 113           3HE      MET 113 -14.091   2.479 -15.652
  853   3HE   MET 113           2HE      MET 113 -12.420   2.095 -15.244
  854    H    GLY 114             H      GLY 114  -9.731   5.883 -14.613
  855   1HA   GLY 114           2HA      GLY 114 -10.806   8.317 -15.767
  856   2HA   GLY 114           1HA      GLY 114  -9.079   8.146 -15.760
  857    H    LYS 115             H      LYS 115 -10.800   8.313 -17.971
  858    HA   LYS 115            HA      LYS 115 -10.117   5.847 -19.386
  859   1HB   LYS 115           2HB      LYS 115 -12.718   7.372 -19.452
  860   2HB   LYS 115           1HB      LYS 115 -12.174   6.420 -20.844
  861   1HG   LYS 115           2HG      LYS 115 -11.760   4.561 -19.005
  862   2HG   LYS 115           1HG      LYS 115 -12.950   5.473 -18.113
  863   1HD   LYS 115           2HD      LYS 115 -14.507   5.292 -20.062
  864   2HD   LYS 115           1HD      LYS 115 -13.324   4.251 -20.857
  865   1HE   LYS 115           2HE      LYS 115 -13.410   2.777 -18.774
  866   2HE   LYS 115           1HE      LYS 115 -14.813   3.720 -18.272
  867   1HZ   LYS 115           2HZ      LYS 115 -14.571   2.228 -20.831
  868   2HZ   LYS 115           1HZ      LYS 115 -15.445   1.709 -19.467
  869   3HZ   LYS 115           3HZ      LYS 115 -15.932   3.100 -20.308
  870    H    GLU 116             H      GLU 116  -9.889   6.349 -21.716
  871    HA   GLU 116            HA      GLU 116  -7.892   7.634 -22.685
  872   1HB   GLU 116           2HB      GLU 116  -9.687   6.762 -23.739
  873   2HB   GLU 116           1HB      GLU 116 -10.472   8.267 -23.713
  874   1HG   GLU 116           2HG      GLU 116  -8.886   9.237 -25.196
  875   2HG   GLU 116           1HG      GLU 116  -7.735   7.935 -24.904
  876    H    GLY 117             H      GLY 117  -7.061   9.443 -23.557
  877   1HA   GLY 117           2HA      GLY 117  -6.461  11.735 -23.596
  878   2HA   GLY 117           1HA      GLY 117  -8.065  12.132 -22.912
  879    H    VAL 118             H      VAL 118  -6.698   9.322 -21.562
  880    HA   VAL 118            HA      VAL 118  -6.252  10.614 -19.020
  881    HB   VAL 118            HB      VAL 118  -7.992   8.822 -19.816
  882   1HG1  VAL 118          1HG1      VAL 118  -6.296   7.196 -20.562
  883   2HG1  VAL 118          3HG1      VAL 118  -5.850   6.962 -18.868
  884   3HG1  VAL 118          2HG1      VAL 118  -7.501   6.590 -19.403
  885   1HG2  VAL 118          1HG2      VAL 118  -6.818   9.558 -17.280
  886   2HG2  VAL 118          3HG2      VAL 118  -8.445   8.925 -17.570
  887   3HG2  VAL 118          2HG2      VAL 118  -7.105   7.802 -17.208
  888    H    HIS 119             H      HIS 119  -4.058  11.264 -19.135
  889    HA   HIS 119            HA      HIS 119  -1.999   9.360 -19.953
  890   1HB   HIS 119           2HB      HIS 119  -1.821  11.885 -20.128
  891   2HB   HIS 119           1HB      HIS 119  -1.563  11.899 -18.383
  892    HD1  HIS 119           HD1      HIS 119   0.913  12.274 -18.143
  893    HD2  HIS 119           HD2      HIS 119   0.029   9.364 -20.990
  894    HE1  HIS 119           HE1      HIS 119   3.131  11.291 -18.880
  895    H    GLY 120             H      GLY 120  -3.681  10.201 -17.023
  896   1HA   GLY 120           2HA      GLY 120  -3.778   8.879 -15.066
  897   2HA   GLY 120           1HA      GLY 120  -2.294   8.063 -15.577
  898    H    GLY 121             H      GLY 121  -1.292  11.057 -16.114
  899   1HA   GLY 121           2HA      GLY 121   0.027  11.332 -13.497
  900   2HA   GLY 121           1HA      GLY 121   0.340  12.319 -14.929
  901    H    LEU 122             H      LEU 122  -2.398  13.033 -15.430
  902    HA   LEU 122            HA      LEU 122  -2.738  15.304 -13.605
  903   1HB   LEU 122           2HB      LEU 122  -4.956  14.388 -15.435
  904   2HB   LEU 122           1HB      LEU 122  -4.473  16.027 -15.013
  905    HG   LEU 122            HG      LEU 122  -2.338  14.655 -16.442
  906   1HD1  LEU 122          2HD1      LEU 122  -4.319  13.434 -17.390
  907   2HD1  LEU 122          1HD1      LEU 122  -4.924  14.995 -17.953
  908   3HD1  LEU 122          3HD1      LEU 122  -3.400  14.366 -18.580
  909   1HD2  LEU 122          2HD2      LEU 122  -2.880  17.167 -16.029
  910   2HD2  LEU 122          1HD2      LEU 122  -2.206  16.686 -17.588
  911   3HD2  LEU 122          3HD2      LEU 122  -3.937  16.985 -17.433
  912    H    ILE 123             H      ILE 123  -4.231  12.196 -14.218
  913    HA   ILE 123            HA      ILE 123  -6.353  12.454 -12.295
  914    HB   ILE 123            HB      ILE 123  -4.915  10.166 -13.604
  915   1HG1  ILE 123          2HG1      ILE 123  -7.546  11.648 -14.038
  916   2HG1  ILE 123          1HG1      ILE 123  -6.246  11.378 -15.200
  917   1HG2  ILE 123          1HG2      ILE 123  -6.215   9.784 -11.198
  918   2HG2  ILE 123          3HG2      ILE 123  -7.535   9.572 -12.329
  919   3HG2  ILE 123          2HG2      ILE 123  -6.115   8.557 -12.443
  920   1HD1  ILE 123          1HD1      ILE 123  -8.037   9.207 -14.074
  921   2HD1  ILE 123          3HD1      ILE 123  -8.224   9.969 -15.647
  922   3HD1  ILE 123          2HD1      ILE 123  -6.791   9.003 -15.302
  923    H    ASN 124             H      ASN 124  -2.976  11.387 -12.240
  924    HA   ASN 124            HA      ASN 124  -2.959  10.440  -9.534
  925   1HB   ASN 124           2HB      ASN 124  -1.162   9.888 -11.180
  926   2HB   ASN 124           1HB      ASN 124  -0.679  11.586 -11.154
  927   1HD2  ASN 124          2HD2      ASN 124   0.769  11.393  -7.880
  928   2HD2  ASN 124          1HD2      ASN 124   0.023  12.457  -8.972
  929    H    LYS 125             H      LYS 125  -2.850  13.536 -11.074
  930    HA   LYS 125            HA      LYS 125  -1.921  15.008  -8.642
  931   1HB   LYS 125           2HB      LYS 125  -3.152  15.945 -11.296
  932   2HB   LYS 125           1HB      LYS 125  -2.470  17.013 -10.057
  933   1HG   LYS 125           2HG      LYS 125  -0.741  14.778 -10.973
  934   2HG   LYS 125           1HG      LYS 125  -1.034  16.062 -12.148
  935   1HD   LYS 125           2HD      LYS 125   0.489  17.349 -11.098
  936   2HD   LYS 125           1HD      LYS 125  -0.492  17.318  -9.635
  937   1HE   LYS 125           2HE      LYS 125   0.964  15.935  -8.603
  938   2HE   LYS 125           1HE      LYS 125   0.946  14.808  -9.956
  939   1HZ   LYS 125           2HZ      LYS 125   2.422  17.331 -10.230
  940   2HZ   LYS 125           1HZ      LYS 125   3.113  16.072  -9.323
  941   3HZ   LYS 125           3HZ      LYS 125   2.719  15.822 -10.954
  942    H    LYS 126             H      LYS 126  -4.972  14.095 -10.191
  943    HA   LYS 126            HA      LYS 126  -6.632  15.727  -8.393
  944   1HB   LYS 126           2HB      LYS 126  -7.097  14.045 -10.814
  945   2HB   LYS 126           1HB      LYS 126  -8.443  14.248  -9.691
  946   1HG   LYS 126           2HG      LYS 126  -8.782  16.142 -10.953
  947   2HG   LYS 126           1HG      LYS 126  -7.633  16.803  -9.806
  948   1HD   LYS 126           2HD      LYS 126  -6.819  17.444 -11.957
  949   2HD   LYS 126           1HD      LYS 126  -5.797  16.112 -11.436
  950   1HE   LYS 126           2HE      LYS 126  -6.308  15.113 -13.406
  951   2HE   LYS 126           1HE      LYS 126  -7.917  14.845 -12.751
  952   1HZ   LYS 126           2HZ      LYS 126  -8.420  17.170 -13.556
  953   2HZ   LYS 126           1HZ      LYS 126  -6.975  17.085 -14.442
  954   3HZ   LYS 126           3HZ      LYS 126  -8.230  15.987 -14.759
  955    H    CYS 127             H      CYS 127  -5.158  12.671  -8.323
  956    HA   CYS 127            HA      CYS 127  -7.112  11.402  -6.495
  957   1HB   CYS 127           2HB      CYS 127  -5.612  10.150  -8.277
  958   2HB   CYS 127           1HB      CYS 127  -4.362  10.309  -7.075
  959    HG   CYS 127            HG      CYS 127  -5.386   8.286  -6.077
  960    OH   TYR 128            OH      TYR 128   2.267  15.138  -2.108
  961    H    TYR 128             H      TYR 128  -4.076  13.057  -6.689
  962    HA   TYR 128            HA      TYR 128  -3.162  12.679  -4.003
  963   1HB   TYR 128           2HB      TYR 128  -1.962  13.490  -6.195
  964   2HB   TYR 128           1HB      TYR 128  -2.614  15.062  -5.794
  965    HD1  TYR 128           HD1      TYR 128  -1.626  12.922  -2.944
  966    HD2  TYR 128           HD2      TYR 128  -0.308  15.848  -5.820
  967    HE1  TYR 128           HE1      TYR 128   0.366  13.385  -1.548
  968    HE2  TYR 128           HE2      TYR 128   1.690  16.312  -4.402
  969    HH   TYR 128            HH      TYR 128   3.048  14.994  -2.652
  970    H    GLU 129             H      GLU 129  -5.296  14.953  -5.725
  971    HA   GLU 129            HA      GLU 129  -5.655  16.751  -3.410
  972   1HB   GLU 129           2HB      GLU 129  -6.995  16.517  -6.104
  973   2HB   GLU 129           1HB      GLU 129  -7.567  17.648  -4.877
  974   1HG   GLU 129           2HG      GLU 129  -5.048  18.372  -4.758
  975   2HG   GLU 129           1HG      GLU 129  -4.953  17.633  -6.358
  976    H    MET 130             H      MET 130  -7.436  14.101  -4.934
  977    HA   MET 130            HA      MET 130  -9.891  14.198  -3.472
  978   1HB   MET 130           2HB      MET 130  -8.912  12.671  -5.496
  979   2HB   MET 130           1HB      MET 130  -8.637  11.553  -4.173
  980   1HG   MET 130           2HG      MET 130 -11.112  11.890  -3.565
  981   2HG   MET 130           1HG      MET 130 -11.279  12.700  -5.141
  982   1HE   MET 130           2HE      MET 130 -12.870  10.641  -4.151
  983   2HE   MET 130           1HE      MET 130 -13.188  10.274  -5.843
  984   3HE   MET 130           3HE      MET 130 -12.685   8.990  -4.733
  985    H    ALA 131             H      ALA 131  -6.817  12.557  -2.847
  986    HA   ALA 131            HA      ALA 131  -7.532  11.613  -0.170
  987   1HB   ALA 131           3HB      ALA 131  -4.961  11.551  -1.799
  988   2HB   ALA 131           2HB      ALA 131  -5.083  10.931  -0.142
  989   3HB   ALA 131           1HB      ALA 131  -6.041  10.198  -1.428
  990    H    SER 132             H      SER 132  -6.179  14.504  -1.589
  991    HA   SER 132            HA      SER 132  -4.537  15.418   0.560
  992   1HB   SER 132           2HB      SER 132  -6.137  16.869  -1.532
  993   2HB   SER 132           1HB      SER 132  -5.363  17.761  -0.241
  994    HG   SER 132            HG      SER 132  -3.455  17.302  -1.053
  995    H    HIS 133             H      HIS 133  -8.046  15.397   0.004
  996    HA   HIS 133            HA      HIS 133  -8.502  16.879   2.490
  997   1HB   HIS 133           2HB      HIS 133 -10.125  16.908   0.519
  998   2HB   HIS 133           1HB      HIS 133 -10.684  15.307   1.099
  999    HD1  HIS 133           HD1      HIS 133 -11.893  15.236   3.359
 1000    HD2  HIS 133           HD2      HIS 133 -10.583  19.071   2.369
 1001    HE1  HIS 133           HE1      HIS 133 -12.948  16.813   5.043
 1002    H    LEU 134             H      LEU 134  -8.597  13.440   1.341
 1003    HA   LEU 134            HA      LEU 134  -9.629  12.500   3.899
 1004   1HB   LEU 134           2HB      LEU 134  -8.114  11.178   1.682
 1005   2HB   LEU 134           1HB      LEU 134  -8.507  10.326   3.171
 1006    HG   LEU 134            HG      LEU 134 -10.878  11.556   2.531
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.355  11.022   0.070
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.028  10.481   0.074
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.644  12.177   0.359
 1010   1HD2  LEU 134          3HD2      LEU 134 -10.415   9.208   3.336
 1011   2HD2  LEU 134          2HD2      LEU 134 -11.684   9.321   2.114
 1012   3HD2  LEU 134          1HD2      LEU 134 -10.068   8.787   1.662
 1013    NH1  ARG 135           NH1      ARG 135  -0.741  14.752   3.992
 1014    NH2  ARG 135           NH2      ARG 135   0.614  13.219   4.958
 1015    H    ARG 135             H      ARG 135  -6.638  13.798   3.150
 1016    HA   ARG 135            HA      ARG 135  -5.240  12.459   5.396
 1017   1HB   ARG 135           2HB      ARG 135  -4.347  14.475   3.306
 1018   2HB   ARG 135           1HB      ARG 135  -3.332  14.005   4.670
 1019   1HG   ARG 135           2HG      ARG 135  -3.907  11.560   3.858
 1020   2HG   ARG 135           1HG      ARG 135  -4.226  12.370   2.323
 1021   1HD   ARG 135           2HD      ARG 135  -1.878  11.597   2.470
 1022   2HD   ARG 135           1HD      ARG 135  -1.977  13.354   2.358
 1023    HE   ARG 135            HE      ARG 135  -1.661  12.021   5.015
 1024   1HH1  ARG 135          2HH1      ARG 135  -1.616  14.989   3.569
 1025   2HH1  ARG 135          1HH1      ARG 135  -0.032  15.448   4.096
 1026   1HH2  ARG 135          1HH2      ARG 135   0.777  12.285   5.273
 1027   2HH2  ARG 135          2HH2      ARG 135   1.324  13.914   5.065
 1028    NH1  ARG 136           NH1      ARG 136  -5.469  22.587   2.936
 1029    NH2  ARG 136           NH2      ARG 136  -4.502  21.237   1.401
 1030    H    ARG 136             H      ARG 136  -6.547  15.530   4.302
 1031    HA   ARG 136            HA      ARG 136  -6.026  16.879   6.831
 1032   1HB   ARG 136           2HB      ARG 136  -7.584  17.570   4.345
 1033   2HB   ARG 136           1HB      ARG 136  -7.681  18.577   5.786
 1034   1HG   ARG 136           2HG      ARG 136  -5.357  19.115   5.692
 1035   2HG   ARG 136           1HG      ARG 136  -5.038  17.835   4.516
 1036   1HD   ARG 136           2HD      ARG 136  -6.201  18.996   2.786
 1037   2HD   ARG 136           1HD      ARG 136  -6.918  20.131   3.925
 1038    HE   ARG 136            HE      ARG 136  -4.061  20.352   4.039
 1039   1HH1  ARG 136          2HH1      ARG 136  -5.816  22.739   3.862
 1040   2HH1  ARG 136          1HH1      ARG 136  -5.522  23.319   2.256
 1041   1HH2  ARG 136          1HH2      ARG 136  -4.106  20.355   1.150
 1042   2HH2  ARG 136          2HH2      ARG 136  -4.558  21.970   0.724
 1043    H    SER 137             H      SER 137  -8.133  14.465   5.854
 1044    HA   SER 137            HA      SER 137 -10.531  15.288   7.267
 1045   1HB   SER 137           2HB      SER 137 -11.437  13.214   6.474
 1046   2HB   SER 137           1HB      SER 137 -10.383  13.727   5.186
 1047    HG   SER 137            HG      SER 137  -9.960  11.588   5.635
 1048    H    GLN 138             H      GLN 138  -7.461  13.863   8.073
 1049    HA   GLN 138            HA      GLN 138  -6.631  13.246  10.202
 1050   1HB   GLN 138           2HB      GLN 138  -8.798  14.732  10.955
 1051   2HB   GLN 138           1HB      GLN 138  -9.265  13.150  11.578
 1052   1HG   GLN 138           2HG      GLN 138  -6.737  13.152  12.436
 1053   2HG   GLN 138           1HG      GLN 138  -6.979  14.897  12.369
 1054   1HE2  GLN 138          2HE2      GLN 138  -9.222  14.972  15.117
 1055   2HE2  GLN 138          1HE2      GLN 138  -8.556  15.849  13.826
 1056    OH   TYR 139            OH      TYR 139 -14.204  12.040   9.505
 1057    H    TYR 139             H      TYR 139  -7.983  11.493   8.104
 1058    HA   TYR 139            HA      TYR 139  -8.570   9.126   9.817
 1059   1HB   TYR 139           2HB      TYR 139  -9.235   9.557   6.865
 1060   2HB   TYR 139           1HB      TYR 139  -9.712   8.172   7.854
 1061    HD1  TYR 139           HD1      TYR 139 -10.374   9.760  10.435
 1062    HD2  TYR 139           HD2      TYR 139 -11.418  10.372   6.307
 1063    HE1  TYR 139           HE1      TYR 139 -12.420  10.975  11.133
 1064    HE2  TYR 139           HE2      TYR 139 -13.462  11.587   7.010
 1065    HH   TYR 139            HH      TYR 139 -13.988  12.974   9.550
   
  Start of MODEL           3
 Raw file had 1065 H/Q atoms
  Start of MODEL    3
    1   1H    ALA   1            1H      ALA   1 -20.771  17.382   0.015
    2   2H    ALA   1            3H      ALA   1 -21.324  16.259   1.157
    3   3H    ALA   1            2H      ALA   1 -22.253  17.637   0.804
    4    HA   ALA   1            HA      ALA   1 -20.878  19.055   1.952
    5   1HB   ALA   1           3HB      ALA   1 -22.015  17.494   3.488
    6   2HB   ALA   1           2HB      ALA   1 -20.648  16.384   3.373
    7   3HB   ALA   1           1HB      ALA   1 -20.439  17.967   4.121
    8    H    GLY   2             H      GLY   2 -19.154  15.910   1.683
    9   1HA   GLY   2           2HA      GLY   2 -16.658  17.406   1.039
   10   2HA   GLY   2           1HA      GLY   2 -16.620  16.261   2.380
   11    CH2  TRP   3           CH2      TRP   3 -13.158  11.272   3.777
   12    H    TRP   3             H      TRP   3 -17.491  13.985   1.771
   13    HA   TRP   3            HA      TRP   3 -15.891  12.701  -0.083
   14   1HB   TRP   3           2HB      TRP   3 -18.518  12.071   0.993
   15   2HB   TRP   3           1HB      TRP   3 -17.893  11.064  -0.255
   16    HD1  TRP   3           HD1      TRP   3 -18.112   9.323   1.820
   17    HE1  TRP   3           HE1      TRP   3 -16.347   8.535   3.504
   18    HE3  TRP   3           HE3      TRP   3 -14.766  13.145   1.469
   19    HZ2  TRP   3           HZ2      TRP   3 -13.869   9.404   4.557
   20    HZ3  TRP   3           HZ3      TRP   3 -12.711  13.140   2.819
   21    HH2  TRP   3           HH2      TRP   3 -12.256  11.269   4.371
   22    H    ASN   4             H      ASN   4 -19.293  13.640  -0.664
   23    HA   ASN   4            HA      ASN   4 -19.535  12.888  -3.368
   24   1HB   ASN   4           2HB      ASN   4 -20.942  14.898  -1.654
   25   2HB   ASN   4           1HB      ASN   4 -21.310  14.825  -3.375
   26   1HD2  ASN   4          2HD2      ASN   4 -22.519  11.790  -0.919
   27   2HD2  ASN   4          1HD2      ASN   4 -21.448  12.975  -0.345
   28    H    ALA   5             H      ALA   5 -18.144  15.805  -2.076
   29    HA   ALA   5            HA      ALA   5 -18.040  17.293  -4.621
   30   1HB   ALA   5           2HB      ALA   5 -17.148  17.693  -1.843
   31   2HB   ALA   5           1HB      ALA   5 -15.948  18.250  -3.009
   32   3HB   ALA   5           3HB      ALA   5 -17.587  18.890  -3.058
   33    OH   TYR   6            OH      TYR   6 -13.796  17.456   1.389
   34    H    TYR   6             H      TYR   6 -16.010  15.048  -2.860
   35    HA   TYR   6            HA      TYR   6 -13.702  15.231  -4.554
   36   1HB   TYR   6           2HB      TYR   6 -14.534  12.946  -2.728
   37   2HB   TYR   6           1HB      TYR   6 -12.896  13.374  -3.185
   38    HD1  TYR   6           HD2      TYR   6 -13.620  16.516  -3.019
   39    HD2  TYR   6           HD1      TYR   6 -13.968  13.232  -0.314
   40    HE1  TYR   6           HE2      TYR   6 -13.588  18.102  -1.131
   41    HE2  TYR   6           HE1      TYR   6 -13.958  14.834   1.589
   42    HH   TYR   6            HH      TYR   6 -14.493  17.187   1.989
   43    H    ILE   7             H      ILE   7 -16.763  13.867  -4.805
   44    HA   ILE   7            HA      ILE   7 -16.104  12.010  -6.994
   45    HB   ILE   7            HB      ILE   7 -18.587  12.649  -5.466
   46   1HG1  ILE   7          2HG1      ILE   7 -16.638  11.099  -4.722
   47   2HG1  ILE   7          1HG1      ILE   7 -18.286  10.509  -4.536
   48   1HG2  ILE   7          1HG2      ILE   7 -18.326  11.409  -8.137
   49   2HG2  ILE   7          3HG2      ILE   7 -19.383  10.580  -6.990
   50   3HG2  ILE   7          2HG2      ILE   7 -19.694  12.266  -7.427
   51   1HD1  ILE   7          3HD1      ILE   7 -17.064   9.903  -7.142
   52   2HD1  ILE   7          2HD1      ILE   7 -16.245   9.150  -5.781
   53   3HD1  ILE   7          1HD1      ILE   7 -17.961   8.852  -6.054
   54    H    ASP   8             H      ASP   8 -17.312  15.199  -6.326
   55    HA   ASP   8            HA      ASP   8 -18.410  15.890  -8.816
   56   1HB   ASP   8           2HB      ASP   8 -17.538  17.315  -6.426
   57   2HB   ASP   8           1HB      ASP   8 -17.685  18.266  -7.845
   58    H    ASN   9             H      ASN   9 -15.247  15.364  -7.732
   59    HA   ASN   9            HA      ASN   9 -13.647  16.932  -9.392
   60   1HB   ASN   9           2HB      ASN   9 -12.408  15.911  -7.755
   61   2HB   ASN   9           1HB      ASN   9 -13.496  14.643  -7.585
   62   1HD2  ASN   9          2HD2      ASN   9 -11.179  12.159  -8.922
   63   2HD2  ASN   9          1HD2      ASN   9 -12.396  12.541  -7.769
   64    H    LEU  10             H      LEU  10 -14.139  13.621  -9.798
   65    HA   LEU  10            HA      LEU  10 -13.463  12.902 -12.335
   66   1HB   LEU  10           2HB      LEU  10 -16.066  12.086 -11.137
   67   2HB   LEU  10           1HB      LEU  10 -15.131  11.192 -12.330
   68    HG   LEU  10            HG      LEU  10 -14.590  10.114 -10.430
   69   1HD1  LEU  10          3HD1      LEU  10 -12.525  12.352 -10.618
   70   2HD1  LEU  10          2HD1      LEU  10 -12.262  10.891  -9.711
   71   3HD1  LEU  10          1HD1      LEU  10 -12.482  10.811 -11.439
   72   1HD2  LEU  10          1HD2      LEU  10 -15.351  12.632  -9.138
   73   2HD2  LEU  10          3HD2      LEU  10 -15.591  11.026  -8.566
   74   3HD2  LEU  10          2HD2      LEU  10 -14.062  11.836  -8.311
   75    H    MET  11             H      MET  11 -16.328  14.381 -11.274
   76    HA   MET  11            HA      MET  11 -17.547  14.251 -13.890
   77   1HB   MET  11           2HB      MET  11 -18.305  15.969 -11.493
   78   2HB   MET  11           1HB      MET  11 -19.375  15.343 -12.746
   79   1HG   MET  11           2HG      MET  11 -17.800  13.165 -11.174
   80   2HG   MET  11           1HG      MET  11 -19.088  14.049 -10.295
   81   1HE   MET  11           1HE      MET  11 -17.931  12.067 -13.076
   82   2HE   MET  11           3HE      MET  11 -19.308  11.188 -13.760
   83   3HE   MET  11           2HE      MET  11 -18.975  12.844 -14.262
   84    H    ALA  12             H      ALA  12 -15.983  16.779 -12.019
   85    HA   ALA  12            HA      ALA  12 -16.036  18.865 -14.039
   86   1HB   ALA  12           2HB      ALA  12 -14.791  18.608 -11.286
   87   2HB   ALA  12           1HB      ALA  12 -14.642  20.070 -12.297
   88   3HB   ALA  12           3HB      ALA  12 -16.236  19.539 -11.754
   89    H    ASP  13             H      ASP  13 -13.880  16.269 -13.655
   90    HA   ASP  13            HA      ASP  13 -11.407  17.794 -14.407
   91   1HB   ASP  13           2HB      ASP  13 -10.369  15.394 -14.066
   92   2HB   ASP  13           1HB      ASP  13 -10.803  16.397 -12.690
   93    H    GLY  14             H      GLY  14 -13.688  16.157 -16.177
   94   1HA   GLY  14           2HA      GLY  14 -13.558  14.897 -18.230
   95   2HA   GLY  14           1HA      GLY  14 -12.767  16.368 -18.720
   96    H    THR  15             H      THR  15 -11.389  13.932 -16.574
   97    HA   THR  15            HA      THR  15  -9.596  12.763 -18.585
   98    HB   THR  15            HB      THR  15  -8.693  14.324 -16.184
   99    HG1  THR  15           HG1      THR  15  -7.370  15.301 -17.719
  100   1HG2  THR  15          2HG2      THR  15  -7.457  12.029 -17.659
  101   2HG2  THR  15          1HG2      THR  15  -6.414  13.303 -16.958
  102   3HG2  THR  15          3HG2      THR  15  -7.516  12.392 -15.923
  103    H    CYS  16             H      CYS  16 -10.306  13.122 -15.230
  104    HA   CYS  16            HA      CYS  16 -10.211  10.238 -14.899
  105   1HB   CYS  16           2HB      CYS  16 -10.847  11.071 -12.395
  106   2HB   CYS  16           1HB      CYS  16  -9.218  10.765 -12.981
  107    HG   CYS  16            HG      CYS  16  -9.002  13.334 -13.341
  108    H    GLN  17             H      GLN  17 -11.763   9.074 -15.327
  109    HA   GLN  17            HA      GLN  17 -14.346  10.205 -15.888
  110   1HB   GLN  17           2HB      GLN  17 -12.881   8.413 -17.067
  111   2HB   GLN  17           1HB      GLN  17 -13.785   7.314 -16.045
  112   1HG   GLN  17           2HG      GLN  17 -15.095   9.392 -17.810
  113   2HG   GLN  17           1HG      GLN  17 -14.790   7.743 -18.339
  114   1HE2  GLN  17          2HE2      GLN  17 -18.049   8.494 -16.153
  115   2HE2  GLN  17          1HE2      GLN  17 -17.117   9.701 -16.898
  116    H    ASP  18             H      ASP  18 -13.009   7.827 -13.644
  117    HA   ASP  18            HA      ASP  18 -15.556   7.942 -12.122
  118   1HB   ASP  18           2HB      ASP  18 -14.880   5.701 -13.337
  119   2HB   ASP  18           1HB      ASP  18 -13.938   5.481 -11.887
  120    H    ALA  19             H      ALA  19 -14.934   6.890  -9.772
  121    HA   ALA  19            HA      ALA  19 -12.334   7.805  -8.640
  122   1HB   ALA  19           2HB      ALA  19 -14.821   9.381  -8.686
  123   2HB   ALA  19           1HB      ALA  19 -13.878   9.376  -7.187
  124   3HB   ALA  19           3HB      ALA  19 -13.143   9.873  -8.682
  125    H    ALA  20             H      ALA  20 -12.130   6.230  -6.899
  126    HA   ALA  20            HA      ALA  20 -14.794   5.784  -5.478
  127   1HB   ALA  20           2HB      ALA  20 -13.051   3.726  -6.574
  128   2HB   ALA  20           1HB      ALA  20 -13.741   3.409  -4.979
  129   3HB   ALA  20           3HB      ALA  20 -14.789   3.777  -6.343
  130    H    ILE  21             H      ILE  21 -14.652   6.809  -3.751
  131    HA   ILE  21            HA      ILE  21 -12.273   6.631  -1.987
  132    HB   ILE  21            HB      ILE  21 -15.010   7.867  -1.494
  133   1HG1  ILE  21          2HG1      ILE  21 -12.403   9.009  -2.571
  134   2HG1  ILE  21          1HG1      ILE  21 -13.976   9.013  -3.362
  135   1HG2  ILE  21          1HG2      ILE  21 -12.345   8.084  -0.033
  136   2HG2  ILE  21          3HG2      ILE  21 -13.748   9.096   0.318
  137   3HG2  ILE  21          2HG2      ILE  21 -13.824   7.354   0.590
  138   1HD1  ILE  21          1HD1      ILE  21 -14.821  10.471  -1.501
  139   2HD1  ILE  21          3HD1      ILE  21 -13.170  10.550  -0.895
  140   3HD1  ILE  21          2HD1      ILE  21 -13.561  11.224  -2.476
  141    H    VAL  22             H      VAL  22 -12.162   4.592  -1.023
  142    HA   VAL  22            HA      VAL  22 -14.739   3.252  -0.356
  143    HB   VAL  22            HB      VAL  22 -12.056   1.980  -1.052
  144   1HG1  VAL  22          1HG1      VAL  22 -13.718   0.693   0.422
  145   2HG1  VAL  22          3HG1      VAL  22 -14.778   0.656  -0.989
  146   3HG1  VAL  22          2HG1      VAL  22 -13.188  -0.120  -1.054
  147   1HG2  VAL  22          1HG2      VAL  22 -13.645   3.295  -2.827
  148   2HG2  VAL  22          3HG2      VAL  22 -12.682   1.876  -3.253
  149   3HG2  VAL  22          2HG2      VAL  22 -14.396   1.702  -2.861
  150    H    GLY  23             H      GLY  23 -15.028   3.170   1.877
  151   1HA   GLY  23           2HA      GLY  23 -12.888   3.402   3.838
  152   2HA   GLY  23           1HA      GLY  23 -14.550   2.888   4.191
  153    OH   TYR  24            OH      TYR  24  -5.530   1.392   5.259
  154    H    TYR  24             H      TYR  24 -11.457   1.792   3.065
  155    HA   TYR  24            HA      TYR  24 -12.067  -0.992   2.764
  156   1HB   TYR  24           2HB      TYR  24  -9.897  -1.104   1.782
  157   2HB   TYR  24           1HB      TYR  24 -10.352   0.542   1.535
  158    HD1  TYR  24           HD2      TYR  24  -9.905   1.861   4.131
  159    HD2  TYR  24           HD1      TYR  24  -7.659  -1.203   2.232
  160    HE1  TYR  24           HE2      TYR  24  -7.911   2.513   5.421
  161    HE2  TYR  24           HE1      TYR  24  -5.659  -0.564   3.487
  162    HH   TYR  24            HH      TYR  24  -4.835   1.607   4.631
  163    H    LYS  25             H      LYS  25 -12.431   0.106   5.572
  164    HA   LYS  25            HA      LYS  25 -10.311  -0.827   7.231
  165   1HB   LYS  25           2HB      LYS  25 -13.062   0.110   7.652
  166   2HB   LYS  25           1HB      LYS  25 -12.239  -0.680   8.956
  167   1HG   LYS  25           2HG      LYS  25 -11.678   1.569   9.286
  168   2HG   LYS  25           1HG      LYS  25 -10.285   0.916   8.437
  169   1HD   LYS  25           2HD      LYS  25 -10.627   2.229   6.664
  170   2HD   LYS  25           1HD      LYS  25 -12.331   1.792   6.579
  171   1HE   LYS  25           2HE      LYS  25 -11.120   3.870   8.405
  172   2HE   LYS  25           1HE      LYS  25 -12.129   4.182   7.009
  173   1HZ   LYS  25           3HZ      LYS  25 -13.747   2.603   8.281
  174   2HZ   LYS  25           2HZ      LYS  25 -12.855   3.121   9.633
  175   3HZ   LYS  25           1HZ      LYS  25 -13.663   4.251   8.661
  176    H    ASP  26             H      ASP  26 -11.905  -2.372   9.102
  177    HA   ASP  26            HA      ASP  26 -11.421  -5.020   8.573
  178   1HB   ASP  26           2HB      ASP  26 -13.692  -5.504   9.767
  179   2HB   ASP  26           1HB      ASP  26 -12.390  -4.761  10.667
  180    H    SER  27             H      SER  27 -14.594  -3.610   7.807
  181    HA   SER  27            HA      SER  27 -14.919  -5.505   5.585
  182   1HB   SER  27           2HB      SER  27 -17.331  -4.709   5.820
  183   2HB   SER  27           1HB      SER  27 -16.756  -5.748   7.094
  184    HG   SER  27            HG      SER  27 -16.820  -4.115   8.444
  185    HA   PRO  28            HA      PRO  28 -14.138  -1.746   3.392
  186   1HB   PRO  28           2HB      PRO  28 -14.187  -2.788   0.864
  187   2HB   PRO  28           1HB      PRO  28 -12.792  -2.875   1.955
  188   1HG   PRO  28           2HG      PRO  28 -14.630  -5.029   1.158
  189   2HG   PRO  28           1HG      PRO  28 -13.047  -5.125   1.889
  190   1HD   PRO  28           2HD      PRO  28 -15.565  -5.475   3.161
  191   2HD   PRO  28           1HD      PRO  28 -13.945  -5.535   3.896
  192    H    SER  29             H      SER  29 -15.291  -0.240   2.132
  193    HA   SER  29            HA      SER  29 -17.847  -0.943   1.009
  194   1HB   SER  29           2HB      SER  29 -19.028   0.796   2.392
  195   2HB   SER  29           1HB      SER  29 -18.583  -0.661   3.272
  196    HG   SER  29            HG      SER  29 -17.875   1.855   3.755
  197    H    VAL  30             H      VAL  30 -18.791   0.884  -0.082
  198    HA   VAL  30            HA      VAL  30 -16.715   2.560  -1.218
  199    HB   VAL  30            HB      VAL  30 -19.572   1.942  -1.937
  200   1HG1  VAL  30          2HG1      VAL  30 -18.941   4.258  -2.616
  201   2HG1  VAL  30          1HG1      VAL  30 -17.535   3.589  -3.448
  202   3HG1  VAL  30          3HG1      VAL  30 -19.159   3.179  -3.998
  203   1HG2  VAL  30          2HG2      VAL  30 -16.839   1.159  -2.922
  204   2HG2  VAL  30          1HG2      VAL  30 -18.147   0.104  -2.367
  205   3HG2  VAL  30          3HG2      VAL  30 -18.279   0.948  -3.898
  206    CH2  TRP  31           CH2      TRP  31 -13.735   5.972   6.536
  207    H    TRP  31             H      TRP  31 -16.341   4.184   0.198
  208    HA   TRP  31            HA      TRP  31 -18.318   5.545   1.748
  209   1HB   TRP  31           2HB      TRP  31 -15.416   5.938   1.103
  210   2HB   TRP  31           1HB      TRP  31 -16.301   7.282   1.821
  211    HD1  TRP  31           HD1      TRP  31 -17.733   4.069   2.970
  212    HE1  TRP  31           HE1      TRP  31 -16.961   3.529   5.318
  213    HE3  TRP  31           HE3      TRP  31 -13.906   7.435   3.476
  214    HZ2  TRP  31           HZ2      TRP  31 -15.009   4.382   7.220
  215    HZ3  TRP  31           HZ3      TRP  31 -12.630   7.548   5.584
  216    HH2  TRP  31           HH2      TRP  31 -13.165   6.019   7.452
  217    H    ALA  32             H      ALA  32 -17.184   5.851  -1.515
  218    HA   ALA  32            HA      ALA  32 -19.253   7.559  -2.365
  219   1HB   ALA  32           3HB      ALA  32 -16.696   9.020  -1.597
  220   2HB   ALA  32           2HB      ALA  32 -17.861   9.698  -2.755
  221   3HB   ALA  32           1HB      ALA  32 -18.352   9.385  -1.080
  222    H    ALA  33             H      ALA  33 -19.009   5.893  -4.038
  223    HA   ALA  33            HA      ALA  33 -16.809   6.517  -5.941
  224   1HB   ALA  33           2HB      ALA  33 -18.210   3.854  -5.591
  225   2HB   ALA  33           1HB      ALA  33 -16.983   4.205  -6.795
  226   3HB   ALA  33           3HB      ALA  33 -16.561   4.219  -5.083
  227    H    VAL  34             H      VAL  34 -17.454   7.141  -7.938
  228    HA   VAL  34            HA      VAL  34 -20.059   7.966  -8.592
  229    HB   VAL  34            HB      VAL  34 -17.879   6.999 -10.457
  230   1HG1  VAL  34          3HG1      VAL  34 -20.597   7.963 -10.976
  231   2HG1  VAL  34          2HG1      VAL  34 -19.368   8.940 -11.789
  232   3HG1  VAL  34          1HG1      VAL  34 -19.455   7.194 -12.079
  233   1HG2  VAL  34          2HG2      VAL  34 -18.557   9.625  -9.162
  234   2HG2  VAL  34          1HG2      VAL  34 -16.990   8.819  -9.269
  235   3HG2  VAL  34          3HG2      VAL  34 -17.686   9.594 -10.696
  236    HA   PRO  35            HA      PRO  35 -21.864   3.813  -8.978
  237   1HB   PRO  35           2HB      PRO  35 -24.490   4.613  -9.070
  238   2HB   PRO  35           1HB      PRO  35 -23.561   4.453  -7.569
  239   1HG   PRO  35           2HG      PRO  35 -24.388   6.942  -9.005
  240   2HG   PRO  35           1HG      PRO  35 -24.013   6.710  -7.285
  241   1HD   PRO  35           2HD      PRO  35 -22.289   7.856  -9.239
  242   2HD   PRO  35           1HD      PRO  35 -21.838   7.367  -7.593
  243    H    GLY  36             H      GLY  36 -22.479   2.574 -10.735
  244   1HA   GLY  36           2HA      GLY  36 -23.878   2.403 -12.797
  245   2HA   GLY  36           1HA      GLY  36 -23.328   4.025 -13.207
  246    H    LYS  37             H      LYS  37 -20.514   2.993 -12.094
  247    HA   LYS  37            HA      LYS  37 -19.738   1.853 -14.734
  248   1HB   LYS  37           2HB      LYS  37 -18.014   3.278 -12.685
  249   2HB   LYS  37           1HB      LYS  37 -17.457   2.685 -14.248
  250   1HG   LYS  37           2HG      LYS  37 -19.457   4.911 -13.706
  251   2HG   LYS  37           1HG      LYS  37 -17.926   5.023 -14.572
  252   1HD   LYS  37           2HD      LYS  37 -18.878   3.478 -16.326
  253   2HD   LYS  37           1HD      LYS  37 -20.429   3.568 -15.491
  254   1HE   LYS  37           2HE      LYS  37 -20.903   5.553 -16.437
  255   2HE   LYS  37           1HE      LYS  37 -19.345   6.225 -15.955
  256   1HZ   LYS  37           3HZ      LYS  37 -19.566   4.342 -18.218
  257   2HZ   LYS  37           2HZ      LYS  37 -19.843   6.004 -18.434
  258   3HZ   LYS  37           1HZ      LYS  37 -18.332   5.455 -17.883
  259    H    THR  38             H      THR  38 -17.662   1.541 -11.841
  260    HA   THR  38            HA      THR  38 -18.238  -1.324 -11.597
  261    HB   THR  38            HB      THR  38 -16.054  -0.253 -13.244
  262    HG1  THR  38           HG1      THR  38 -16.579  -1.935 -14.484
  263   1HG2  THR  38          2HG2      THR  38 -15.412  -2.209 -11.142
  264   2HG2  THR  38          1HG2      THR  38 -15.002  -2.757 -12.758
  265   3HG2  THR  38          3HG2      THR  38 -14.316  -1.243 -12.142
  266    H    PHE  39             H      PHE  39 -16.128   1.357 -10.643
  267    HA   PHE  39            HA      PHE  39 -14.684   0.090  -8.566
  268   1HB   PHE  39           2HB      PHE  39 -15.578   2.926  -8.927
  269   2HB   PHE  39           1HB      PHE  39 -14.563   2.392  -7.605
  270    HD1  PHE  39           HD2      PHE  39 -14.081   0.636 -10.794
  271    HD2  PHE  39           HD1      PHE  39 -12.794   3.998  -8.445
  272    HE1  PHE  39           HE2      PHE  39 -12.086   0.857 -12.210
  273    HE2  PHE  39           HE1      PHE  39 -10.776   4.219  -9.866
  274    HZ   PHE  39            HZ      PHE  39 -10.445   2.614 -11.749
  275    H    VAL  40             H      VAL  40 -17.789   1.738  -8.395
  276    HA   VAL  40            HA      VAL  40 -18.135   1.734  -5.599
  277    HB   VAL  40            HB      VAL  40 -19.618   3.126  -6.832
  278   1HG1  VAL  40          2HG1      VAL  40 -20.152   0.628  -8.405
  279   2HG1  VAL  40          1HG1      VAL  40 -21.275   1.987  -8.443
  280   3HG1  VAL  40          3HG1      VAL  40 -19.605   2.210  -8.972
  281   1HG2  VAL  40          3HG2      VAL  40 -20.600   1.380  -4.960
  282   2HG2  VAL  40          2HG2      VAL  40 -21.554   2.678  -5.684
  283   3HG2  VAL  40          1HG2      VAL  40 -21.668   1.037  -6.323
  284    H    ASN  41             H      ASN  41 -18.249  -0.868  -7.852
  285    HA   ASN  41            HA      ASN  41 -19.798  -2.633  -6.138
  286   1HB   ASN  41           2HB      ASN  41 -18.286  -3.007  -8.736
  287   2HB   ASN  41           1HB      ASN  41 -19.171  -4.273  -7.928
  288   1HD2  ASN  41          2HD2      ASN  41 -21.714  -3.133 -10.227
  289   2HD2  ASN  41          1HD2      ASN  41 -20.404  -4.204 -10.117
  290    H    ILE  42             H      ILE  42 -17.084  -1.318  -5.318
  291    HA   ILE  42            HA      ILE  42 -15.177  -3.432  -5.348
  292    HB   ILE  42            HB      ILE  42 -15.331  -0.642  -4.242
  293   1HG1  ILE  42          2HG1      ILE  42 -13.039  -1.997  -5.663
  294   2HG1  ILE  42          1HG1      ILE  42 -14.469  -1.487  -6.553
  295   1HG2  ILE  42          3HG2      ILE  42 -13.479  -2.779  -3.195
  296   2HG2  ILE  42          2HG2      ILE  42 -12.954  -1.105  -3.268
  297   3HG2  ILE  42          1HG2      ILE  42 -14.355  -1.543  -2.301
  298   1HD1  ILE  42          1HD1      ILE  42 -14.018   0.793  -5.215
  299   2HD1  ILE  42          3HD1      ILE  42 -12.367   0.168  -5.230
  300   3HD1  ILE  42          2HD1      ILE  42 -13.216   0.447  -6.755
  301    H    THR  43             H      THR  43 -15.027  -5.036  -4.021
  302    HA   THR  43            HA      THR  43 -16.415  -5.249  -1.390
  303    HB   THR  43            HB      THR  43 -16.072  -7.785  -2.045
  304    HG1  THR  43           HG1      THR  43 -14.643  -7.200  -3.781
  305   1HG2  THR  43          3HG2      THR  43 -18.032  -5.835  -3.059
  306   2HG2  THR  43          2HG2      THR  43 -18.005  -7.401  -3.878
  307   3HG2  THR  43          1HG2      THR  43 -18.300  -7.320  -2.140
  308    HA   PRO  44            HA      PRO  44 -12.357  -6.090   0.413
  309   1HB   PRO  44           2HB      PRO  44 -12.518  -8.445   1.697
  310   2HB   PRO  44           1HB      PRO  44 -13.143  -6.957   2.349
  311   1HG   PRO  44           2HG      PRO  44 -14.635  -9.245   1.151
  312   2HG   PRO  44           1HG      PRO  44 -15.181  -8.057   2.348
  313   1HD   PRO  44           2HD      PRO  44 -15.860  -8.020  -0.345
  314   2HD   PRO  44           1HD      PRO  44 -15.998  -6.631   0.728
  315    H    ALA  45             H      ALA  45 -13.376  -7.965  -2.036
  316    HA   ALA  45            HA      ALA  45 -11.103  -9.768  -2.260
  317   1HB   ALA  45           3HB      ALA  45 -13.543  -9.163  -3.874
  318   2HB   ALA  45           2HB      ALA  45 -12.207 -10.049  -4.613
  319   3HB   ALA  45           1HB      ALA  45 -13.028 -10.711  -3.200
  320    H    GLU  46             H      GLU  46 -12.504  -7.324  -4.305
  321    HA   GLU  46            HA      GLU  46 -10.147  -6.790  -5.833
  322   1HB   GLU  46           2HB      GLU  46 -11.395  -4.450  -6.192
  323   2HB   GLU  46           1HB      GLU  46 -11.926  -5.899  -7.022
  324   1HG   GLU  46           2HG      GLU  46 -13.062  -5.476  -4.338
  325   2HG   GLU  46           1HG      GLU  46 -13.488  -4.263  -5.532
  326    H    VAL  47             H      VAL  47 -11.346  -5.534  -2.831
  327    HA   VAL  47            HA      VAL  47  -9.245  -3.581  -2.568
  328    HB   VAL  47            HB      VAL  47 -11.734  -4.114  -1.189
  329   1HG1  VAL  47          2HG1      VAL  47 -10.121  -4.526   0.641
  330   2HG1  VAL  47          1HG1      VAL  47  -9.476  -2.923   0.300
  331   3HG1  VAL  47          3HG1      VAL  47 -11.128  -3.084   0.868
  332   1HG2  VAL  47          2HG2      VAL  47 -10.939  -2.108  -2.630
  333   2HG2  VAL  47          1HG2      VAL  47 -11.855  -1.763  -1.164
  334   3HG2  VAL  47          3HG2      VAL  47 -10.071  -1.602  -1.132
  335    H    GLY  48             H      GLY  48  -9.742  -6.876  -1.785
  336   1HA   GLY  48           2HA      GLY  48  -7.902  -7.204   0.362
  337   2HA   GLY  48           1HA      GLY  48  -8.347  -8.460  -0.798
  338    H    VAL  49             H      VAL  49  -7.463  -6.840  -3.083
  339    HA   VAL  49            HA      VAL  49  -4.549  -7.351  -2.823
  340    HB   VAL  49            HB      VAL  49  -5.744  -8.421  -4.753
  341   1HG1  VAL  49          1HG1      VAL  49  -6.090  -5.525  -5.568
  342   2HG1  VAL  49          3HG1      VAL  49  -6.158  -6.848  -6.725
  343   3HG1  VAL  49          2HG1      VAL  49  -7.338  -6.758  -5.414
  344   1HG2  VAL  49          1HG2      VAL  49  -3.381  -6.602  -4.995
  345   2HG2  VAL  49          3HG2      VAL  49  -3.478  -8.351  -5.203
  346   3HG2  VAL  49          2HG2      VAL  49  -4.036  -7.280  -6.489
  347    H    LEU  50             H      LEU  50  -6.782  -4.791  -3.546
  348    HA   LEU  50            HA      LEU  50  -4.973  -2.738  -4.309
  349   1HB   LEU  50           2HB      LEU  50  -7.694  -2.937  -3.279
  350   2HB   LEU  50           1HB      LEU  50  -6.949  -1.412  -3.137
  351    HG   LEU  50            HG      LEU  50  -7.069  -2.856  -5.757
  352   1HD1  LEU  50          2HD1      LEU  50  -9.132  -0.991  -4.460
  353   2HD1  LEU  50          1HD1      LEU  50  -9.141  -1.456  -6.175
  354   3HD1  LEU  50          3HD1      LEU  50  -9.383  -2.685  -4.928
  355   1HD2  LEU  50          2HD2      LEU  50  -5.643  -0.713  -5.145
  356   2HD2  LEU  50          1HD2      LEU  50  -6.543  -0.756  -6.662
  357   3HD2  LEU  50          3HD2      LEU  50  -7.196   0.113  -5.270
  358    H    VAL  51             H      VAL  51  -5.679  -4.223  -1.314
  359    HA   VAL  51            HA      VAL  51  -3.980  -2.271   0.135
  360    HB   VAL  51            HB      VAL  51  -5.729  -1.705   1.669
  361   1HG1  VAL  51          1HG1      VAL  51  -7.171  -2.220  -0.926
  362   2HG1  VAL  51          3HG1      VAL  51  -7.748  -1.168   0.359
  363   3HG1  VAL  51          2HG1      VAL  51  -6.277  -0.763  -0.510
  364   1HG2  VAL  51          3HG2      VAL  51  -6.710  -4.440   1.094
  365   2HG2  VAL  51          2HG2      VAL  51  -6.797  -3.509   2.592
  366   3HG2  VAL  51          1HG2      VAL  51  -7.983  -3.236   1.322
  367    H    GLY  52             H      GLY  52  -4.729  -5.551  -0.407
  368   1HA   GLY  52           2HA      GLY  52  -4.462  -6.829   2.047
  369   2HA   GLY  52           1HA      GLY  52  -3.903  -7.511   0.528
  370    H    LYS  53             H      LYS  53  -2.425  -8.239   2.412
  371    HA   LYS  53            HA      LYS  53  -0.253  -6.460   2.988
  372   1HB   LYS  53           2HB      LYS  53   0.658  -8.281   4.356
  373   2HB   LYS  53           1HB      LYS  53  -1.039  -8.015   4.745
  374   1HG   LYS  53           2HG      LYS  53  -1.178 -10.289   4.441
  375   2HG   LYS  53           1HG      LYS  53  -1.294  -9.837   2.736
  376   1HD   LYS  53           2HD      LYS  53   0.493 -11.241   2.500
  377   2HD   LYS  53           1HD      LYS  53   1.411  -9.841   3.055
  378   1HE   LYS  53           2HE      LYS  53   0.214 -11.681   5.100
  379   2HE   LYS  53           1HE      LYS  53   1.689 -12.176   4.270
  380   1HZ   LYS  53           2HZ      LYS  53   2.659 -10.003   4.908
  381   2HZ   LYS  53           1HZ      LYS  53   1.271  -9.691   5.841
  382   3HZ   LYS  53           3HZ      LYS  53   2.285 -10.990   6.240
  383    H    ASP  54             H      ASP  54  -1.007  -8.838   0.664
  384    HA   ASP  54            HA      ASP  54   1.375  -9.911  -0.135
  385   1HB   ASP  54           2HB      ASP  54  -0.968 -10.364  -1.043
  386   2HB   ASP  54           1HB      ASP  54  -0.712  -8.967  -2.089
  387    NH1  ARG  55           NH1      ARG  55   8.362  -6.991   2.357
  388    NH2  ARG  55           NH2      ARG  55   8.491  -4.766   1.960
  389    H    ARG  55             H      ARG  55   3.069  -9.107  -1.152
  390    HA   ARG  55            HA      ARG  55   3.011  -6.495  -2.383
  391   1HB   ARG  55           2HB      ARG  55   4.991  -5.741  -1.152
  392   2HB   ARG  55           1HB      ARG  55   3.704  -6.167  -0.026
  393   1HG   ARG  55           2HG      ARG  55   4.976  -7.775   0.928
  394   2HG   ARG  55           1HG      ARG  55   5.308  -8.511  -0.637
  395   1HD   ARG  55           2HD      ARG  55   7.435  -7.853   0.211
  396   2HD   ARG  55           1HD      ARG  55   7.016  -6.630  -0.989
  397    HE   ARG  55            HE      ARG  55   6.112  -5.355   1.129
  398   1HH1  ARG  55          2HH1      ARG  55   7.907  -7.871   2.214
  399   2HH1  ARG  55          1HH1      ARG  55   9.170  -6.934   2.945
  400   1HH2  ARG  55          1HH2      ARG  55   8.133  -3.943   1.515
  401   2HH2  ARG  55          2HH2      ARG  55   9.302  -4.708   2.543
  402    H    SER  56             H      SER  56   3.067  -8.709  -3.894
  403    HA   SER  56            HA      SER  56   5.503  -8.418  -5.381
  404   1HB   SER  56           2HB      SER  56   6.522  -9.715  -3.684
  405   2HB   SER  56           1HB      SER  56   5.244 -10.917  -3.734
  406    HG   SER  56            HG      SER  56   7.213 -10.324  -5.686
  407    H    SER  57             H      SER  57   2.367  -9.717  -5.168
  408    HA   SER  57            HA      SER  57   2.586 -11.210  -7.669
  409   1HB   SER  57           2HB      SER  57   0.089 -11.608  -7.182
  410   2HB   SER  57           1HB      SER  57   1.279 -12.444  -6.205
  411    HG   SER  57            HG      SER  57  -0.108 -11.513  -4.786
  412    H    PHE  58             H      PHE  58  -0.238  -9.354  -6.838
  413    HA   PHE  58            HA      PHE  58  -0.967  -8.394  -9.267
  414   1HB   PHE  58           2HB      PHE  58  -2.148  -6.572  -8.223
  415   2HB   PHE  58           1HB      PHE  58  -2.265  -8.018  -7.232
  416    HD1  PHE  58           HD2      PHE  58  -0.764  -4.683  -7.546
  417    HD2  PHE  58           HD1      PHE  58  -1.155  -8.178  -5.091
  418    HE1  PHE  58           HE2      PHE  58   0.162  -3.432  -5.626
  419    HE2  PHE  58           HE1      PHE  58  -0.233  -6.931  -3.166
  420    HZ   PHE  58            HZ      PHE  58   0.426  -4.555  -3.430
  421    OH   TYR  59            OH      TYR  59   3.505  -4.079  -2.850
  422    H    TYR  59             H      TYR  59   1.999  -7.164  -7.715
  423    HA   TYR  59            HA      TYR  59   2.058  -4.689  -9.038
  424   1HB   TYR  59           2HB      TYR  59   4.528  -6.297  -8.470
  425   2HB   TYR  59           1HB      TYR  59   4.431  -4.578  -8.789
  426    HD1  TYR  59           HD1      TYR  59   2.146  -3.823  -7.190
  427    HD2  TYR  59           HD2      TYR  59   5.440  -6.381  -6.264
  428    HE1  TYR  59           HE1      TYR  59   1.958  -3.193  -4.790
  429    HE2  TYR  59           HE2      TYR  59   5.269  -5.734  -3.888
  430    HH   TYR  59            HH      TYR  59   4.395  -3.999  -2.497
  431    H    VAL  60             H      VAL  60   2.129  -7.620 -10.524
  432    HA   VAL  60            HA      VAL  60   3.299  -6.452 -12.949
  433    HB   VAL  60            HB      VAL  60   3.626  -9.032 -13.437
  434   1HG1  VAL  60          2HG1      VAL  60   5.385  -7.312 -13.379
  435   2HG1  VAL  60          1HG1      VAL  60   5.413  -7.421 -11.617
  436   3HG1  VAL  60          3HG1      VAL  60   5.928  -8.797 -12.595
  437   1HG2  VAL  60          3HG2      VAL  60   2.583  -9.735 -11.272
  438   2HG2  VAL  60          2HG2      VAL  60   4.242 -10.307 -11.449
  439   3HG2  VAL  60          1HG2      VAL  60   3.892  -8.908 -10.423
  440    H    ASN  61             H      ASN  61   0.664  -8.443 -11.617
  441    HA   ASN  61            HA      ASN  61  -0.496  -8.746 -14.260
  442   1HB   ASN  61           2HB      ASN  61  -2.092 -10.196 -13.199
  443   2HB   ASN  61           1HB      ASN  61  -0.508 -10.671 -12.700
  444   1HD2  ASN  61          2HD2      ASN  61  -1.308 -10.363  -9.325
  445   2HD2  ASN  61          1HD2      ASN  61  -0.312 -11.037 -10.524
  446    H    GLY  62             H      GLY  62  -1.290  -7.216 -11.142
  447   1HA   GLY  62           2HA      GLY  62  -2.115  -4.854 -11.359
  448   2HA   GLY  62           1HA      GLY  62  -3.240  -5.462 -12.589
  449    H    LEU  63             H      LEU  63  -3.646  -4.134  -9.895
  450    HA   LEU  63            HA      LEU  63  -4.750  -5.962  -7.990
  451   1HB   LEU  63           2HB      LEU  63  -5.650  -3.081  -8.429
  452   2HB   LEU  63           1HB      LEU  63  -5.785  -4.005  -6.931
  453    HG   LEU  63            HG      LEU  63  -3.083  -3.454  -8.159
  454   1HD1  LEU  63          3HD1      LEU  63  -4.785  -1.391  -7.608
  455   2HD1  LEU  63          2HD1      LEU  63  -4.097  -1.671  -6.002
  456   3HD1  LEU  63          1HD1      LEU  63  -3.039  -1.300  -7.361
  457   1HD2  LEU  63          1HD2      LEU  63  -4.217  -4.089  -5.435
  458   2HD2  LEU  63          3HD2      LEU  63  -3.110  -5.064  -6.385
  459   3HD2  LEU  63          2HD2      LEU  63  -2.557  -3.554  -5.663
  460    H    THR  64             H      THR  64  -7.418  -4.629  -7.780
  461    HA   THR  64            HA      THR  64  -8.837  -5.194 -10.203
  462    HB   THR  64            HB      THR  64 -10.285  -6.917  -9.032
  463    HG1  THR  64           HG1      THR  64  -7.992  -7.117  -7.404
  464   1HG2  THR  64          2HG2      THR  64  -8.515  -7.417 -10.760
  465   2HG2  THR  64          1HG2      THR  64  -7.423  -7.794  -9.420
  466   3HG2  THR  64          3HG2      THR  64  -8.892  -8.747  -9.671
  467    H    LEU  65             H      LEU  65 -10.552  -3.965 -10.138
  468    HA   LEU  65            HA      LEU  65 -11.622  -3.044  -7.562
  469   1HB   LEU  65           2HB      LEU  65 -11.907  -0.764  -8.841
  470   2HB   LEU  65           1HB      LEU  65 -10.482  -1.131  -7.920
  471    HG   LEU  65            HG      LEU  65  -9.453  -1.998 -10.099
  472   1HD1  LEU  65          1HD1      LEU  65 -12.040  -0.887 -11.028
  473   2HD1  LEU  65          3HD1      LEU  65 -10.625  -0.537 -12.016
  474   3HD1  LEU  65          2HD1      LEU  65 -11.078  -2.202 -11.685
  475   1HD2  LEU  65          1HD2      LEU  65 -10.130   0.867  -9.482
  476   2HD2  LEU  65          3HD2      LEU  65  -8.588   0.025  -9.291
  477   3HD2  LEU  65          2HD2      LEU  65  -9.155   0.470 -10.902
  478    H    GLY  66             H      GLY  66 -13.490  -4.066  -7.650
  479   1HA   GLY  66           2HA      GLY  66 -15.747  -4.364  -8.194
  480   2HA   GLY  66           1HA      GLY  66 -15.541  -3.166  -9.461
  481    H    GLY  67             H      GLY  67 -13.488  -5.984  -9.109
  482   1HA   GLY  67           2HA      GLY  67 -13.348  -7.960 -10.378
  483   2HA   GLY  67           1HA      GLY  67 -14.866  -7.529 -11.168
  484    H    GLN  68             H      GLN  68 -12.571  -4.908 -11.182
  485    HA   GLN  68            HA      GLN  68 -11.849  -5.648 -14.012
  486   1HB   GLN  68           2HB      GLN  68 -13.196  -3.744 -14.167
  487   2HB   GLN  68           1HB      GLN  68 -12.420  -3.056 -12.795
  488   1HG   GLN  68           2HG      GLN  68 -11.767  -2.023 -15.059
  489   2HG   GLN  68           1HG      GLN  68 -10.434  -2.470 -14.000
  490   1HE2  GLN  68          2HE2      GLN  68  -9.077  -4.274 -16.745
  491   2HE2  GLN  68          1HE2      GLN  68  -8.864  -3.004 -15.636
  492    H    LYS  69             H      LYS  69  -9.936  -6.623 -13.709
  493    HA   LYS  69            HA      LYS  69  -7.977  -5.855 -11.834
  494   1HB   LYS  69           2HB      LYS  69  -6.831  -7.706 -12.559
  495   2HB   LYS  69           1HB      LYS  69  -8.313  -8.045 -13.434
  496   1HG   LYS  69           2HG      LYS  69  -7.252  -6.690 -15.377
  497   2HG   LYS  69           1HG      LYS  69  -5.735  -6.865 -14.494
  498   1HD   LYS  69           2HD      LYS  69  -7.384  -9.317 -14.880
  499   2HD   LYS  69           1HD      LYS  69  -6.550  -8.677 -16.295
  500   1HE   LYS  69           2HE      LYS  69  -4.560  -8.530 -14.431
  501   2HE   LYS  69           1HE      LYS  69  -5.437  -9.953 -13.865
  502   1HZ   LYS  69           3HZ      LYS  69  -4.562  -9.559 -16.672
  503   2HZ   LYS  69           2HZ      LYS  69  -3.672 -10.435 -15.521
  504   3HZ   LYS  69           1HZ      LYS  69  -5.215 -10.967 -15.991
  505    H    CYS  70             H      CYS  70  -6.675  -4.128 -11.754
  506    HA   CYS  70            HA      CYS  70  -5.999  -2.729 -14.347
  507   1HB   CYS  70           2HB      CYS  70  -5.742  -0.699 -12.921
  508   2HB   CYS  70           1HB      CYS  70  -7.370  -1.309 -12.979
  509    HG   CYS  70            HG      CYS  70  -6.002  -2.490 -10.592
  510    H    SER  71             H      SER  71  -3.952  -2.530 -14.651
  511    HA   SER  71            HA      SER  71  -1.999  -3.955 -13.052
  512   1HB   SER  71           2HB      SER  71  -0.492  -3.477 -14.751
  513   2HB   SER  71           1HB      SER  71  -2.048  -3.722 -15.475
  514    HG   SER  71            HG      SER  71  -2.195  -1.264 -15.177
  515    H    VAL  72             H      VAL  72  -0.064  -2.974 -12.223
  516    HA   VAL  72            HA      VAL  72  -0.535  -0.234 -11.174
  517    HB   VAL  72            HB      VAL  72   1.649  -2.053 -10.290
  518   1HG1  VAL  72          1HG1      VAL  72   0.275   0.394  -9.307
  519   2HG1  VAL  72          3HG1      VAL  72   1.019  -0.695  -8.146
  520   3HG1  VAL  72          2HG1      VAL  72   2.003   0.049  -9.399
  521   1HG2  VAL  72          3HG2      VAL  72  -0.480  -3.285 -10.069
  522   2HG2  VAL  72          2HG2      VAL  72   0.219  -2.872  -8.505
  523   3HG2  VAL  72          1HG2      VAL  72  -1.127  -1.934  -9.144
  524    H    ILE  73             H      ILE  73   0.885   1.297 -11.485
  525    HA   ILE  73            HA      ILE  73   3.285   0.782 -13.004
  526    HB   ILE  73            HB      ILE  73   1.127   2.599 -13.887
  527   1HG1  ILE  73          2HG1      ILE  73   2.263   1.148 -16.045
  528   2HG1  ILE  73          1HG1      ILE  73   2.083   0.007 -14.727
  529   1HG2  ILE  73          3HG2      ILE  73   4.020   2.794 -14.373
  530   2HG2  ILE  73          2HG2      ILE  73   2.971   3.042 -15.767
  531   3HG2  ILE  73          1HG2      ILE  73   2.809   4.078 -14.347
  532   1HD1  ILE  73          1HD1      ILE  73  -0.158   1.735 -15.866
  533   2HD1  ILE  73          3HD1      ILE  73   0.043  -0.008 -16.196
  534   3HD1  ILE  73          2HD1      ILE  73  -0.335   0.579 -14.548
  535    NH1  ARG  74           NH2      ARG  74   7.716   4.945 -12.435
  536    NH2  ARG  74           NH1      ARG  74   9.087   6.672 -11.924
  537    H    ARG  74             H      ARG  74   3.878   1.165 -10.803
  538    HA   ARG  74            HA      ARG  74   5.508   2.494  -9.608
  539   1HB   ARG  74           2HB      ARG  74   4.765   4.545 -11.066
  540   2HB   ARG  74           1HB      ARG  74   3.661   4.867  -9.721
  541   1HG   ARG  74           2HG      ARG  74   5.364   5.357  -8.260
  542   2HG   ARG  74           1HG      ARG  74   6.482   4.220  -9.018
  543   1HD   ARG  74           2HD      ARG  74   5.833   6.318 -10.893
  544   2HD   ARG  74           1HD      ARG  74   6.389   7.023  -9.372
  545    HE   ARG  74            HE      ARG  74   8.403   5.474  -9.607
  546   1HH1  ARG  74          1HH2      ARG  74   7.037   4.266 -12.156
  547   2HH1  ARG  74          2HH2      ARG  74   8.030   4.975 -13.385
  548   1HH2  ARG  74          2HH1      ARG  74   9.455   7.317 -11.253
  549   2HH2  ARG  74          1HH1      ARG  74   9.404   6.701 -12.870
  550    H    ASP  75             H      ASP  75   4.585   0.838  -8.230
  551    HA   ASP  75            HA      ASP  75   2.310   1.457  -6.679
  552   1HB   ASP  75           2HB      ASP  75   2.402  -0.822  -6.770
  553   2HB   ASP  75           1HB      ASP  75   4.121  -0.825  -6.818
  554    H    SER  76             H      SER  76   2.314   3.186  -5.459
  555    HA   SER  76            HA      SER  76   4.320   3.236  -3.239
  556   1HB   SER  76           2HB      SER  76   3.827   5.428  -5.226
  557   2HB   SER  76           1HB      SER  76   3.956   5.889  -3.540
  558    HG   SER  76            HG      SER  76   5.935   4.666  -3.493
  559    H    LEU  77             H      LEU  77   1.429   2.434  -3.709
  560    HA   LEU  77            HA      LEU  77  -0.506   4.158  -2.500
  561   1HB   LEU  77           2HB      LEU  77  -0.814   1.969  -3.779
  562   2HB   LEU  77           1HB      LEU  77  -0.337   1.116  -2.329
  563    HG   LEU  77            HG      LEU  77  -2.289   1.868  -1.168
  564   1HD1  LEU  77          1HD1      LEU  77  -2.620   3.710  -3.541
  565   2HD1  LEU  77          3HD1      LEU  77  -3.942   3.367  -2.432
  566   3HD1  LEU  77          2HD1      LEU  77  -2.482   4.158  -1.846
  567   1HD2  LEU  77          1HD2      LEU  77  -2.647   0.894  -4.015
  568   2HD2  LEU  77          3HD2      LEU  77  -2.884   0.013  -2.490
  569   3HD2  LEU  77          2HD2      LEU  77  -4.077   1.210  -3.006
  570    H    LEU  78             H      LEU  78   2.154   2.534  -1.002
  571    HA   LEU  78            HA      LEU  78   0.868   2.963   1.578
  572   1HB   LEU  78           2HB      LEU  78   3.002   1.189   0.773
  573   2HB   LEU  78           1HB      LEU  78   2.729   1.517   2.454
  574    HG   LEU  78            HG      LEU  78   0.516   0.640   0.576
  575   1HD1  LEU  78          1HD1      LEU  78   2.438  -1.076   0.823
  576   2HD1  LEU  78          3HD1      LEU  78   1.864  -1.257   2.485
  577   3HD1  LEU  78          2HD1      LEU  78   0.777  -1.624   1.128
  578   1HD2  LEU  78          3HD2      LEU  78   0.801   0.598   3.594
  579   2HD2  LEU  78          2HD2      LEU  78  -0.194   1.712   2.659
  580   3HD2  LEU  78          1HD2      LEU  78  -0.597  -0.006   2.700
  581    H    GLN  79             H      GLN  79   1.480   4.635   2.678
  582    HA   GLN  79            HA      GLN  79   2.707   6.800   1.913
  583   1HB   GLN  79           2HB      GLN  79   2.758   7.488   4.336
  584   2HB   GLN  79           1HB      GLN  79   1.200   6.902   3.769
  585   1HG   GLN  79           2HG      GLN  79   2.835   4.697   4.735
  586   2HG   GLN  79           1HG      GLN  79   2.654   5.938   5.976
  587   1HE2  GLN  79          2HE2      GLN  79  -0.966   5.571   6.086
  588   2HE2  GLN  79          1HE2      GLN  79   0.228   6.779   6.148
  589    H    ASP  80             H      ASP  80   4.493   5.999   0.954
  590    HA   ASP  80            HA      ASP  80   6.935   5.919   2.671
  591   1HB   ASP  80           2HB      ASP  80   6.798   4.112   0.936
  592   2HB   ASP  80           1HB      ASP  80   6.604   5.345  -0.311
  593    H    GLY  81             H      GLY  81   4.987   8.195   2.063
  594   1HA   GLY  81           2HA      GLY  81   5.395  10.535   1.890
  595   2HA   GLY  81           1HA      GLY  81   6.878  10.177   0.986
  596    H    GLU  82             H      GLU  82   3.820   8.470   0.304
  597    HA   GLU  82            HA      GLU  82   3.299  10.055  -2.071
  598   1HB   GLU  82           2HB      GLU  82   4.525   7.395  -1.982
  599   2HB   GLU  82           1HB      GLU  82   3.357   7.717  -3.214
  600   1HG   GLU  82           2HG      GLU  82   5.883   9.275  -2.747
  601   2HG   GLU  82           1HG      GLU  82   5.567   8.143  -4.081
  602    H    PHE  83             H      PHE  83   2.536   6.808  -0.868
  603    HA   PHE  83            HA      PHE  83   0.581   5.570  -0.876
  604   1HB   PHE  83           2HB      PHE  83  -1.545   7.296  -0.780
  605   2HB   PHE  83           1HB      PHE  83  -0.876   6.368   0.497
  606    HD1  PHE  83           HD1      PHE  83   0.939   7.413   1.932
  607    HD2  PHE  83           HD2      PHE  83  -1.404   9.695  -0.800
  608    HE1  PHE  83           HE1      PHE  83   1.588   9.476   3.139
  609    HE2  PHE  83           HE2      PHE  83  -0.771  11.777   0.388
  610    HZ   PHE  83            HZ      PHE  83   0.728  11.665   2.362
  611    H    SER  84             H      SER  84   1.372   7.395  -3.486
  612    HA   SER  84            HA      SER  84  -1.190   6.996  -4.922
  613   1HB   SER  84           2HB      SER  84   0.114   8.319  -6.737
  614   2HB   SER  84           1HB      SER  84  -0.429   9.185  -5.295
  615    HG   SER  84            HG      SER  84   1.606   9.652  -5.054
  616    H    MET  85             H      MET  85  -1.440   5.519  -6.395
  617    HA   MET  85            HA      MET  85   0.943   3.920  -7.340
  618   1HB   MET  85           2HB      MET  85  -0.617   2.936  -5.512
  619   2HB   MET  85           1HB      MET  85  -1.784   2.853  -6.781
  620   1HG   MET  85           2HG      MET  85  -0.890   0.998  -7.625
  621   2HG   MET  85           1HG      MET  85   0.705   1.708  -7.636
  622   1HE   MET  85           2HE      MET  85  -1.157  -0.829  -6.946
  623   2HE   MET  85           1HE      MET  85   0.382  -1.663  -6.546
  624   3HE   MET  85           3HE      MET  85  -0.923  -1.503  -5.329
  625    H    ASP  86             H      ASP  86   1.002   3.955  -9.642
  626    HA   ASP  86            HA      ASP  86  -1.425   5.056 -10.983
  627   1HB   ASP  86           2HB      ASP  86   1.390   4.595 -11.644
  628   2HB   ASP  86           1HB      ASP  86   0.243   4.595 -12.960
  629    H    LEU  87             H      LEU  87  -2.771   3.068 -10.557
  630    HA   LEU  87            HA      LEU  87  -1.859   0.846 -12.167
  631   1HB   LEU  87           2HB      LEU  87  -3.939  -0.394 -11.109
  632   2HB   LEU  87           1HB      LEU  87  -2.410  -0.293 -10.278
  633    HG   LEU  87            HG      LEU  87  -4.298   0.106  -8.797
  634   1HD1  LEU  87          2HD1      LEU  87  -2.026   1.744  -9.041
  635   2HD1  LEU  87          1HD1      LEU  87  -3.370   2.784  -8.578
  636   3HD1  LEU  87          3HD1      LEU  87  -2.961   1.379  -7.596
  637   1HD2  LEU  87          2HD2      LEU  87  -5.558   1.225 -10.787
  638   2HD2  LEU  87          1HD2      LEU  87  -5.884   1.743  -9.126
  639   3HD2  LEU  87          3HD2      LEU  87  -4.823   2.703 -10.158
  640    NH1  ARG  88           NH2      ARG  88   1.041   3.512 -17.595
  641    NH2  ARG  88           NH1      ARG  88   0.319   3.394 -19.732
  642    H    ARG  88             H      ARG  88  -2.448   0.590 -14.115
  643    HA   ARG  88            HA      ARG  88  -5.014   2.012 -14.895
  644   1HB   ARG  88           2HB      ARG  88  -4.020   2.771 -16.866
  645   2HB   ARG  88           1HB      ARG  88  -2.623   2.739 -15.808
  646   1HG   ARG  88           2HG      ARG  88  -1.926   0.568 -16.787
  647   2HG   ARG  88           1HG      ARG  88  -3.383   0.530 -17.806
  648   1HD   ARG  88           2HD      ARG  88  -2.215   1.658 -19.355
  649   2HD   ARG  88           1HD      ARG  88  -2.245   3.069 -18.267
  650    HE   ARG  88            HE      ARG  88  -0.054   1.087 -17.894
  651   1HH1  ARG  88          1HH2      ARG  88   1.029   3.168 -16.658
  652   2HH1  ARG  88          2HH2      ARG  88   1.618   4.297 -17.832
  653   1HH2  ARG  88          2HH1      ARG  88  -0.248   2.961 -20.433
  654   2HH2  ARG  88          1HH1      ARG  88   0.900   4.170 -19.969
  655    H    THR  89             H      THR  89  -6.625   0.929 -15.805
  656    HA   THR  89            HA      THR  89  -6.763  -1.913 -16.085
  657    HB   THR  89            HB      THR  89  -8.945  -1.544 -16.990
  658    HG1  THR  89           HG1      THR  89  -9.040  -0.446 -18.727
  659   1HG2  THR  89          2HG2      THR  89  -8.476  -0.178 -14.805
  660   2HG2  THR  89          1HG2      THR  89  -8.710   1.211 -15.876
  661   3HG2  THR  89          3HG2      THR  89 -10.010   0.032 -15.655
  662    H    LYS  90             H      LYS  90  -4.876  -2.531 -17.338
  663    HA   LYS  90            HA      LYS  90  -4.237  -1.234 -19.773
  664   1HB   LYS  90           2HB      LYS  90  -3.147  -3.949 -19.314
  665   2HB   LYS  90           1HB      LYS  90  -2.366  -2.466 -19.816
  666   1HG   LYS  90           2HG      LYS  90  -2.539  -1.609 -17.501
  667   2HG   LYS  90           1HG      LYS  90  -3.048  -3.244 -17.014
  668   1HD   LYS  90           2HD      LYS  90  -0.600  -2.894 -18.764
  669   2HD   LYS  90           1HD      LYS  90  -0.439  -2.661 -17.042
  670   1HE   LYS  90           2HE      LYS  90  -1.920  -5.022 -17.247
  671   2HE   LYS  90           1HE      LYS  90  -0.733  -5.141 -18.544
  672   1HZ   LYS  90           2HZ      LYS  90   0.756  -4.231 -16.478
  673   2HZ   LYS  90           1HZ      LYS  90  -0.351  -5.248 -15.685
  674   3HZ   LYS  90           3HZ      LYS  90   0.618  -5.861 -16.932
  675    H    SER  91             H      SER  91  -3.937  -2.668 -21.732
  676    HA   SER  91            HA      SER  91  -6.327  -4.409 -22.165
  677   1HB   SER  91           2HB      SER  91  -7.094  -2.555 -23.321
  678   2HB   SER  91           1HB      SER  91  -5.510  -1.964 -23.637
  679    HG   SER  91            HG      SER  91  -5.481  -2.987 -25.477
  680    H    THR  92             H      THR  92  -6.179  -5.788 -24.077
  681    HA   THR  92            HA      THR  92  -3.513  -6.356 -25.206
  682    HB   THR  92            HB      THR  92  -3.338  -8.638 -24.371
  683    HG1  THR  92           HG1      THR  92  -5.173  -9.522 -23.902
  684   1HG2  THR  92          1HG2      THR  92  -2.473  -6.772 -22.928
  685   2HG2  THR  92          3HG2      THR  92  -3.985  -6.845 -22.013
  686   3HG2  THR  92          2HG2      THR  92  -2.888  -8.232 -22.030
  687    H    GLY  93             H      GLY  93  -4.153  -6.456 -27.315
  688   1HA   GLY  93           2HA      GLY  93  -5.062  -7.797 -29.140
  689   2HA   GLY  93           1HA      GLY  93  -6.316  -8.379 -28.045
  690    H    GLY  94             H      GLY  94  -5.174  -5.099 -28.937
  691   1HA   GLY  94           2HA      GLY  94  -6.335  -3.224 -29.749
  692   2HA   GLY  94           1HA      GLY  94  -7.480  -4.358 -30.460
  693    H    ALA  95             H      ALA  95  -6.939  -4.485 -27.005
  694    HA   ALA  95            HA      ALA  95  -9.754  -3.743 -26.523
  695   1HB   ALA  95           1HB      ALA  95  -7.928  -5.414 -25.210
  696   2HB   ALA  95           3HB      ALA  95  -8.121  -4.039 -24.116
  697   3HB   ALA  95           2HB      ALA  95  -9.535  -4.962 -24.635
  698    HA   PRO  96            HA      PRO  96  -8.970   0.349 -25.140
  699   1HB   PRO  96           2HB      PRO  96 -11.077   0.673 -23.456
  700   2HB   PRO  96           1HB      PRO  96 -11.289   0.455 -25.205
  701   1HG   PRO  96           2HG      PRO  96 -11.870  -1.488 -23.018
  702   2HG   PRO  96           1HG      PRO  96 -12.508  -1.444 -24.661
  703   1HD   PRO  96           2HD      PRO  96 -10.379  -3.097 -23.652
  704   2HD   PRO  96           1HD      PRO  96 -11.038  -3.020 -25.304
  705    H    THR  97             H      THR  97  -7.667   1.371 -23.591
  706    HA   THR  97            HA      THR  97  -7.378   0.021 -20.926
  707    HB   THR  97            HB      THR  97  -5.288   1.445 -20.688
  708    HG1  THR  97           HG1      THR  97  -5.748   1.890 -23.462
  709   1HG2  THR  97          1HG2      THR  97  -5.603  -0.966 -21.915
  710   2HG2  THR  97          3HG2      THR  97  -4.783  -0.053 -23.183
  711   3HG2  THR  97          2HG2      THR  97  -4.041  -0.211 -21.584
  712    H    PHE  98             H      PHE  98  -7.186   1.450 -19.094
  713    HA   PHE  98            HA      PHE  98  -8.259   4.176 -19.279
  714   1HB   PHE  98           2HB      PHE  98  -9.483   1.993 -17.517
  715   2HB   PHE  98           1HB      PHE  98  -9.959   3.699 -17.550
  716    HD1  PHE  98           HD1      PHE  98 -10.228   4.535 -20.167
  717    HD2  PHE  98           HD2      PHE  98 -11.007   0.616 -18.638
  718    HE1  PHE  98           HE1      PHE  98 -11.767   4.135 -22.060
  719    HE2  PHE  98           HE2      PHE  98 -12.558   0.187 -20.530
  720    HZ   PHE  98            HZ      PHE  98 -12.946   1.945 -22.238
  721    H    ASN  99             H      ASN  99  -7.078   5.443 -17.738
  722    HA   ASN  99            HA      ASN  99  -5.300   3.782 -15.999
  723   1HB   ASN  99           2HB      ASN  99  -4.692   6.692 -16.398
  724   2HB   ASN  99           1HB      ASN  99  -3.590   5.338 -16.140
  725   1HD2  ASN  99          2HD2      ASN  99  -3.247   6.355 -19.708
  726   2HD2  ASN  99          1HD2      ASN  99  -2.971   7.092 -18.206
  727    H    VAL 100             H      VAL 100  -5.199   3.981 -13.901
  728    HA   VAL 100            HA      VAL 100  -7.056   5.826 -12.491
  729    HB   VAL 100            HB      VAL 100  -6.289   3.067 -11.471
  730   1HG1  VAL 100          2HG1      VAL 100  -8.534   4.984 -10.939
  731   2HG1  VAL 100          1HG1      VAL 100  -8.497   3.350 -10.322
  732   3HG1  VAL 100          3HG1      VAL 100  -7.260   4.502  -9.843
  733   1HG2  VAL 100          3HG2      VAL 100  -7.327   2.772 -13.721
  734   2HG2  VAL 100          2HG2      VAL 100  -8.386   2.191 -12.438
  735   3HG2  VAL 100          1HG2      VAL 100  -8.698   3.744 -13.201
  736    H    THR 101             H      THR 101  -6.288   6.583 -10.510
  737    HA   THR 101            HA      THR 101  -3.526   5.949  -9.729
  738    HB   THR 101            HB      THR 101  -4.880   8.667  -9.511
  739    HG1  THR 101           HG1      THR 101  -2.742   7.819 -11.172
  740   1HG2  THR 101          1HG2      THR 101  -2.652   7.488  -8.142
  741   2HG2  THR 101          3HG2      THR 101  -2.034   8.731  -9.230
  742   3HG2  THR 101          2HG2      THR 101  -3.254   9.141  -8.027
  743    H    VAL 102             H      VAL 102  -3.598   5.095  -7.757
  744    HA   VAL 102            HA      VAL 102  -6.013   5.485  -6.109
  745    HB   VAL 102            HB      VAL 102  -4.302   3.137  -6.841
  746   1HG1  VAL 102          1HG1      VAL 102  -5.118   3.681  -4.005
  747   2HG1  VAL 102          3HG1      VAL 102  -5.544   2.083  -4.623
  748   3HG1  VAL 102          2HG1      VAL 102  -3.869   2.613  -4.632
  749   1HG2  VAL 102          1HG2      VAL 102  -7.193   3.744  -6.273
  750   2HG2  VAL 102          3HG2      VAL 102  -6.439   3.177  -7.764
  751   3HG2  VAL 102          2HG2      VAL 102  -6.622   2.077  -6.396
  752    H    THR 103             H      THR 103  -5.758   6.722  -4.391
  753    HA   THR 103            HA      THR 103  -3.101   7.008  -3.121
  754    HB   THR 103            HB      THR 103  -4.097   9.101  -2.109
  755    HG1  THR 103           HG1      THR 103  -5.858   9.940  -3.204
  756   1HG2  THR 103          3HG2      THR 103  -3.227   8.616  -4.894
  757   2HG2  THR 103          2HG2      THR 103  -3.985  10.178  -4.597
  758   3HG2  THR 103          1HG2      THR 103  -2.557   9.700  -3.672
  759    H    LYS 104             H      LYS 104  -2.934   5.972  -1.211
  760    HA   LYS 104            HA      LYS 104  -5.429   5.340   0.274
  761   1HB   LYS 104           2HB      LYS 104  -4.085   3.387  -0.355
  762   2HB   LYS 104           1HB      LYS 104  -2.665   4.099   0.388
  763   1HG   LYS 104           2HG      LYS 104  -3.248   2.909   2.239
  764   2HG   LYS 104           1HG      LYS 104  -4.483   4.141   2.474
  765   1HD   LYS 104           2HD      LYS 104  -5.548   1.979   2.550
  766   2HD   LYS 104           1HD      LYS 104  -6.033   2.781   1.062
  767   1HE   LYS 104           2HE      LYS 104  -5.343   0.327   0.838
  768   2HE   LYS 104           1HE      LYS 104  -4.540   1.452  -0.252
  769   1HZ   LYS 104           2HZ      LYS 104  -3.350   0.774   2.364
  770   2HZ   LYS 104           1HZ      LYS 104  -3.122  -0.244   1.023
  771   3HZ   LYS 104           3HZ      LYS 104  -2.585   1.365   0.965
  772    H    THR 105             H      THR 105  -5.790   6.272   2.159
  773    HA   THR 105            HA      THR 105  -3.750   8.070   3.354
  774    HB   THR 105            HB      THR 105  -5.604   8.827   4.807
  775    HG1  THR 105           HG1      THR 105  -7.565   7.834   4.705
  776   1HG2  THR 105          3HG2      THR 105  -5.713   8.913   1.892
  777   2HG2  THR 105          2HG2      THR 105  -7.322   9.072   2.609
  778   3HG2  THR 105          1HG2      THR 105  -6.035  10.199   3.062
  779    H    ASP 106             H      ASP 106  -5.052   7.492   6.111
  780    HA   ASP 106            HA      ASP 106  -3.447   5.078   6.705
  781   1HB   ASP 106           2HB      ASP 106  -3.201   7.269   7.987
  782   2HB   ASP 106           1HB      ASP 106  -4.770   6.900   8.704
  783    H    LYS 107             H      LYS 107  -6.743   6.091   6.312
  784    HA   LYS 107            HA      LYS 107  -7.683   3.430   7.164
  785   1HB   LYS 107           2HB      LYS 107  -9.153   5.859   8.212
  786   2HB   LYS 107           1HB      LYS 107  -9.277   4.189   8.738
  787   1HG   LYS 107           2HG      LYS 107  -6.849   4.378   9.499
  788   2HG   LYS 107           1HG      LYS 107  -7.021   6.117   9.256
  789   1HD   LYS 107           2HD      LYS 107  -9.165   5.860  10.727
  790   2HD   LYS 107           1HD      LYS 107  -8.438   4.335  11.230
  791   1HE   LYS 107           2HE      LYS 107  -6.973   6.980  11.346
  792   2HE   LYS 107           1HE      LYS 107  -7.877   6.312  12.710
  793   1HZ   LYS 107           2HZ      LYS 107  -6.504   4.279  12.483
  794   2HZ   LYS 107           1HZ      LYS 107  -5.562   5.082  11.324
  795   3HZ   LYS 107           3HZ      LYS 107  -5.610   5.658  12.917
  796    H    THR 108             H      THR 108  -7.529   5.185   4.584
  797    HA   THR 108            HA      THR 108 -10.283   4.547   3.660
  798    HB   THR 108            HB      THR 108 -10.743   6.698   2.759
  799    HG1  THR 108           HG1      THR 108  -8.748   7.255   1.958
  800   1HG2  THR 108          1HG2      THR 108 -10.852   6.382   5.323
  801   2HG2  THR 108          3HG2      THR 108  -9.409   7.404   5.376
  802   3HG2  THR 108          2HG2      THR 108 -10.913   8.037   4.703
  803    H    LEU 109             H      LEU 109 -10.303   4.215   1.372
  804    HA   LEU 109            HA      LEU 109  -7.648   3.861   0.067
  805   1HB   LEU 109           2HB      LEU 109  -9.351   1.910   0.800
  806   2HB   LEU 109           1HB      LEU 109 -10.057   2.250  -0.754
  807    HG   LEU 109            HG      LEU 109  -7.599   0.787  -0.079
  808   1HD1  LEU 109          1HD1      LEU 109  -9.820   0.322  -1.529
  809   2HD1  LEU 109          3HD1      LEU 109  -8.732   0.829  -2.818
  810   3HD1  LEU 109          2HD1      LEU 109  -8.307  -0.531  -1.788
  811   1HD2  LEU 109          3HD2      LEU 109  -7.546   2.948  -2.139
  812   2HD2  LEU 109          2HD2      LEU 109  -6.368   2.595  -0.881
  813   3HD2  LEU 109          1HD2      LEU 109  -6.535   1.516  -2.263
  814    H    VAL 110             H      VAL 110  -7.906   6.109  -0.949
  815    HA   VAL 110            HA      VAL 110 -10.345   6.676  -2.437
  816    HB   VAL 110            HB      VAL 110  -7.775   8.152  -1.832
  817   1HG1  VAL 110          1HG1      VAL 110  -7.993   8.465  -4.297
  818   2HG1  VAL 110          3HG1      VAL 110  -9.656   9.007  -4.072
  819   3HG1  VAL 110          2HG1      VAL 110  -8.323   9.962  -3.426
  820   1HG2  VAL 110          3HG2      VAL 110 -10.309   8.157  -0.800
  821   2HG2  VAL 110          2HG2      VAL 110  -9.201   9.532  -0.676
  822   3HG2  VAL 110          1HG2      VAL 110 -10.431   9.493  -1.950
  823    H    LEU 111             H      LEU 111 -10.648   6.552  -4.584
  824    HA   LEU 111            HA      LEU 111  -8.508   5.403  -6.281
  825   1HB   LEU 111           2HB      LEU 111 -11.450   4.720  -6.089
  826   2HB   LEU 111           1HB      LEU 111 -10.606   4.486  -7.616
  827    HG   LEU 111            HG      LEU 111  -9.079   3.495  -5.475
  828   1HD1  LEU 111          1HD1      LEU 111 -11.877   2.487  -5.558
  829   2HD1  LEU 111          3HD1      LEU 111 -10.561   1.555  -4.846
  830   3HD1  LEU 111          2HD1      LEU 111 -11.011   3.120  -4.164
  831   1HD2  LEU 111          1HD2      LEU 111  -9.581   2.815  -8.112
  832   2HD2  LEU 111          3HD2      LEU 111  -8.553   1.877  -7.015
  833   3HD2  LEU 111          2HD2      LEU 111 -10.261   1.462  -7.208
  834    H    LEU 112             H      LEU 112  -8.252   6.417  -8.193
  835    HA   LEU 112            HA      LEU 112 -10.092   8.664  -8.808
  836   1HB   LEU 112           2HB      LEU 112  -7.625   8.989  -7.904
  837   2HB   LEU 112           1HB      LEU 112  -7.196   8.742  -9.556
  838    HG   LEU 112            HG      LEU 112  -7.344  11.099  -9.182
  839   1HD1  LEU 112          1HD1      LEU 112  -8.990   9.803 -11.036
  840   2HD1  LEU 112          3HD1      LEU 112  -9.993  11.062 -10.338
  841   3HD1  LEU 112          2HD1      LEU 112  -8.446  11.470 -11.090
  842   1HD2  LEU 112          2HD2      LEU 112  -8.637  10.884  -7.079
  843   2HD2  LEU 112          1HD2      LEU 112  -9.265  12.145  -8.141
  844   3HD2  LEU 112          3HD2      LEU 112 -10.100  10.586  -8.033
  845    H    MET 113             H      MET 113 -11.146   7.553 -10.466
  846    HA   MET 113            HA      MET 113  -9.537   5.847 -12.281
  847   1HB   MET 113           2HB      MET 113 -11.908   5.332 -11.452
  848   2HB   MET 113           1HB      MET 113 -12.405   6.408 -12.708
  849   1HG   MET 113           2HG      MET 113 -11.192   5.111 -14.388
  850   2HG   MET 113           1HG      MET 113 -10.634   4.013 -13.131
  851   1HE   MET 113           1HE      MET 113 -11.751   2.695 -15.443
  852   2HE   MET 113           3HE      MET 113 -11.500   1.804 -13.934
  853   3HE   MET 113           2HE      MET 113 -13.004   1.619 -14.835
  854    H    GLY 114             H      GLY 114  -9.268   6.042 -14.362
  855   1HA   GLY 114           2HA      GLY 114  -9.847   8.625 -15.603
  856   2HA   GLY 114           1HA      GLY 114  -8.282   7.892 -15.696
  857    H    LYS 115             H      LYS 115 -10.581   8.598 -17.559
  858    HA   LYS 115            HA      LYS 115 -10.348   6.183 -19.181
  859   1HB   LYS 115           2HB      LYS 115 -12.819   7.856 -18.833
  860   2HB   LYS 115           1HB      LYS 115 -12.599   6.718 -20.165
  861   1HG   LYS 115           2HG      LYS 115 -11.890   5.044 -18.274
  862   2HG   LYS 115           1HG      LYS 115 -12.779   6.127 -17.220
  863   1HD   LYS 115           2HD      LYS 115 -14.775   5.844 -18.726
  864   2HD   LYS 115           1HD      LYS 115 -13.856   4.638 -19.625
  865   1HE   LYS 115           2HE      LYS 115 -13.487   3.754 -17.052
  866   2HE   LYS 115           1HE      LYS 115 -15.117   4.434 -16.950
  867   1HZ   LYS 115           2HZ      LYS 115 -14.309   2.604 -19.129
  868   2HZ   LYS 115           1HZ      LYS 115 -14.914   2.028 -17.651
  869   3HZ   LYS 115           3HZ      LYS 115 -15.878   3.021 -18.632
  870    H    GLU 116             H      GLU 116 -10.243   6.615 -21.393
  871    HA   GLU 116            HA      GLU 116  -8.373   7.908 -22.543
  872   1HB   GLU 116           2HB      GLU 116 -10.119   6.905 -23.490
  873   2HB   GLU 116           1HB      GLU 116 -11.042   8.333 -23.430
  874   1HG   GLU 116           2HG      GLU 116 -10.091   8.100 -25.698
  875   2HG   GLU 116           1HG      GLU 116  -9.327   9.452 -24.876
  876    H    GLY 117             H      GLY 117  -7.625   9.688 -23.511
  877   1HA   GLY 117           2HA      GLY 117  -7.112  11.995 -23.670
  878   2HA   GLY 117           1HA      GLY 117  -8.672  12.365 -22.879
  879    H    VAL 118             H      VAL 118  -7.058   9.618 -21.629
  880    HA   VAL 118            HA      VAL 118  -6.541  10.901 -19.105
  881    HB   VAL 118            HB      VAL 118  -8.187   8.993 -19.758
  882   1HG1  VAL 118          1HG1      VAL 118  -6.487   7.552 -20.797
  883   2HG1  VAL 118          3HG1      VAL 118  -5.806   7.273 -19.190
  884   3HG1  VAL 118          2HG1      VAL 118  -7.483   6.800 -19.532
  885   1HG2  VAL 118          3HG2      VAL 118  -6.628   9.586 -17.344
  886   2HG2  VAL 118          2HG2      VAL 118  -8.327   9.134 -17.476
  887   3HG2  VAL 118          1HG2      VAL 118  -7.080   7.862 -17.350
  888    H    HIS 119             H      HIS 119  -4.490  11.555 -18.921
  889    HA   HIS 119            HA      HIS 119  -2.252  10.039 -20.098
  890   1HB   HIS 119           2HB      HIS 119  -2.324  12.560 -20.037
  891   2HB   HIS 119           1HB      HIS 119  -2.110  12.462 -18.290
  892    HD1  HIS 119           HD1      HIS 119   0.191  11.723 -17.399
  893    HD2  HIS 119           HD2      HIS 119  -0.044  11.748 -21.559
  894    HE1  HIS 119           HE1      HIS 119   2.559  11.447 -18.253
  895    H    GLY 120             H      GLY 120  -3.800  10.586 -16.991
  896   1HA   GLY 120           2HA      GLY 120  -3.694   9.046 -15.153
  897   2HA   GLY 120           1HA      GLY 120  -2.189   8.399 -15.811
  898    H    GLY 121             H      GLY 121  -1.338  11.410 -16.172
  899   1HA   GLY 121           2HA      GLY 121  -0.001  11.620 -13.543
  900   2HA   GLY 121           1HA      GLY 121   0.306  12.648 -14.943
  901    H    LEU 122             H      LEU 122  -2.467  13.343 -15.391
  902    HA   LEU 122            HA      LEU 122  -2.784  15.577 -13.531
  903   1HB   LEU 122           2HB      LEU 122  -5.003  14.623 -15.344
  904   2HB   LEU 122           1HB      LEU 122  -4.597  16.270 -14.872
  905    HG   LEU 122            HG      LEU 122  -2.381  15.061 -16.322
  906   1HD1  LEU 122          3HD1      LEU 122  -4.376  13.759 -17.253
  907   2HD1  LEU 122          2HD1      LEU 122  -4.937  15.303 -17.906
  908   3HD1  LEU 122          1HD1      LEU 122  -3.392  14.633 -18.433
  909   1HD2  LEU 122          1HD2      LEU 122  -3.166  17.532 -15.873
  910   2HD2  LEU 122          3HD2      LEU 122  -2.348  17.125 -17.385
  911   3HD2  LEU 122          2HD2      LEU 122  -4.107  17.282 -17.350
  912    H    ILE 123             H      ILE 123  -4.210  12.410 -14.076
  913    HA   ILE 123            HA      ILE 123  -6.304  12.632 -12.103
  914    HB   ILE 123            HB      ILE 123  -4.790  10.291 -13.245
  915   1HG1  ILE 123          2HG1      ILE 123  -7.542  11.436 -13.916
  916   2HG1  ILE 123          1HG1      ILE 123  -6.083  11.627 -14.893
  917   1HG2  ILE 123          3HG2      ILE 123  -6.591  10.358 -11.007
  918   2HG2  ILE 123          2HG2      ILE 123  -7.405   9.538 -12.333
  919   3HG2  ILE 123          1HG2      ILE 123  -5.848   8.941 -11.751
  920   1HD1  ILE 123          3HD1      ILE 123  -7.062   8.901 -14.124
  921   2HD1  ILE 123          2HD1      ILE 123  -7.731   9.764 -15.499
  922   3HD1  ILE 123          1HD1      ILE 123  -6.015   9.370 -15.459
  923    H    ASN 124             H      ASN 124  -2.913  11.627 -12.160
  924    HA   ASN 124            HA      ASN 124  -2.721  10.694  -9.461
  925   1HB   ASN 124           2HB      ASN 124  -0.992  10.326 -11.262
  926   2HB   ASN 124           1HB      ASN 124  -0.554  12.029 -11.115
  927   1HD2  ASN 124          2HD2      ASN 124   1.484   9.697  -8.804
  928   2HD2  ASN 124          1HD2      ASN 124   0.989   9.455 -10.410
  929    H    LYS 125             H      LYS 125  -2.762  13.840 -11.003
  930    HA   LYS 125            HA      LYS 125  -1.830  15.344  -8.579
  931   1HB   LYS 125           2HB      LYS 125  -3.155  16.196 -11.229
  932   2HB   LYS 125           1HB      LYS 125  -2.590  17.331  -9.994
  933   1HG   LYS 125           2HG      LYS 125  -0.558  15.334 -10.707
  934   2HG   LYS 125           1HG      LYS 125  -1.073  16.302 -12.099
  935   1HD   LYS 125           2HD      LYS 125  -0.049  18.170 -11.304
  936   2HD   LYS 125           1HD      LYS 125  -0.659  17.916  -9.670
  937   1HE   LYS 125           2HE      LYS 125   1.563  16.197 -10.767
  938   2HE   LYS 125           1HE      LYS 125   1.911  17.771 -10.053
  939   1HZ   LYS 125           1HZ      LYS 125   0.202  15.870  -8.606
  940   2HZ   LYS 125           3HZ      LYS 125   1.882  15.664  -8.574
  941   3HZ   LYS 125           2HZ      LYS 125   1.194  17.105  -7.994
  942    H    LYS 126             H      LYS 126  -4.895  14.346 -10.058
  943    HA   LYS 126            HA      LYS 126  -6.554  15.935  -8.230
  944   1HB   LYS 126           2HB      LYS 126  -7.207  13.958 -10.430
  945   2HB   LYS 126           1HB      LYS 126  -8.431  14.777  -9.460
  946   1HG   LYS 126           2HG      LYS 126  -7.484  16.969 -10.151
  947   2HG   LYS 126           1HG      LYS 126  -6.321  16.122 -11.172
  948   1HD   LYS 126           2HD      LYS 126  -9.140  15.351 -11.591
  949   2HD   LYS 126           1HD      LYS 126  -8.753  17.007 -12.035
  950   1HE   LYS 126           2HE      LYS 126  -6.971  14.746 -12.929
  951   2HE   LYS 126           1HE      LYS 126  -8.428  15.149 -13.833
  952   1HZ   LYS 126           1HZ      LYS 126  -7.634  17.453 -13.943
  953   2HZ   LYS 126           3HZ      LYS 126  -6.191  16.978 -13.198
  954   3HZ   LYS 126           2HZ      LYS 126  -6.594  16.364 -14.728
  955    H    CYS 127             H      CYS 127  -5.054  12.878  -8.184
  956    HA   CYS 127            HA      CYS 127  -6.940  11.570  -6.346
  957   1HB   CYS 127           2HB      CYS 127  -5.496  10.357  -8.145
  958   2HB   CYS 127           1HB      CYS 127  -4.177  10.584  -7.029
  959    HG   CYS 127            HG      CYS 127  -5.080   8.440  -6.122
  960    OH   TYR 128            OH      TYR 128   2.425  15.280  -1.897
  961    H    TYR 128             H      TYR 128  -3.836  13.107  -6.541
  962    HA   TYR 128            HA      TYR 128  -2.946  12.652  -3.858
  963   1HB   TYR 128           2HB      TYR 128  -1.660  13.346  -5.987
  964   2HB   TYR 128           1HB      TYR 128  -2.293  14.958  -5.737
  965    HD1  TYR 128           HD1      TYR 128  -1.409  12.965  -2.739
  966    HD2  TYR 128           HD2      TYR 128  -0.047  15.764  -5.719
  967    HE1  TYR 128           HE1      TYR 128   0.534  13.525  -1.309
  968    HE2  TYR 128           HE2      TYR 128   1.903  16.325  -4.265
  969    HH   TYR 128            HH      TYR 128   2.315  16.186  -1.596
  970    H    GLU 129             H      GLU 129  -4.964  15.076  -5.515
  971    HA   GLU 129            HA      GLU 129  -5.194  16.778  -3.084
  972   1HB   GLU 129           2HB      GLU 129  -6.550  16.900  -5.795
  973   2HB   GLU 129           1HB      GLU 129  -6.820  18.072  -4.501
  974   1HG   GLU 129           2HG      GLU 129  -4.361  18.536  -4.470
  975   2HG   GLU 129           1HG      GLU 129  -4.178  17.469  -5.860
  976    H    MET 130             H      MET 130  -7.037  14.270  -4.748
  977    HA   MET 130            HA      MET 130  -9.583  14.629  -3.434
  978   1HB   MET 130           2HB      MET 130  -8.662  12.968  -5.407
  979   2HB   MET 130           1HB      MET 130  -8.616  11.853  -4.079
  980   1HG   MET 130           2HG      MET 130 -10.764  11.715  -5.369
  981   2HG   MET 130           1HG      MET 130 -11.017  12.196  -3.670
  982   1HE   MET 130           2HE      MET 130  -9.929  13.739  -7.037
  983   2HE   MET 130           1HE      MET 130 -10.667  15.336  -7.055
  984   3HE   MET 130           3HE      MET 130  -9.355  14.978  -5.925
  985    H    ALA 131             H      ALA 131  -6.655  12.818  -2.704
  986    HA   ALA 131            HA      ALA 131  -7.523  11.817  -0.093
  987   1HB   ALA 131           1HB      ALA 131  -4.919  11.769  -1.662
  988   2HB   ALA 131           3HB      ALA 131  -4.997  11.247   0.030
  989   3HB   ALA 131           2HB      ALA 131  -5.950  10.406  -1.190
  990    H    SER 132             H      SER 132  -6.007  14.705  -1.373
  991    HA   SER 132            HA      SER 132  -4.604  15.583   0.944
  992   1HB   SER 132           2HB      SER 132  -5.980  17.121  -1.263
  993   2HB   SER 132           1HB      SER 132  -5.165  17.934   0.060
  994    HG   SER 132            HG      SER 132  -3.275  17.236  -0.664
  995    H    HIS 133             H      HIS 133  -8.054  15.551   0.054
  996    HA   HIS 133            HA      HIS 133  -8.788  17.085   2.452
  997   1HB   HIS 133           2HB      HIS 133 -10.202  16.786   0.248
  998   2HB   HIS 133           1HB      HIS 133 -10.864  15.370   1.111
  999    HD1  HIS 133           HD1      HIS 133 -11.024  19.076   0.985
 1000    HD2  HIS 133           HD2      HIS 133 -11.947  16.095   3.753
 1001    HE1  HIS 133           HE1      HIS 133 -12.424  20.177   2.789
 1002    H    LEU 134             H      LEU 134  -8.693  13.646   1.391
 1003    HA   LEU 134            HA      LEU 134  -9.767  12.653   3.909
 1004   1HB   LEU 134           2HB      LEU 134  -8.169  11.377   1.715
 1005   2HB   LEU 134           1HB      LEU 134  -8.650  10.492   3.161
 1006    HG   LEU 134            HG      LEU 134 -10.997  11.683   2.506
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.390  11.438   0.016
 1008   2HD1  LEU 134          1HD1      LEU 134 -11.100  11.056  -0.059
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.577  12.657   0.458
 1010   1HD2  LEU 134          1HD2      LEU 134  -9.811   9.048   1.674
 1011   2HD2  LEU 134          3HD2      LEU 134 -10.943   9.368   2.986
 1012   3HD2  LEU 134          2HD2      LEU 134 -11.490   9.447   1.311
 1013    NH1  ARG 135           NH2      ARG 135   0.484  14.308   4.609
 1014    NH2  ARG 135           NH1      ARG 135   0.180  12.510   5.947
 1015    H    ARG 135             H      ARG 135  -6.847  14.127   3.253
 1016    HA   ARG 135            HA      ARG 135  -5.367  12.808   5.450
 1017   1HB   ARG 135           2HB      ARG 135  -4.677  14.779   3.289
 1018   2HB   ARG 135           1HB      ARG 135  -3.731  14.815   4.776
 1019   1HG   ARG 135           2HG      ARG 135  -4.232  12.155   3.528
 1020   2HG   ARG 135           1HG      ARG 135  -3.071  13.219   2.737
 1021   1HD   ARG 135           2HD      ARG 135  -2.615  13.245   5.595
 1022   2HD   ARG 135           1HD      ARG 135  -2.622  11.583   5.004
 1023    HE   ARG 135            HE      ARG 135  -0.993  12.658   3.183
 1024   1HH1  ARG 135          1HH2      ARG 135   0.220  14.845   3.807
 1025   2HH1  ARG 135          2HH2      ARG 135   1.241  14.613   5.188
 1026   1HH2  ARG 135          2HH1      ARG 135  -0.316  11.671   6.170
 1027   2HH2  ARG 135          1HH1      ARG 135   0.937  12.812   6.527
 1028    NH1  ARG 136           NH1      ARG 136  -4.097  22.009   4.786
 1029    NH2  ARG 136           NH2      ARG 136  -6.057  22.979   4.239
 1030    H    ARG 136             H      ARG 136  -6.914  15.837   4.487
 1031    HA   ARG 136            HA      ARG 136  -6.534  17.121   7.074
 1032   1HB   ARG 136           2HB      ARG 136  -8.295  17.756   4.699
 1033   2HB   ARG 136           1HB      ARG 136  -8.275  18.740   6.165
 1034   1HG   ARG 136           2HG      ARG 136  -5.799  19.033   5.859
 1035   2HG   ARG 136           1HG      ARG 136  -5.941  18.201   4.307
 1036   1HD   ARG 136           2HD      ARG 136  -7.610  19.914   3.587
 1037   2HD   ARG 136           1HD      ARG 136  -7.337  20.771   5.104
 1038    HE   ARG 136            HE      ARG 136  -5.241  20.393   3.006
 1039   1HH1  ARG 136          2HH1      ARG 136  -3.506  21.204   4.807
 1040   2HH1  ARG 136          1HH1      ARG 136  -3.776  22.875   5.165
 1041   1HH2  ARG 136          1HH2      ARG 136  -6.972  22.919   3.839
 1042   2HH2  ARG 136          2HH2      ARG 136  -5.734  23.846   4.619
 1043    H    SER 137             H      SER 137  -8.458  14.609   5.948
 1044    HA   SER 137            HA      SER 137 -10.854  15.108   7.493
 1045   1HB   SER 137           2HB      SER 137 -11.641  13.099   6.492
 1046   2HB   SER 137           1HB      SER 137 -10.582  13.742   5.265
 1047    HG   SER 137            HG      SER 137 -10.124  11.568   5.601
 1048    H    GLN 138             H      GLN 138  -7.667  13.863   8.122
 1049    HA   GLN 138            HA      GLN 138  -6.713  13.087  10.135
 1050   1HB   GLN 138           2HB      GLN 138  -8.805  14.513  11.086
 1051   2HB   GLN 138           1HB      GLN 138  -9.322  12.898  11.581
 1052   1HG   GLN 138           2HG      GLN 138  -7.453  12.577  12.954
 1053   2HG   GLN 138           1HG      GLN 138  -6.500  13.795  12.108
 1054   1HE2  GLN 138          2HE2      GLN 138  -8.106  15.003  15.432
 1055   2HE2  GLN 138          1HE2      GLN 138  -7.487  13.466  15.063
 1056    OH   TYR 139            OH      TYR 139 -14.215  10.734  10.628
 1057    H    TYR 139             H      TYR 139  -7.896  11.411   8.004
 1058    HA   TYR 139            HA      TYR 139  -8.386   8.925   9.595
 1059   1HB   TYR 139           2HB      TYR 139  -9.468   9.711   6.846
 1060   2HB   TYR 139           1HB      TYR 139  -9.602   8.083   7.521
 1061    HD1  TYR 139           HD1      TYR 139 -10.170   8.636  10.396
 1062    HD2  TYR 139           HD2      TYR 139 -11.668  10.567   6.852
 1063    HE1  TYR 139           HE1      TYR 139 -12.206   9.334  11.630
 1064    HE2  TYR 139           HE2      TYR 139 -13.698  11.263   8.093
 1065    HH   TYR 139            HH      TYR 139 -13.942  11.065  11.486
   
  Start of MODEL           4
 Raw file had 1065 H/Q atoms
  Start of MODEL    4
    1   1H    ALA   1            1H      ALA   1 -16.439  13.572   4.750
    2   2H    ALA   1            3H      ALA   1 -14.974  14.191   5.337
    3   3H    ALA   1            2H      ALA   1 -16.178  13.687   6.424
    4    HA   ALA   1            HA      ALA   1 -17.631  15.452   5.733
    5   1HB   ALA   1           3HB      ALA   1 -14.839  16.054   6.646
    6   2HB   ALA   1           2HB      ALA   1 -15.901  17.406   6.261
    7   3HB   ALA   1           1HB      ALA   1 -16.364  16.251   7.509
    8    H    GLY   2             H      GLY   2 -18.206  15.477   3.531
    9   1HA   GLY   2           2HA      GLY   2 -18.317  16.903   1.567
   10   2HA   GLY   2           1HA      GLY   2 -16.625  17.335   1.814
   11    CH2  TRP   3           CH2      TRP   3 -12.571  11.369   3.642
   12    H    TRP   3             H      TRP   3 -17.603  13.984   2.067
   13    HA   TRP   3            HA      TRP   3 -15.763  12.918   0.283
   14   1HB   TRP   3           2HB      TRP   3 -18.274  12.029   1.364
   15   2HB   TRP   3           1HB      TRP   3 -17.612  11.109   0.054
   16    HD1  TRP   3           HD1      TRP   3 -17.731   9.459   2.289
   17    HE1  TRP   3           HE1      TRP   3 -15.824   8.731   3.825
   18    HE3  TRP   3           HE3      TRP   3 -14.300  13.243   1.389
   19    HZ2  TRP   3           HZ2      TRP   3 -13.250   9.575   4.579
   20    HZ3  TRP   3           HZ3      TRP   3 -12.148  13.166   2.558
   21    HH2  TRP   3           HH2      TRP   3 -11.616  11.358   4.145
   22    H    ASN   4             H      ASN   4 -19.139  13.804  -0.382
   23    HA   ASN   4            HA      ASN   4 -19.255  12.979  -3.100
   24   1HB   ASN   4           2HB      ASN   4 -20.747  15.220  -1.716
   25   2HB   ASN   4           1HB      ASN   4 -21.176  14.548  -3.288
   26   1HD2  ASN   4          2HD2      ASN   4 -23.183  12.163  -1.646
   27   2HD2  ASN   4          1HD2      ASN   4 -23.080  13.377  -2.828
   28    H    ALA   5             H      ALA   5 -17.833  15.783  -1.689
   29    HA   ALA   5            HA      ALA   5 -17.628  17.374  -4.118
   30   1HB   ALA   5           2HB      ALA   5 -16.383  17.521  -1.383
   31   2HB   ALA   5           1HB      ALA   5 -15.668  18.447  -2.693
   32   3HB   ALA   5           3HB      ALA   5 -17.345  18.720  -2.230
   33    OH   TYR   6            OH      TYR   6 -12.834  17.909   0.906
   34    H    TYR   6             H      TYR   6 -15.618  14.952  -2.433
   35    HA   TYR   6            HA      TYR   6 -13.439  15.194  -4.410
   36   1HB   TYR   6           2HB      TYR   6 -13.826  12.928  -2.430
   37   2HB   TYR   6           1HB      TYR   6 -12.321  13.416  -3.234
   38    HD1  TYR   6           HD1      TYR   6 -11.454  15.790  -2.862
   39    HD2  TYR   6           HD2      TYR   6 -14.573  14.025  -0.590
   40    HE1  TYR   6           HE1      TYR   6 -11.307  17.655  -1.234
   41    HE2  TYR   6           HE2      TYR   6 -14.426  15.823   1.075
   42    HH   TYR   6            HH      TYR   6 -13.450  18.577   0.588
   43    H    ILE   7             H      ILE   7 -16.518  13.905  -4.411
   44    HA   ILE   7            HA      ILE   7 -15.979  11.967  -6.563
   45    HB   ILE   7            HB      ILE   7 -18.408  12.687  -5.009
   46   1HG1  ILE   7          2HG1      ILE   7 -16.701  10.996  -4.258
   47   2HG1  ILE   7          1HG1      ILE   7 -18.339  10.372  -4.380
   48   1HG2  ILE   7          2HG2      ILE   7 -18.265  11.648  -7.753
   49   2HG2  ILE   7          1HG2      ILE   7 -19.338  10.768  -6.656
   50   3HG2  ILE   7          3HG2      ILE   7 -19.588  12.492  -6.948
   51   1HD1  ILE   7          1HD1      ILE   7 -16.961  10.110  -6.898
   52   2HD1  ILE   7          3HD1      ILE   7 -16.020   9.364  -5.613
   53   3HD1  ILE   7          2HD1      ILE   7 -17.681   8.858  -5.901
   54    H    ASP   8             H      ASP   8 -16.973  15.226  -5.859
   55    HA   ASP   8            HA      ASP   8 -17.923  15.989  -8.402
   56   1HB   ASP   8           2HB      ASP   8 -17.255  17.340  -5.913
   57   2HB   ASP   8           1HB      ASP   8 -17.250  18.324  -7.318
   58    H    ASN   9             H      ASN   9 -14.873  15.243  -7.127
   59    HA   ASN   9            HA      ASN   9 -13.080  16.826  -8.533
   60   1HB   ASN   9           2HB      ASN   9 -11.870  15.533  -7.092
   61   2HB   ASN   9           1HB      ASN   9 -13.136  14.489  -6.876
   62   1HD2  ASN   9          2HD2      ASN   9 -11.482  11.624  -8.528
   63   2HD2  ASN   9          1HD2      ASN   9 -12.640  12.183  -7.380
   64    H    LEU  10             H      LEU  10 -14.197  13.723  -9.162
   65    HA   LEU  10            HA      LEU  10 -13.391  13.050 -11.663
   66   1HB   LEU  10           2HB      LEU  10 -16.078  12.700 -10.467
   67   2HB   LEU  10           1HB      LEU  10 -15.528  11.839 -11.875
   68    HG   LEU  10            HG      LEU  10 -15.110  10.340 -10.382
   69   1HD1  LEU  10          3HD1      LEU  10 -12.605  12.034 -10.183
   70   2HD1  LEU  10          2HD1      LEU  10 -12.719  10.467  -9.409
   71   3HD1  LEU  10          1HD1      LEU  10 -12.867  10.593 -11.158
   72   1HD2  LEU  10          3HD2      LEU  10 -15.221  12.506  -8.455
   73   2HD2  LEU  10          2HD2      LEU  10 -15.889  10.929  -8.339
   74   3HD2  LEU  10          1HD2      LEU  10 -14.199  11.213  -7.967
   75    H    MET  11             H      MET  11 -16.117  14.804 -10.667
   76    HA   MET  11            HA      MET  11 -17.048  15.017 -13.402
   77   1HB   MET  11           2HB      MET  11 -17.929  16.416 -10.839
   78   2HB   MET  11           1HB      MET  11 -18.893  16.217 -12.311
   79   1HG   MET  11           2HG      MET  11 -17.711  13.647 -10.915
   80   2HG   MET  11           1HG      MET  11 -19.247  14.395 -10.347
   81   1HE   MET  11           3HE      MET  11 -17.748  11.893 -12.200
   82   2HE   MET  11           2HE      MET  11 -18.553  11.639 -13.747
   83   3HE   MET  11           1HE      MET  11 -17.391  12.950 -13.574
   84    H    ALA  12             H      ALA  12 -15.237  17.049 -11.236
   85    HA   ALA  12            HA      ALA  12 -14.975  19.319 -13.011
   86   1HB   ALA  12           2HB      ALA  12 -13.857  18.687 -10.287
   87   2HB   ALA  12           1HB      ALA  12 -13.443  20.156 -11.178
   88   3HB   ALA  12           3HB      ALA  12 -15.115  19.860 -10.699
   89    H    ASP  13             H      ASP  13 -13.319  16.341 -13.011
   90    HA   ASP  13            HA      ASP  13 -10.652  17.565 -13.597
   91   1HB   ASP  13           2HB      ASP  13 -10.016  14.960 -13.705
   92   2HB   ASP  13           1HB      ASP  13 -10.106  15.853 -12.201
   93    H    GLY  14             H      GLY  14 -13.214  16.669 -15.530
   94   1HA   GLY  14           2HA      GLY  14 -13.337  15.847 -17.815
   95   2HA   GLY  14           1HA      GLY  14 -12.216  17.184 -18.030
   96    H    THR  15             H      THR  15 -11.353  14.244 -16.308
   97    HA   THR  15            HA      THR  15  -9.748  13.122 -18.485
   98    HB   THR  15            HB      THR  15  -8.688  13.929 -15.803
   99    HG1  THR  15           HG1      THR  15  -7.810  14.477 -18.439
  100   1HG2  THR  15          3HG2      THR  15  -7.609  12.082 -17.929
  101   2HG2  THR  15          2HG2      THR  15  -6.587  12.823 -16.681
  102   3HG2  THR  15          1HG2      THR  15  -7.911  11.742 -16.222
  103    H    CYS  16             H      CYS  16 -11.123  12.845 -15.324
  104    HA   CYS  16            HA      CYS  16 -10.575  10.124 -14.864
  105   1HB   CYS  16           2HB      CYS  16 -11.749  10.596 -12.866
  106   2HB   CYS  16           1HB      CYS  16 -11.466  12.208 -13.383
  107    HG   CYS  16            HG      CYS  16 -13.883  12.253 -14.435
  108    H    GLN  17             H      GLN  17 -12.852   8.887 -14.381
  109    HA   GLN  17            HA      GLN  17 -14.861   9.108 -16.425
  110   1HB   GLN  17           2HB      GLN  17 -13.034   7.577 -17.326
  111   2HB   GLN  17           1HB      GLN  17 -13.557   6.436 -16.093
  112   1HG   GLN  17           2HG      GLN  17 -15.677   7.709 -17.778
  113   2HG   GLN  17           1HG      GLN  17 -14.695   6.473 -18.523
  114   1HE2  GLN  17          2HE2      GLN  17 -17.427   4.506 -17.121
  115   2HE2  GLN  17          1HE2      GLN  17 -17.084   5.484 -18.463
  116    H    ASP  18             H      ASP  18 -13.441   7.241 -13.791
  117    HA   ASP  18            HA      ASP  18 -16.011   7.272 -12.369
  118   1HB   ASP  18           2HB      ASP  18 -15.348   5.001 -13.462
  119   2HB   ASP  18           1HB      ASP  18 -14.342   4.854 -12.032
  120    H    ALA  19             H      ALA  19 -15.377   6.318  -9.950
  121    HA   ALA  19            HA      ALA  19 -12.812   7.413  -8.908
  122   1HB   ALA  19           1HB      ALA  19 -14.451   9.174  -9.617
  123   2HB   ALA  19           3HB      ALA  19 -15.342   8.810  -8.167
  124   3HB   ALA  19           2HB      ALA  19 -13.650   9.323  -8.086
  125    H    ALA  20             H      ALA  20 -12.518   6.282  -6.903
  126    HA   ALA  20            HA      ALA  20 -15.063   5.803  -5.397
  127   1HB   ALA  20           1HB      ALA  20 -13.355   3.604  -6.393
  128   2HB   ALA  20           3HB      ALA  20 -14.249   3.414  -4.883
  129   3HB   ALA  20           2HB      ALA  20 -15.104   3.776  -6.383
  130    H    ILE  21             H      ILE  21 -14.804   6.703  -3.590
  131    HA   ILE  21            HA      ILE  21 -12.264   6.433  -2.090
  132    HB   ILE  21            HB      ILE  21 -14.860   7.861  -1.402
  133   1HG1  ILE  21          2HG1      ILE  21 -12.146   8.813  -2.380
  134   2HG1  ILE  21          1HG1      ILE  21 -13.661   8.886  -3.275
  135   1HG2  ILE  21          1HG2      ILE  21 -12.219   7.498   0.046
  136   2HG2  ILE  21          3HG2      ILE  21 -13.206   8.935   0.351
  137   3HG2  ILE  21          2HG2      ILE  21 -13.852   7.324   0.691
  138   1HD1  ILE  21          2HD1      ILE  21 -14.330  10.192  -0.982
  139   2HD1  ILE  21          1HD1      ILE  21 -12.632  10.633  -1.158
  140   3HD1  ILE  21          3HD1      ILE  21 -13.769  10.979  -2.453
  141    H    VAL  22             H      VAL  22 -12.143   4.550  -0.882
  142    HA   VAL  22            HA      VAL  22 -14.724   3.192  -0.236
  143    HB   VAL  22            HB      VAL  22 -12.040   1.874  -0.870
  144   1HG1  VAL  22          2HG1      VAL  22 -13.921   0.696   0.499
  145   2HG1  VAL  22          1HG1      VAL  22 -14.747   0.576  -1.056
  146   3HG1  VAL  22          3HG1      VAL  22 -13.162  -0.180  -0.833
  147   1HG2  VAL  22          2HG2      VAL  22 -14.194   2.889  -2.658
  148   2HG2  VAL  22          1HG2      VAL  22 -12.483   2.608  -3.000
  149   3HG2  VAL  22          3HG2      VAL  22 -13.619   1.255  -3.001
  150    H    GLY  23             H      GLY  23 -14.975   3.188   2.027
  151   1HA   GLY  23           2HA      GLY  23 -12.793   3.398   3.940
  152   2HA   GLY  23           1HA      GLY  23 -14.455   2.930   4.334
  153    OH   TYR  24            OH      TYR  24  -5.352   1.446   4.779
  154    H    TYR  24             H      TYR  24 -11.391   1.744   3.196
  155    HA   TYR  24            HA      TYR  24 -12.146  -1.026   2.972
  156   1HB   TYR  24           2HB      TYR  24 -10.019  -1.343   2.009
  157   2HB   TYR  24           1HB      TYR  24 -10.454   0.280   1.540
  158    HD1  TYR  24           HD1      TYR  24  -9.862   1.667   4.273
  159    HD2  TYR  24           HD2      TYR  24  -7.727  -1.186   1.983
  160    HE1  TYR  24           HE1      TYR  24  -7.751   2.411   5.300
  161    HE2  TYR  24           HE2      TYR  24  -5.615  -0.468   2.963
  162    HH   TYR  24            HH      TYR  24  -5.513   1.591   5.716
  163    H    LYS  25             H      LYS  25 -12.396   0.062   5.727
  164    HA   LYS  25            HA      LYS  25 -10.240  -0.824   7.362
  165   1HB   LYS  25           2HB      LYS  25 -13.091  -0.249   7.916
  166   2HB   LYS  25           1HB      LYS  25 -12.016  -0.786   9.173
  167   1HG   LYS  25           2HG      LYS  25 -11.916   1.562   9.305
  168   2HG   LYS  25           1HG      LYS  25 -10.464   1.114   8.415
  169   1HD   LYS  25           2HD      LYS  25 -11.304   1.829   6.403
  170   2HD   LYS  25           1HD      LYS  25 -12.983   1.657   6.918
  171   1HE   LYS  25           2HE      LYS  25 -11.043   3.727   7.973
  172   2HE   LYS  25           1HE      LYS  25 -12.302   4.033   6.782
  173   1HZ   LYS  25           3HZ      LYS  25 -13.855   3.042   8.553
  174   2HZ   LYS  25           2HZ      LYS  25 -12.589   3.365   9.639
  175   3HZ   LYS  25           1HZ      LYS  25 -13.301   4.628   8.764
  176    H    ASP  26             H      ASP  26 -11.799  -2.562   9.146
  177    HA   ASP  26            HA      ASP  26 -11.133  -5.151   8.353
  178   1HB   ASP  26           2HB      ASP  26 -13.282  -5.849   9.655
  179   2HB   ASP  26           1HB      ASP  26 -11.934  -5.154  10.526
  180    H    SER  27             H      SER  27 -14.358  -3.746   7.951
  181    HA   SER  27            HA      SER  27 -14.888  -5.517   5.671
  182   1HB   SER  27           2HB      SER  27 -17.225  -4.518   6.046
  183   2HB   SER  27           1HB      SER  27 -16.679  -5.718   7.179
  184    HG   SER  27            HG      SER  27 -17.539  -3.349   7.749
  185    HA   PRO  28            HA      PRO  28 -14.060  -1.747   3.476
  186   1HB   PRO  28           2HB      PRO  28 -14.212  -2.789   0.944
  187   2HB   PRO  28           1HB      PRO  28 -12.791  -2.932   1.992
  188   1HG   PRO  28           2HG      PRO  28 -14.729  -5.015   1.240
  189   2HG   PRO  28           1HG      PRO  28 -13.130  -5.177   1.925
  190   1HD   PRO  28           2HD      PRO  28 -15.627  -5.424   3.269
  191   2HD   PRO  28           1HD      PRO  28 -13.993  -5.570   3.953
  192    H    SER  29             H      SER  29 -15.264  -0.190   2.265
  193    HA   SER  29            HA      SER  29 -17.851  -0.858   1.212
  194   1HB   SER  29           2HB      SER  29 -19.070   0.742   2.644
  195   2HB   SER  29           1HB      SER  29 -18.390  -0.577   3.593
  196    HG   SER  29            HG      SER  29 -17.611   2.111   3.401
  197    H    VAL  30             H      VAL  30 -18.827   1.000   0.180
  198    HA   VAL  30            HA      VAL  30 -16.776   2.632  -1.064
  199    HB   VAL  30            HB      VAL  30 -19.704   2.132  -1.579
  200   1HG1  VAL  30          3HG1      VAL  30 -19.000   4.442  -2.269
  201   2HG1  VAL  30          2HG1      VAL  30 -17.736   3.712  -3.256
  202   3HG1  VAL  30          1HG1      VAL  30 -19.432   3.414  -3.640
  203   1HG2  VAL  30          1HG2      VAL  30 -17.080   1.166  -2.651
  204   2HG2  VAL  30          3HG2      VAL  30 -18.531   0.235  -2.251
  205   3HG2  VAL  30          2HG2      VAL  30 -18.485   1.220  -3.700
  206    CH2  TRP  31           CH2      TRP  31 -13.540   6.167   6.759
  207    H    TRP  31             H      TRP  31 -16.248   4.225   0.369
  208    HA   TRP  31            HA      TRP  31 -18.080   5.664   2.024
  209   1HB   TRP  31           2HB      TRP  31 -15.197   5.876   1.266
  210   2HB   TRP  31           1HB      TRP  31 -15.959   7.303   1.968
  211    HD1  TRP  31           HD1      TRP  31 -17.440   4.087   3.176
  212    HE1  TRP  31           HE1      TRP  31 -16.697   3.622   5.550
  213    HE3  TRP  31           HE3      TRP  31 -13.708   7.550   3.658
  214    HZ2  TRP  31           HZ2      TRP  31 -14.789   4.563   7.463
  215    HZ3  TRP  31           HZ3      TRP  31 -12.460   7.746   5.783
  216    HH2  TRP  31           HH2      TRP  31 -12.986   6.253   7.681
  217    H    ALA  32             H      ALA  32 -17.101   5.953  -1.296
  218    HA   ALA  32            HA      ALA  32 -19.157   7.724  -2.046
  219   1HB   ALA  32           1HB      ALA  32 -16.607   9.130  -1.242
  220   2HB   ALA  32           3HB      ALA  32 -17.693   9.831  -2.459
  221   3HB   ALA  32           2HB      ALA  32 -18.274   9.529  -0.814
  222    H    ALA  33             H      ALA  33 -19.007   6.140  -3.752
  223    HA   ALA  33            HA      ALA  33 -16.912   6.802  -5.761
  224   1HB   ALA  33           1HB      ALA  33 -18.195   4.104  -5.244
  225   2HB   ALA  33           3HB      ALA  33 -17.128   4.465  -6.601
  226   3HB   ALA  33           2HB      ALA  33 -16.507   4.532  -4.947
  227    H    VAL  34             H      VAL  34 -17.680   7.432  -7.683
  228    HA   VAL  34            HA      VAL  34 -20.366   8.111  -8.239
  229    HB   VAL  34            HB      VAL  34 -18.393   7.151 -10.350
  230   1HG1  VAL  34          1HG1      VAL  34 -20.832   8.910 -10.305
  231   2HG1  VAL  34          3HG1      VAL  34 -19.579   9.193 -11.519
  232   3HG1  VAL  34          2HG1      VAL  34 -20.408   7.619 -11.442
  233   1HG2  VAL  34          1HG2      VAL  34 -18.150   9.347  -8.439
  234   2HG2  VAL  34          3HG2      VAL  34 -16.992   8.802  -9.657
  235   3HG2  VAL  34          2HG2      VAL  34 -18.238   9.972 -10.088
  236    HA   PRO  35            HA      PRO  35 -21.706   3.766  -8.269
  237   1HB   PRO  35           2HB      PRO  35 -24.385   4.252  -7.961
  238   2HB   PRO  35           1HB      PRO  35 -23.230   4.197  -6.621
  239   1HG   PRO  35           2HG      PRO  35 -24.488   6.582  -7.924
  240   2HG   PRO  35           1HG      PRO  35 -23.938   6.378  -6.250
  241   1HD   PRO  35           2HD      PRO  35 -22.528   7.763  -8.249
  242   2HD   PRO  35           1HD      PRO  35 -21.825   7.150  -6.737
  243    H    GLY  36             H      GLY  36 -22.859   2.391  -9.677
  244   1HA   GLY  36           2HA      GLY  36 -24.375   2.022 -11.554
  245   2HA   GLY  36           1HA      GLY  36 -23.998   3.647 -12.125
  246    H    LYS  37             H      LYS  37 -21.082   3.389 -11.713
  247    HA   LYS  37            HA      LYS  37 -20.499   2.064 -14.253
  248   1HB   LYS  37           2HB      LYS  37 -18.653   3.438 -12.298
  249   2HB   LYS  37           1HB      LYS  37 -18.212   2.919 -13.921
  250   1HG   LYS  37           2HG      LYS  37 -20.320   4.987 -13.188
  251   2HG   LYS  37           1HG      LYS  37 -18.784   5.293 -13.992
  252   1HD   LYS  37           2HD      LYS  37 -19.583   3.751 -15.863
  253   2HD   LYS  37           1HD      LYS  37 -21.173   3.786 -15.101
  254   1HE   LYS  37           2HE      LYS  37 -19.648   6.253 -15.975
  255   2HE   LYS  37           1HE      LYS  37 -20.915   5.479 -16.926
  256   1HZ   LYS  37           3HZ      LYS  37 -22.361   5.755 -14.898
  257   2HZ   LYS  37           2HZ      LYS  37 -21.160   6.785 -14.278
  258   3HZ   LYS  37           1HZ      LYS  37 -21.962   7.180 -15.724
  259    H    THR  38             H      THR  38 -18.043   1.668 -11.686
  260    HA   THR  38            HA      THR  38 -18.580  -1.229 -11.490
  261    HB   THR  38            HB      THR  38 -16.508  -0.017 -13.188
  262    HG1  THR  38           HG1      THR  38 -17.623  -2.585 -13.283
  263   1HG2  THR  38          2HG2      THR  38 -15.850  -2.257 -11.316
  264   2HG2  THR  38          1HG2      THR  38 -15.219  -2.347 -12.954
  265   3HG2  THR  38          3HG2      THR  38 -14.792  -0.974 -11.919
  266    H    PHE  39             H      PHE  39 -16.349   1.402 -10.625
  267    HA   PHE  39            HA      PHE  39 -14.786   0.090  -8.680
  268   1HB   PHE  39           2HB      PHE  39 -15.661   2.934  -8.972
  269   2HB   PHE  39           1HB      PHE  39 -14.664   2.404  -7.640
  270    HD1  PHE  39           HD2      PHE  39 -14.434   0.967 -11.061
  271    HD2  PHE  39           HD1      PHE  39 -12.658   3.615  -8.191
  272    HE1  PHE  39           HE2      PHE  39 -12.410   1.103 -12.436
  273    HE2  PHE  39           HE1      PHE  39 -10.625   3.748  -9.576
  274    HZ   PHE  39            HZ      PHE  39 -10.528   2.465 -11.693
  275    H    VAL  40             H      VAL  40 -17.793   1.849  -8.215
  276    HA   VAL  40            HA      VAL  40 -17.990   1.758  -5.423
  277    HB   VAL  40            HB      VAL  40 -19.517   3.190  -6.561
  278   1HG1  VAL  40          1HG1      VAL  40 -19.973   0.755  -8.193
  279   2HG1  VAL  40          3HG1      VAL  40 -21.302   1.895  -8.038
  280   3HG1  VAL  40          2HG1      VAL  40 -19.754   2.435  -8.692
  281   1HG2  VAL  40          1HG2      VAL  40 -20.441   1.422  -4.672
  282   2HG2  VAL  40          3HG2      VAL  40 -21.396   2.761  -5.316
  283   3HG2  VAL  40          2HG2      VAL  40 -21.582   1.140  -5.988
  284    H    ASN  41             H      ASN  41 -18.404  -0.781  -7.744
  285    HA   ASN  41            HA      ASN  41 -19.885  -2.561  -5.993
  286   1HB   ASN  41           2HB      ASN  41 -18.473  -2.898  -8.646
  287   2HB   ASN  41           1HB      ASN  41 -19.305  -4.191  -7.823
  288   1HD2  ASN  41          2HD2      ASN  41 -22.429  -3.210  -9.067
  289   2HD2  ASN  41          1HD2      ASN  41 -21.446  -4.449  -8.455
  290    H    ILE  42             H      ILE  42 -17.044  -1.350  -5.298
  291    HA   ILE  42            HA      ILE  42 -15.259  -3.548  -5.340
  292    HB   ILE  42            HB      ILE  42 -15.252  -0.745  -4.289
  293   1HG1  ILE  42          2HG1      ILE  42 -12.968  -2.240  -5.547
  294   2HG1  ILE  42          1HG1      ILE  42 -14.359  -1.784  -6.533
  295   1HG2  ILE  42          1HG2      ILE  42 -13.312  -2.851  -3.253
  296   2HG2  ILE  42          3HG2      ILE  42 -13.107  -1.110  -3.069
  297   3HG2  ILE  42          2HG2      ILE  42 -14.457  -1.923  -2.290
  298   1HD1  ILE  42          1HD1      ILE  42 -13.980   0.569  -5.361
  299   2HD1  ILE  42          3HD1      ILE  42 -12.337  -0.046  -5.183
  300   3HD1  ILE  42          2HD1      ILE  42 -13.050   0.110  -6.793
  301    H    THR  43             H      THR  43 -15.022  -5.079  -3.952
  302    HA   THR  43            HA      THR  43 -16.420  -5.240  -1.325
  303    HB   THR  43            HB      THR  43 -16.139  -7.801  -1.999
  304    HG1  THR  43           HG1      THR  43 -15.549  -8.206  -3.934
  305   1HG2  THR  43          2HG2      THR  43 -18.124  -5.785  -2.769
  306   2HG2  THR  43          1HG2      THR  43 -18.188  -7.295  -3.688
  307   3HG2  THR  43          3HG2      THR  43 -18.352  -7.328  -1.933
  308    HA   PRO  44            HA      PRO  44 -12.381  -6.174   0.423
  309   1HB   PRO  44           2HB      PRO  44 -12.534  -8.551   1.671
  310   2HB   PRO  44           1HB      PRO  44 -13.147  -7.063   2.349
  311   1HG   PRO  44           2HG      PRO  44 -14.663  -9.329   1.125
  312   2HG   PRO  44           1HG      PRO  44 -15.184  -8.171   2.362
  313   1HD   PRO  44           2HD      PRO  44 -15.916  -8.059  -0.307
  314   2HD   PRO  44           1HD      PRO  44 -16.006  -6.691   0.796
  315    H    ALA  45             H      ALA  45 -13.462  -8.054  -2.020
  316    HA   ALA  45            HA      ALA  45 -11.221  -9.871  -2.335
  317   1HB   ALA  45           2HB      ALA  45 -13.838  -9.463  -3.529
  318   2HB   ALA  45           1HB      ALA  45 -12.596  -9.688  -4.765
  319   3HB   ALA  45           3HB      ALA  45 -12.840 -10.923  -3.528
  320    H    GLU  46             H      GLU  46 -12.598  -7.396  -4.361
  321    HA   GLU  46            HA      GLU  46 -10.211  -6.874  -5.908
  322   1HB   GLU  46           2HB      GLU  46 -11.461  -4.525  -6.251
  323   2HB   GLU  46           1HB      GLU  46 -11.998  -5.970  -7.083
  324   1HG   GLU  46           2HG      GLU  46 -13.122  -5.531  -4.394
  325   2HG   GLU  46           1HG      GLU  46 -13.569  -4.349  -5.607
  326    H    VAL  47             H      VAL  47 -11.411  -5.644  -2.859
  327    HA   VAL  47            HA      VAL  47  -9.315  -3.662  -2.625
  328    HB   VAL  47            HB      VAL  47 -11.754  -4.245  -1.158
  329   1HG1  VAL  47          1HG1      VAL  47  -9.406  -3.087   0.204
  330   2HG1  VAL  47          3HG1      VAL  47 -11.040  -3.126   0.850
  331   3HG1  VAL  47          2HG1      VAL  47 -10.139  -4.635   0.618
  332   1HG2  VAL  47          2HG2      VAL  47 -11.014  -2.218  -2.635
  333   2HG2  VAL  47          1HG2      VAL  47 -11.969  -1.923  -1.177
  334   3HG2  VAL  47          3HG2      VAL  47 -10.197  -1.687  -1.127
  335    H    GLY  48             H      GLY  48  -9.804  -6.973  -1.869
  336   1HA   GLY  48           2HA      GLY  48  -7.911  -7.343   0.223
  337   2HA   GLY  48           1HA      GLY  48  -8.406  -8.582  -0.931
  338    H    VAL  49             H      VAL  49  -7.569  -6.932  -3.223
  339    HA   VAL  49            HA      VAL  49  -4.663  -7.500  -3.077
  340    HB   VAL  49            HB      VAL  49  -5.895  -8.525  -4.975
  341   1HG1  VAL  49          3HG1      VAL  49  -7.307  -6.278  -5.133
  342   2HG1  VAL  49          2HG1      VAL  49  -6.062  -5.856  -6.301
  343   3HG1  VAL  49          1HG1      VAL  49  -7.053  -7.294  -6.542
  344   1HG2  VAL  49          1HG2      VAL  49  -3.677  -6.518  -5.440
  345   2HG2  VAL  49          3HG2      VAL  49  -3.594  -8.286  -5.416
  346   3HG2  VAL  49          2HG2      VAL  49  -4.333  -7.461  -6.788
  347    H    LEU  50             H      LEU  50  -6.873  -4.891  -3.708
  348    HA   LEU  50            HA      LEU  50  -5.001  -2.859  -4.408
  349   1HB   LEU  50           2HB      LEU  50  -7.756  -3.022  -3.469
  350   2HB   LEU  50           1HB      LEU  50  -6.989  -1.524  -3.223
  351    HG   LEU  50            HG      LEU  50  -6.943  -2.746  -5.941
  352   1HD1  LEU  50          1HD1      LEU  50  -9.325  -2.851  -5.061
  353   2HD1  LEU  50          3HD1      LEU  50  -9.252  -1.110  -4.747
  354   3HD1  LEU  50          2HD1      LEU  50  -9.146  -1.732  -6.406
  355   1HD2  LEU  50          1HD2      LEU  50  -5.714  -0.621  -5.320
  356   2HD2  LEU  50          3HD2      LEU  50  -6.925  -0.381  -6.579
  357   3HD2  LEU  50          2HD2      LEU  50  -7.273   0.103  -4.912
  358    H    VAL  51             H      VAL  51  -5.754  -4.425  -1.464
  359    HA   VAL  51            HA      VAL  51  -4.115  -2.497   0.079
  360    HB   VAL  51            HB      VAL  51  -5.880  -1.830   1.486
  361   1HG1  VAL  51          3HG1      VAL  51  -7.279  -2.550  -1.089
  362   2HG1  VAL  51          2HG1      VAL  51  -8.045  -1.632   0.183
  363   3HG1  VAL  51          1HG1      VAL  51  -6.617  -0.990  -0.619
  364   1HG2  VAL  51          3HG2      VAL  51  -6.929  -4.603   1.104
  365   2HG2  VAL  51          2HG2      VAL  51  -6.760  -3.647   2.582
  366   3HG2  VAL  51          1HG2      VAL  51  -8.104  -3.332   1.484
  367    H    GLY  52             H      GLY  52  -4.752  -5.746  -0.581
  368   1HA   GLY  52           2HA      GLY  52  -4.681  -7.137   1.798
  369   2HA   GLY  52           1HA      GLY  52  -3.917  -7.709   0.319
  370    H    LYS  53             H      LYS  53  -2.967  -8.068   2.927
  371    HA   LYS  53            HA      LYS  53  -0.877  -6.343   3.661
  372   1HB   LYS  53           2HB      LYS  53   0.006  -8.244   4.981
  373   2HB   LYS  53           1HB      LYS  53  -1.729  -8.014   5.223
  374   1HG   LYS  53           2HG      LYS  53  -1.785 -10.265   4.775
  375   2HG   LYS  53           1HG      LYS  53  -1.793  -9.695   3.106
  376   1HD   LYS  53           2HD      LYS  53   0.419 -10.263   2.749
  377   2HD   LYS  53           1HD      LYS  53   0.857 -10.039   4.442
  378   1HE   LYS  53           2HE      LYS  53  -0.286 -12.108   5.057
  379   2HE   LYS  53           1HE      LYS  53  -0.859 -12.317   3.406
  380   1HZ   LYS  53           2HZ      LYS  53   1.880 -12.015   3.194
  381   2HZ   LYS  53           1HZ      LYS  53   1.654 -13.029   4.540
  382   3HZ   LYS  53           3HZ      LYS  53   0.999 -13.459   3.039
  383    H    ASP  54             H      ASP  54  -1.112  -8.537   1.067
  384    HA   ASP  54            HA      ASP  54   1.465  -9.384   0.613
  385   1HB   ASP  54           2HB      ASP  54  -0.797  -9.808  -0.642
  386   2HB   ASP  54           1HB      ASP  54  -0.193  -8.536  -1.694
  387    NH1  ARG  55           NH2      ARG  55   5.300  -0.591   1.918
  388    NH2  ARG  55           NH1      ARG  55   6.852  -1.625   3.195
  389    H    ARG  55             H      ARG  55   3.207  -8.183   0.301
  390    HA   ARG  55            HA      ARG  55   2.973  -5.435  -0.587
  391   1HB   ARG  55           2HB      ARG  55   4.111  -6.520   1.739
  392   2HB   ARG  55           1HB      ARG  55   5.472  -5.996   0.751
  393   1HG   ARG  55           2HG      ARG  55   4.197  -3.784   0.455
  394   2HG   ARG  55           1HG      ARG  55   3.163  -4.337   1.773
  395   1HD   ARG  55           2HD      ARG  55   5.210  -4.654   3.181
  396   2HD   ARG  55           1HD      ARG  55   6.165  -3.938   1.882
  397    HE   ARG  55            HE      ARG  55   4.001  -2.451   3.319
  398   1HH1  ARG  55          1HH2      ARG  55   4.388  -0.575   1.508
  399   2HH1  ARG  55          2HH2      ARG  55   5.932   0.168   1.763
  400   1HH2  ARG  55          2HH1      ARG  55   7.132  -2.402   3.759
  401   2HH2  ARG  55          1HH1      ARG  55   7.480  -0.860   3.051
  402    H    SER  56             H      SER  56   3.330  -7.721  -2.473
  403    HA   SER  56            HA      SER  56   5.485  -6.576  -4.038
  404   1HB   SER  56           2HB      SER  56   6.833  -7.744  -2.382
  405   2HB   SER  56           1HB      SER  56   6.063  -9.262  -2.826
  406    HG   SER  56            HG      SER  56   8.091  -8.878  -3.893
  407    H    SER  57             H      SER  57   2.894  -8.800  -3.912
  408    HA   SER  57            HA      SER  57   3.569 -10.110  -6.425
  409   1HB   SER  57           2HB      SER  57   1.257 -11.124  -6.150
  410   2HB   SER  57           1HB      SER  57   2.480 -11.559  -4.970
  411    HG   SER  57            HG      SER  57   0.315 -10.836  -4.207
  412    H    PHE  58             H      PHE  58   0.371  -8.862  -5.839
  413    HA   PHE  58            HA      PHE  58  -0.437  -8.288  -8.360
  414   1HB   PHE  58           2HB      PHE  58  -1.970  -6.579  -7.501
  415   2HB   PHE  58           1HB      PHE  58  -1.949  -8.042  -6.546
  416    HD1  PHE  58           HD2      PHE  58  -0.835  -4.544  -6.708
  417    HD2  PHE  58           HD1      PHE  58  -1.206  -8.045  -4.259
  418    HE1  PHE  58           HE2      PHE  58  -0.378  -3.190  -4.704
  419    HE2  PHE  58           HE1      PHE  58  -0.740  -6.680  -2.240
  420    HZ   PHE  58            HZ      PHE  58  -0.327  -4.252  -2.470
  421    OH   TYR  59            OH      TYR  59   2.828  -3.271  -2.174
  422    H    TYR  59             H      TYR  59   2.131  -6.376  -6.937
  423    HA   TYR  59            HA      TYR  59   1.733  -4.040  -8.423
  424   1HB   TYR  59           2HB      TYR  59   4.426  -5.151  -7.761
  425   2HB   TYR  59           1HB      TYR  59   4.037  -3.478  -8.112
  426    HD1  TYR  59           HD1      TYR  59   1.680  -2.971  -6.569
  427    HD2  TYR  59           HD2      TYR  59   5.158  -5.233  -5.543
  428    HE1  TYR  59           HE1      TYR  59   1.319  -2.448  -4.163
  429    HE2  TYR  59           HE2      TYR  59   4.794  -4.709  -3.168
  430    HH   TYR  59            HH      TYR  59   3.325  -2.478  -1.958
  431    H    VAL  60             H      VAL  60   2.317  -7.012  -9.709
  432    HA   VAL  60            HA      VAL  60   3.378  -5.820 -12.184
  433    HB   VAL  60            HB      VAL  60   4.103  -8.346 -12.492
  434   1HG1  VAL  60          2HG1      VAL  60   5.435  -6.130 -10.974
  435   2HG1  VAL  60          1HG1      VAL  60   6.283  -7.652 -11.268
  436   3HG1  VAL  60          3HG1      VAL  60   5.741  -6.668 -12.628
  437   1HG2  VAL  60          3HG2      VAL  60   4.086  -7.992  -9.488
  438   2HG2  VAL  60          2HG2      VAL  60   3.160  -9.190 -10.397
  439   3HG2  VAL  60          1HG2      VAL  60   4.920  -9.294 -10.341
  440    H    ASN  61             H      ASN  61   0.975  -8.093 -10.831
  441    HA   ASN  61            HA      ASN  61   0.104  -8.839 -13.499
  442   1HB   ASN  61           2HB      ASN  61  -1.561 -10.200 -12.295
  443   2HB   ASN  61           1HB      ASN  61   0.069 -10.579 -11.856
  444   1HD2  ASN  61          2HD2      ASN  61  -0.636 -10.172  -8.509
  445   2HD2  ASN  61          1HD2      ASN  61   0.213 -10.982  -9.726
  446    H    GLY  62             H      GLY  62  -0.973  -6.788 -10.874
  447   1HA   GLY  62           2HA      GLY  62  -2.154  -4.740 -11.487
  448   2HA   GLY  62           1HA      GLY  62  -3.084  -5.701 -12.644
  449    H    LEU  63             H      LEU  63  -4.041  -4.048 -10.402
  450    HA   LEU  63            HA      LEU  63  -5.015  -5.897  -8.330
  451   1HB   LEU  63           2HB      LEU  63  -6.081  -3.089  -8.711
  452   2HB   LEU  63           1HB      LEU  63  -5.937  -4.007  -7.207
  453    HG   LEU  63            HG      LEU  63  -3.623  -2.916  -8.826
  454   1HD1  LEU  63          2HD1      LEU  63  -5.366  -1.425  -7.456
  455   2HD1  LEU  63          1HD1      LEU  63  -4.395  -1.991  -6.091
  456   3HD1  LEU  63          3HD1      LEU  63  -3.639  -1.094  -7.409
  457   1HD2  LEU  63          3HD2      LEU  63  -3.932  -4.541  -6.326
  458   2HD2  LEU  63          2HD2      LEU  63  -2.786  -4.747  -7.654
  459   3HD2  LEU  63          1HD2      LEU  63  -2.568  -3.437  -6.493
  460    H    THR  64             H      THR  64  -7.647  -4.611  -8.095
  461    HA   THR  64            HA      THR  64  -9.083  -5.119 -10.539
  462    HB   THR  64            HB      THR  64 -10.497  -6.891  -9.415
  463    HG1  THR  64           HG1      THR  64  -9.453  -8.008  -7.720
  464   1HG2  THR  64          3HG2      THR  64  -8.676  -7.269 -11.133
  465   2HG2  THR  64          2HG2      THR  64  -7.631  -7.740  -9.785
  466   3HG2  THR  64          1HG2      THR  64  -9.101  -8.662 -10.141
  467    H    LEU  65             H      LEU  65 -10.758  -3.814 -10.401
  468    HA   LEU  65            HA      LEU  65 -11.762  -2.973  -7.762
  469   1HB   LEU  65           2HB      LEU  65 -12.051  -0.656  -8.978
  470   2HB   LEU  65           1HB      LEU  65 -10.609  -1.063  -8.098
  471    HG   LEU  65            HG      LEU  65  -9.651  -1.904 -10.316
  472   1HD1  LEU  65          2HD1      LEU  65 -12.253  -0.784 -11.166
  473   2HD1  LEU  65          1HD1      LEU  65 -10.866  -0.394 -12.178
  474   3HD1  LEU  65          3HD1      LEU  65 -11.291  -2.073 -11.875
  475   1HD2  LEU  65          3HD2      LEU  65 -10.098   0.872  -9.387
  476   2HD2  LEU  65          2HD2      LEU  65  -8.590   0.043  -9.804
  477   3HD2  LEU  65          1HD2      LEU  65  -9.599   0.723 -11.080
  478    H    GLY  66             H      GLY  66 -13.639  -3.920  -7.774
  479   1HA   GLY  66           2HA      GLY  66 -15.921  -4.170  -8.212
  480   2HA   GLY  66           1HA      GLY  66 -15.742  -3.009  -9.521
  481    H    GLY  67             H      GLY  67 -13.594  -5.740  -9.292
  482   1HA   GLY  67           2HA      GLY  67 -13.565  -7.789 -10.457
  483   2HA   GLY  67           1HA      GLY  67 -15.094  -7.353 -11.222
  484    H    GLN  68             H      GLN  68 -12.834  -4.713 -11.378
  485    HA   GLN  68            HA      GLN  68 -12.227  -5.523 -14.215
  486   1HB   GLN  68           2HB      GLN  68 -13.465  -3.563 -14.344
  487   2HB   GLN  68           1HB      GLN  68 -12.630  -2.901 -12.995
  488   1HG   GLN  68           2HG      GLN  68 -11.993  -1.884 -15.256
  489   2HG   GLN  68           1HG      GLN  68 -10.645  -2.416 -14.260
  490   1HE2  GLN  68          2HE2      GLN  68  -9.529  -4.214 -17.129
  491   2HE2  GLN  68          1HE2      GLN  68  -9.196  -2.948 -16.041
  492    H    LYS  69             H      LYS  69 -10.291  -6.395 -14.348
  493    HA   LYS  69            HA      LYS  69  -8.117  -6.117 -12.624
  494   1HB   LYS  69           2HB      LYS  69  -8.635  -7.882 -14.422
  495   2HB   LYS  69           1HB      LYS  69  -7.907  -6.741 -15.552
  496   1HG   LYS  69           2HG      LYS  69  -6.065  -7.941 -14.945
  497   2HG   LYS  69           1HG      LYS  69  -6.023  -6.667 -13.739
  498   1HD   LYS  69           2HD      LYS  69  -6.980  -8.050 -12.074
  499   2HD   LYS  69           1HD      LYS  69  -7.466  -9.260 -13.260
  500   1HE   LYS  69           2HE      LYS  69  -5.068  -9.742 -13.730
  501   2HE   LYS  69           1HE      LYS  69  -4.606  -8.566 -12.501
  502   1HZ   LYS  69           2HZ      LYS  69  -6.268 -10.061 -11.086
  503   2HZ   LYS  69           1HZ      LYS  69  -5.730 -11.238 -12.190
  504   3HZ   LYS  69           3HZ      LYS  69  -4.611 -10.413 -11.220
  505    H    CYS  70             H      CYS  70  -7.038  -4.210 -12.247
  506    HA   CYS  70            HA      CYS  70  -6.334  -2.526 -14.645
  507   1HB   CYS  70           2HB      CYS  70  -6.017  -0.736 -12.881
  508   2HB   CYS  70           1HB      CYS  70  -7.674  -1.218 -13.144
  509    HG   CYS  70            HG      CYS  70  -6.303  -2.662 -10.800
  510    H    SER  71             H      SER  71  -4.111  -1.651 -14.311
  511    HA   SER  71            HA      SER  71  -2.358  -3.618 -12.960
  512   1HB   SER  71           2HB      SER  71  -0.875  -3.489 -14.792
  513   2HB   SER  71           1HB      SER  71  -2.505  -3.731 -15.402
  514    HG   SER  71            HG      SER  71  -2.518  -1.284 -15.468
  515    H    VAL  72             H      VAL  72  -1.448  -2.664 -11.260
  516    HA   VAL  72            HA      VAL  72  -0.923   0.018 -10.756
  517    HB   VAL  72            HB      VAL  72   1.059  -2.048  -9.988
  518   1HG1  VAL  72          3HG1      VAL  72   0.588   0.686  -9.348
  519   2HG1  VAL  72          2HG1      VAL  72   0.273  -0.267  -7.903
  520   3HG1  VAL  72          1HG1      VAL  72   1.833  -0.382  -8.708
  521   1HG2  VAL  72          1HG2      VAL  72  -1.720  -1.679  -8.947
  522   2HG2  VAL  72          3HG2      VAL  72  -0.925  -3.175  -9.425
  523   3HG2  VAL  72          2HG2      VAL  72  -0.444  -2.357  -7.940
  524    H    ILE  73             H      ILE  73   0.350   1.414 -11.565
  525    HA   ILE  73            HA      ILE  73   2.700   0.623 -13.037
  526    HB   ILE  73            HB      ILE  73   0.624   2.551 -13.873
  527   1HG1  ILE  73          2HG1      ILE  73   1.980   0.643 -15.707
  528   2HG1  ILE  73          1HG1      ILE  73   0.900  -0.048 -14.500
  529   1HG2  ILE  73          2HG2      ILE  73   3.500   2.650 -14.431
  530   2HG2  ILE  73          1HG2      ILE  73   2.445   2.830 -15.831
  531   3HG2  ILE  73          3HG2      ILE  73   2.313   3.954 -14.477
  532   1HD1  ILE  73          1HD1      ILE  73  -0.894   1.567 -15.353
  533   2HD1  ILE  73          3HD1      ILE  73   0.195   1.940 -16.690
  534   3HD1  ILE  73          2HD1      ILE  73  -0.435   0.286 -16.502
  535    NH1  ARG  74           NH2      ARG  74   8.292   5.049 -12.314
  536    NH2  ARG  74           NH1      ARG  74   9.351   6.433 -10.882
  537    H    ARG  74             H      ARG  74   3.439   0.933 -10.977
  538    HA   ARG  74            HA      ARG  74   5.169   1.969  -9.737
  539   1HB   ARG  74           2HB      ARG  74   4.471   4.200 -11.316
  540   2HB   ARG  74           1HB      ARG  74   4.147   4.718  -9.657
  541   1HG   ARG  74           2HG      ARG  74   6.512   3.553  -9.240
  542   2HG   ARG  74           1HG      ARG  74   6.733   3.921 -10.952
  543   1HD   ARG  74           2HD      ARG  74   5.592   6.156  -9.419
  544   2HD   ARG  74           1HD      ARG  74   7.205   5.686  -8.884
  545    HE   ARG  74            HE      ARG  74   6.618   7.071 -11.323
  546   1HH1  ARG  74          1HH2      ARG  74   7.446   4.670 -12.684
  547   2HH1  ARG  74          2HH2      ARG  74   9.175   4.750 -12.675
  548   1HH2  ARG  74          2HH1      ARG  74   9.319   7.117 -10.154
  549   2HH2  ARG  74          1HH1      ARG  74  10.233   6.127 -11.240
  550    H    ASP  75             H      ASP  75   3.992   0.647  -8.230
  551    HA   ASP  75            HA      ASP  75   1.773   1.723  -6.836
  552   1HB   ASP  75           2HB      ASP  75   1.920  -0.651  -6.753
  553   2HB   ASP  75           1HB      ASP  75   3.535  -0.558  -6.177
  554    H    SER  76             H      SER  76   2.004   3.611  -5.985
  555    HA   SER  76            HA      SER  76   4.268   3.914  -4.035
  556   1HB   SER  76           2HB      SER  76   3.276   6.515  -4.709
  557   2HB   SER  76           1HB      SER  76   4.844   5.855  -5.093
  558    HG   SER  76            HG      SER  76   4.046   5.100  -7.019
  559    H    LEU  77             H      LEU  77   1.409   2.884  -3.953
  560    HA   LEU  77            HA      LEU  77  -0.434   4.498  -2.567
  561   1HB   LEU  77           2HB      LEU  77  -0.670   2.193  -3.717
  562   2HB   LEU  77           1HB      LEU  77  -0.054   1.482  -2.235
  563    HG   LEU  77            HG      LEU  77  -1.903   2.742  -1.049
  564   1HD1  LEU  77          3HD1      LEU  77  -2.680   3.119  -3.947
  565   2HD1  LEU  77          2HD1      LEU  77  -3.878   3.168  -2.650
  566   3HD1  LEU  77          1HD1      LEU  77  -2.572   4.351  -2.685
  567   1HD2  LEU  77          2HD2      LEU  77  -2.207   0.433  -2.932
  568   2HD2  LEU  77          1HD2      LEU  77  -2.296   0.456  -1.165
  569   3HD2  LEU  77          3HD2      LEU  77  -3.652   1.053  -2.124
  570    H    LEU  78             H      LEU  78   0.267   1.880  -0.415
  571    HA   LEU  78            HA      LEU  78   0.432   3.875   1.618
  572   1HB   LEU  78           2HB      LEU  78   0.366   2.001   3.265
  573   2HB   LEU  78           1HB      LEU  78  -0.875   1.826   2.032
  574    HG   LEU  78            HG      LEU  78   1.789   0.426   1.708
  575   1HD1  LEU  78          2HD1      LEU  78  -0.244  -0.080   3.763
  576   2HD1  LEU  78          1HD1      LEU  78  -0.001  -1.487   2.719
  577   3HD1  LEU  78          3HD1      LEU  78   1.366  -0.776   3.590
  578   1HD2  LEU  78          3HD2      LEU  78  -0.938   0.319   0.519
  579   2HD2  LEU  78          2HD2      LEU  78   0.623  -0.035  -0.220
  580   3HD2  LEU  78          1HD2      LEU  78  -0.167  -1.245   0.785
  581    H    GLN  79             H      GLN  79   2.741   4.369   0.253
  582    HA   GLN  79            HA      GLN  79   4.853   3.523   2.099
  583   1HB   GLN  79           2HB      GLN  79   6.481   3.965   0.360
  584   2HB   GLN  79           1HB      GLN  79   5.254   2.913  -0.315
  585   1HG   GLN  79           2HG      GLN  79   4.132   5.033  -1.214
  586   2HG   GLN  79           1HG      GLN  79   5.611   5.848  -0.753
  587   1HE2  GLN  79          2HE2      GLN  79   6.847   3.034  -3.373
  588   2HE2  GLN  79          1HE2      GLN  79   6.378   2.626  -1.806
  589    H    ASP  80             H      ASP  80   3.205   5.131   3.079
  590    HA   ASP  80            HA      ASP  80   2.427   7.517   2.986
  591   1HB   ASP  80           2HB      ASP  80   3.169   6.170   5.134
  592   2HB   ASP  80           1HB      ASP  80   4.468   7.364   5.147
  593    H    GLY  81             H      GLY  81   2.868   9.252   2.133
  594   1HA   GLY  81           2HA      GLY  81   4.108  11.343   1.835
  595   2HA   GLY  81           1HA      GLY  81   5.604  10.411   1.940
  596    H    GLU  82             H      GLU  82   3.125   8.850   0.168
  597    HA   GLU  82            HA      GLU  82   3.778   9.877  -2.426
  598   1HB   GLU  82           2HB      GLU  82   4.521   7.260  -1.368
  599   2HB   GLU  82           1HB      GLU  82   3.968   7.358  -3.001
  600   1HG   GLU  82           2HG      GLU  82   6.242   7.664  -3.309
  601   2HG   GLU  82           1HG      GLU  82   5.671   9.327  -3.191
  602    H    PHE  83             H      PHE  83   2.234   7.194  -0.699
  603    HA   PHE  83            HA      PHE  83   0.253   6.026  -1.517
  604   1HB   PHE  83           2HB      PHE  83  -1.666   7.380  -0.657
  605   2HB   PHE  83           1HB      PHE  83  -0.477   6.794   0.412
  606    HD1  PHE  83           HD1      PHE  83   1.492   8.382   0.975
  607    HD2  PHE  83           HD2      PHE  83  -2.244   9.623  -0.759
  608    HE1  PHE  83           HE1      PHE  83   1.878  10.782   1.715
  609    HE2  PHE  83           HE2      PHE  83  -1.850  11.953  -0.034
  610    HZ   PHE  83            HZ      PHE  83   0.211  12.533   1.204
  611    H    SER  84             H      SER  84   0.903   6.524  -3.863
  612    HA   SER  84            HA      SER  84  -1.596   7.146  -5.273
  613   1HB   SER  84           2HB      SER  84  -0.076   8.397  -7.002
  614   2HB   SER  84           1HB      SER  84  -0.675   9.265  -5.587
  615    HG   SER  84            HG      SER  84   1.840   7.925  -5.688
  616    H    MET  85             H      MET  85  -1.835   5.680  -6.828
  617    HA   MET  85            HA      MET  85   0.457   3.865  -7.600
  618   1HB   MET  85           2HB      MET  85  -1.178   3.350  -5.664
  619   2HB   MET  85           1HB      MET  85  -2.331   3.164  -6.913
  620   1HG   MET  85           2HG      MET  85  -1.112   1.311  -7.841
  621   2HG   MET  85           1HG      MET  85   0.085   1.541  -6.603
  622   1HE   MET  85           3HE      MET  85  -0.209  -0.817  -6.099
  623   2HE   MET  85           2HE      MET  85  -1.552  -1.532  -5.203
  624   3HE   MET  85           1HE      MET  85  -1.734  -1.213  -6.929
  625    H    ASP  86             H      ASP  86   0.474   3.703  -9.948
  626    HA   ASP  86            HA      ASP  86  -1.983   4.766 -11.333
  627   1HB   ASP  86           2HB      ASP  86   0.783   4.091 -12.211
  628   2HB   ASP  86           1HB      ASP  86  -0.494   4.316 -13.379
  629    H    LEU  87             H      LEU  87  -3.296   2.763 -10.688
  630    HA   LEU  87            HA      LEU  87  -2.510   0.447 -12.268
  631   1HB   LEU  87           2HB      LEU  87  -4.627  -0.647 -11.165
  632   2HB   LEU  87           1HB      LEU  87  -3.083  -0.616 -10.376
  633    HG   LEU  87            HG      LEU  87  -4.891  -0.080  -8.831
  634   1HD1  LEU  87          1HD1      LEU  87  -2.548   1.418  -9.152
  635   2HD1  LEU  87          3HD1      LEU  87  -3.815   2.590  -8.788
  636   3HD1  LEU  87          2HD1      LEU  87  -3.522   1.244  -7.696
  637   1HD2  LEU  87          3HD2      LEU  87  -6.136   1.084 -10.860
  638   2HD2  LEU  87          2HD2      LEU  87  -6.476   1.514  -9.200
  639   3HD2  LEU  87          1HD2      LEU  87  -5.412   2.528 -10.165
  640    NH1  ARG  88           NH2      ARG  88   0.308   2.915 -19.203
  641    NH2  ARG  88           NH1      ARG  88   0.516   1.059 -20.472
  642    H    ARG  88             H      ARG  88  -2.936   0.482 -14.261
  643    HA   ARG  88            HA      ARG  88  -5.516   1.751 -15.149
  644   1HB   ARG  88           2HB      ARG  88  -4.453   2.534 -17.081
  645   2HB   ARG  88           1HB      ARG  88  -3.097   2.525 -15.977
  646   1HG   ARG  88           2HG      ARG  88  -2.379   0.309 -16.905
  647   2HG   ARG  88           1HG      ARG  88  -3.763   0.328 -18.018
  648   1HD   ARG  88           2HD      ARG  88  -2.813   1.856 -19.386
  649   2HD   ARG  88           1HD      ARG  88  -2.067   2.763 -18.056
  650    HE   ARG  88            HE      ARG  88  -0.784   0.191 -18.417
  651   1HH1  ARG  88          1HH2      ARG  88  -0.119   3.396 -18.439
  652   2HH1  ARG  88          2HH2      ARG  88   1.005   3.373 -19.759
  653   1HH2  ARG  88          2HH1      ARG  88   0.246   0.119 -20.684
  654   2HH2  ARG  88          1HH1      ARG  88   1.218   1.512 -21.020
  655    H    THR  89             H      THR  89  -7.034   0.671 -16.224
  656    HA   THR  89            HA      THR  89  -7.094  -2.170 -16.568
  657    HB   THR  89            HB      THR  89  -9.152  -1.797 -17.680
  658    HG1  THR  89           HG1      THR  89  -9.141  -0.576 -19.324
  659   1HG2  THR  89          3HG2      THR  89  -8.762  -0.432 -15.384
  660   2HG2  THR  89          2HG2      THR  89  -9.317   0.858 -16.463
  661   3HG2  THR  89          1HG2      THR  89 -10.330  -0.569 -16.185
  662    H    LYS  90             H      LYS  90  -5.126  -2.758 -17.712
  663    HA   LYS  90            HA      LYS  90  -4.369  -1.362 -20.060
  664   1HB   LYS  90           2HB      LYS  90  -3.170  -4.020 -19.543
  665   2HB   LYS  90           1HB      LYS  90  -2.442  -2.504 -20.016
  666   1HG   LYS  90           2HG      LYS  90  -2.801  -1.647 -17.715
  667   2HG   LYS  90           1HG      LYS  90  -3.243  -3.309 -17.239
  668   1HD   LYS  90           2HD      LYS  90  -0.765  -3.061 -18.919
  669   2HD   LYS  90           1HD      LYS  90  -0.630  -2.393 -17.305
  670   1HE   LYS  90           2HE      LYS  90  -0.345  -4.484 -16.500
  671   2HE   LYS  90           1HE      LYS  90  -1.974  -4.889 -17.036
  672   1HZ   LYS  90           3HZ      LYS  90   0.338  -4.916 -18.876
  673   2HZ   LYS  90           2HZ      LYS  90  -0.092  -6.273 -17.951
  674   3HZ   LYS  90           1HZ      LYS  90  -1.181  -5.636 -19.087
  675    H    SER  91             H      SER  91  -3.955  -2.486 -22.039
  676    HA   SER  91            HA      SER  91  -6.104  -4.426 -22.763
  677   1HB   SER  91           2HB      SER  91  -6.712  -2.577 -24.020
  678   2HB   SER  91           1HB      SER  91  -5.111  -1.952 -24.077
  679    HG   SER  91            HG      SER  91  -5.210  -2.690 -26.056
  680    H    THR  92             H      THR  92  -5.330  -5.537 -25.024
  681    HA   THR  92            HA      THR  92  -2.423  -6.276 -24.710
  682    HB   THR  92            HB      THR  92  -2.919  -8.645 -24.799
  683    HG1  THR  92           HG1      THR  92  -5.154  -9.277 -24.839
  684   1HG2  THR  92          2HG2      THR  92  -3.259  -7.248 -22.626
  685   2HG2  THR  92          1HG2      THR  92  -4.973  -7.567 -22.885
  686   3HG2  THR  92          3HG2      THR  92  -3.853  -8.908 -22.664
  687    H    GLY  93             H      GLY  93  -3.555  -4.583 -26.766
  688   1HA   GLY  93           2HA      GLY  93  -2.312  -5.082 -29.078
  689   2HA   GLY  93           1HA      GLY  93  -3.593  -6.288 -29.211
  690    H    GLY  94             H      GLY  94  -5.512  -5.664 -30.036
  691   1HA   GLY  94           2HA      GLY  94  -5.877  -2.821 -30.761
  692   2HA   GLY  94           1HA      GLY  94  -6.860  -4.171 -31.331
  693    H    ALA  95             H      ALA  95  -6.314  -4.262 -27.921
  694    HA   ALA  95            HA      ALA  95  -9.136  -3.668 -27.411
  695   1HB   ALA  95           3HB      ALA  95  -7.107  -5.218 -26.128
  696   2HB   ALA  95           2HB      ALA  95  -7.646  -3.994 -24.976
  697   3HB   ALA  95           1HB      ALA  95  -8.816  -5.096 -25.704
  698    HA   PRO  96            HA      PRO  96  -8.522   0.368 -25.782
  699   1HB   PRO  96           2HB      PRO  96 -10.678   0.500 -24.131
  700   2HB   PRO  96           1HB      PRO  96 -10.849   0.371 -25.893
  701   1HG   PRO  96           2HG      PRO  96 -11.392  -1.711 -23.830
  702   2HG   PRO  96           1HG      PRO  96 -11.977  -1.615 -25.494
  703   1HD   PRO  96           2HD      PRO  96  -9.774  -3.189 -24.477
  704   2HD   PRO  96           1HD      PRO  96 -10.415  -3.105 -26.132
  705    H    THR  97             H      THR  97  -7.651   1.535 -23.987
  706    HA   THR  97            HA      THR  97  -7.266  -0.035 -21.439
  707    HB   THR  97            HB      THR  97  -5.224   1.457 -21.087
  708    HG1  THR  97           HG1      THR  97  -5.041   2.974 -22.523
  709   1HG2  THR  97          3HG2      THR  97  -5.492  -0.956 -22.384
  710   2HG2  THR  97          2HG2      THR  97  -4.535  -0.015 -23.525
  711   3HG2  THR  97          1HG2      THR  97  -3.967  -0.232 -21.865
  712    H    PHE  98             H      PHE  98  -7.286   1.273 -19.541
  713    HA   PHE  98            HA      PHE  98  -8.308   4.007 -19.662
  714   1HB   PHE  98           2HB      PHE  98  -9.690   1.774 -18.131
  715   2HB   PHE  98           1HB      PHE  98 -10.172   3.477 -18.161
  716    HD1  PHE  98           HD1      PHE  98 -10.314   4.459 -20.700
  717    HD2  PHE  98           HD2      PHE  98 -10.904   0.362 -19.555
  718    HE1  PHE  98           HE1      PHE  98 -11.598   4.072 -22.785
  719    HE2  PHE  98           HE2      PHE  98 -12.194  -0.032 -21.642
  720    HZ   PHE  98            HZ      PHE  98 -12.541   1.824 -23.255
  721    H    ASN  99             H      ASN  99  -7.431   5.211 -17.872
  722    HA   ASN  99            HA      ASN  99  -5.708   3.503 -16.098
  723   1HB   ASN  99           2HB      ASN  99  -4.971   6.383 -16.534
  724   2HB   ASN  99           1HB      ASN  99  -3.929   4.992 -16.203
  725   1HD2  ASN  99          2HD2      ASN  99  -3.641   6.014 -19.851
  726   2HD2  ASN  99          1HD2      ASN  99  -3.517   6.899 -18.406
  727    H    VAL 100             H      VAL 100  -5.598   3.797 -13.997
  728    HA   VAL 100            HA      VAL 100  -7.407   5.747 -12.674
  729    HB   VAL 100            HB      VAL 100  -6.801   2.941 -11.646
  730   1HG1  VAL 100          2HG1      VAL 100  -7.740   5.036 -10.307
  731   2HG1  VAL 100          1HG1      VAL 100  -9.263   4.469 -10.983
  732   3HG1  VAL 100          3HG1      VAL 100  -8.283   3.395  -9.991
  733   1HG2  VAL 100          1HG2      VAL 100  -8.085   3.088 -13.943
  734   2HG2  VAL 100          3HG2      VAL 100  -8.778   2.108 -12.652
  735   3HG2  VAL 100          2HG2      VAL 100  -9.411   3.720 -12.973
  736    H    THR 101             H      THR 101  -6.558   6.649 -10.809
  737    HA   THR 101            HA      THR 101  -3.860   5.782  -9.968
  738    HB   THR 101            HB      THR 101  -5.166   8.546  -9.765
  739    HG1  THR 101           HG1      THR 101  -2.790   7.763 -11.086
  740   1HG2  THR 101          1HG2      THR 101  -3.650   7.671  -7.819
  741   2HG2  THR 101          3HG2      THR 101  -2.336   7.905  -8.966
  742   3HG2  THR 101          2HG2      THR 101  -3.345   9.256  -8.483
  743    H    VAL 102             H      VAL 102  -3.960   4.945  -7.977
  744    HA   VAL 102            HA      VAL 102  -6.400   5.383  -6.381
  745    HB   VAL 102            HB      VAL 102  -4.763   2.940  -7.032
  746   1HG1  VAL 102          2HG1      VAL 102  -6.290   3.493  -4.475
  747   2HG1  VAL 102          1HG1      VAL 102  -6.401   1.885  -5.186
  748   3HG1  VAL 102          3HG1      VAL 102  -4.830   2.527  -4.706
  749   1HG2  VAL 102          3HG2      VAL 102  -7.645   3.767  -7.053
  750   2HG2  VAL 102          2HG2      VAL 102  -6.625   3.325  -8.399
  751   3HG2  VAL 102          1HG2      VAL 102  -7.147   2.094  -7.259
  752    H    THR 103             H      THR 103  -6.021   6.535  -4.689
  753    HA   THR 103            HA      THR 103  -3.294   6.716  -3.568
  754    HB   THR 103            HB      THR 103  -4.452   8.609  -2.235
  755    HG1  THR 103           HG1      THR 103  -6.309   9.356  -3.094
  756   1HG2  THR 103          3HG2      THR 103  -3.303   8.458  -4.892
  757   2HG2  THR 103          2HG2      THR 103  -4.439   9.795  -4.773
  758   3HG2  THR 103          1HG2      THR 103  -3.080   9.690  -3.648
  759    H    LYS 104             H      LYS 104  -3.111   6.724  -1.254
  760    HA   LYS 104            HA      LYS 104  -5.183   5.232   0.269
  761   1HB   LYS 104           2HB      LYS 104  -3.598   3.551  -0.475
  762   2HB   LYS 104           1HB      LYS 104  -2.236   4.525   0.063
  763   1HG   LYS 104           2HG      LYS 104  -2.510   2.899   1.773
  764   2HG   LYS 104           1HG      LYS 104  -3.281   4.330   2.436
  765   1HD   LYS 104           2HD      LYS 104  -4.946   2.799   2.835
  766   2HD   LYS 104           1HD      LYS 104  -5.400   3.295   1.208
  767   1HE   LYS 104           2HE      LYS 104  -5.396   0.887   1.219
  768   2HE   LYS 104           1HE      LYS 104  -3.956   1.395   0.335
  769   1HZ   LYS 104           2HZ      LYS 104  -3.774   0.969   3.237
  770   2HZ   LYS 104           1HZ      LYS 104  -3.791  -0.383   2.211
  771   3HZ   LYS 104           3HZ      LYS 104  -2.581   0.790   2.043
  772    H    THR 105             H      THR 105  -5.398   5.838   2.360
  773    HA   THR 105            HA      THR 105  -3.536   7.915   3.457
  774    HB   THR 105            HB      THR 105  -5.453   8.763   4.732
  775    HG1  THR 105           HG1      THR 105  -7.232   7.670   4.916
  776   1HG2  THR 105          1HG2      THR 105  -5.403   8.673   1.830
  777   2HG2  THR 105          3HG2      THR 105  -7.058   8.831   2.434
  778   3HG2  THR 105          2HG2      THR 105  -5.826  10.013   2.897
  779    H    ASP 106             H      ASP 106  -5.061   7.440   6.137
  780    HA   ASP 106            HA      ASP 106  -3.472   5.086   6.955
  781   1HB   ASP 106           2HB      ASP 106  -3.362   7.289   8.196
  782   2HB   ASP 106           1HB      ASP 106  -5.006   6.967   8.744
  783    H    LYS 107             H      LYS 107  -6.778   5.983   6.274
  784    HA   LYS 107            HA      LYS 107  -7.672   3.277   7.046
  785   1HB   LYS 107           2HB      LYS 107  -9.458   5.440   8.097
  786   2HB   LYS 107           1HB      LYS 107  -9.194   3.812   8.712
  787   1HG   LYS 107           2HG      LYS 107  -6.933   4.535   9.532
  788   2HG   LYS 107           1HG      LYS 107  -7.295   6.164   9.007
  789   1HD   LYS 107           2HD      LYS 107  -8.454   4.617  11.311
  790   2HD   LYS 107           1HD      LYS 107  -7.857   6.271  11.279
  791   1HE   LYS 107           2HE      LYS 107  -9.878   6.806   9.771
  792   2HE   LYS 107           1HE      LYS 107 -10.508   5.229  10.250
  793   1HZ   LYS 107           2HZ      LYS 107 -10.054   6.033  12.613
  794   2HZ   LYS 107           1HZ      LYS 107  -9.968   7.588  11.936
  795   3HZ   LYS 107           3HZ      LYS 107 -11.397   6.687  11.799
  796    H    THR 108             H      THR 108  -7.519   5.156   4.558
  797    HA   THR 108            HA      THR 108 -10.250   4.501   3.596
  798    HB   THR 108            HB      THR 108 -10.591   6.655   2.600
  799    HG1  THR 108           HG1      THR 108  -8.595   7.215   1.906
  800   1HG2  THR 108          2HG2      THR 108 -10.755   6.302   5.212
  801   2HG2  THR 108          1HG2      THR 108  -9.408   7.450   5.242
  802   3HG2  THR 108          3HG2      THR 108 -10.949   7.922   4.521
  803    H    LEU 109             H      LEU 109 -10.285   4.191   1.314
  804    HA   LEU 109            HA      LEU 109  -7.658   3.717   0.006
  805   1HB   LEU 109           2HB      LEU 109  -9.381   1.797   0.854
  806   2HB   LEU 109           1HB      LEU 109 -10.075   2.087  -0.718
  807    HG   LEU 109            HG      LEU 109  -8.124   0.273  -0.166
  808   1HD1  LEU 109          2HD1      LEU 109  -9.359   1.403  -2.499
  809   2HD1  LEU 109          1HD1      LEU 109  -7.750   0.767  -2.845
  810   3HD1  LEU 109          3HD1      LEU 109  -8.972  -0.274  -2.113
  811   1HD2  LEU 109          1HD2      LEU 109  -6.486   2.140   0.119
  812   2HD2  LEU 109          3HD2      LEU 109  -6.027   0.908  -1.042
  813   3HD2  LEU 109          2HD2      LEU 109  -6.658   2.459  -1.598
  814    H    VAL 110             H      VAL 110  -7.905   5.915  -1.062
  815    HA   VAL 110            HA      VAL 110 -10.362   6.414  -2.517
  816    HB   VAL 110            HB      VAL 110  -7.770   7.923  -2.063
  817   1HG1  VAL 110          3HG1      VAL 110  -9.824   8.472  -4.202
  818   2HG1  VAL 110          2HG1      VAL 110  -8.836   9.762  -3.525
  819   3HG1  VAL 110          1HG1      VAL 110  -8.076   8.418  -4.369
  820   1HG2  VAL 110          2HG2      VAL 110 -10.316   7.919  -0.858
  821   2HG2  VAL 110          1HG2      VAL 110  -9.049   9.131  -0.616
  822   3HG2  VAL 110          3HG2      VAL 110 -10.305   9.392  -1.843
  823    H    LEU 111             H      LEU 111 -10.620   6.359  -4.687
  824    HA   LEU 111            HA      LEU 111  -8.392   5.371  -6.332
  825   1HB   LEU 111           2HB      LEU 111 -11.245   4.529  -6.893
  826   2HB   LEU 111           1HB      LEU 111  -9.765   3.833  -7.534
  827    HG   LEU 111            HG      LEU 111 -10.796   3.571  -4.715
  828   1HD1  LEU 111          1HD1      LEU 111 -10.648   1.754  -7.102
  829   2HD1  LEU 111          3HD1      LEU 111 -10.612   1.066  -5.471
  830   3HD1  LEU 111          2HD1      LEU 111 -12.000   2.025  -5.994
  831   1HD2  LEU 111          1HD2      LEU 111  -8.213   3.661  -5.198
  832   2HD2  LEU 111          3HD2      LEU 111  -8.885   2.541  -4.042
  833   3HD2  LEU 111          2HD2      LEU 111  -8.490   1.992  -5.668
  834    H    LEU 112             H      LEU 112  -8.522   6.162  -8.451
  835    HA   LEU 112            HA      LEU 112 -10.479   8.308  -8.984
  836   1HB   LEU 112           2HB      LEU 112  -8.157   9.101  -8.179
  837   2HB   LEU 112           1HB      LEU 112  -7.552   8.448  -9.666
  838    HG   LEU 112            HG      LEU 112  -7.863  10.543 -10.489
  839   1HD1  LEU 112          2HD1      LEU 112 -10.757   9.635 -10.429
  840   2HD1  LEU 112          1HD1      LEU 112 -10.227  11.132 -11.214
  841   3HD1  LEU 112          3HD1      LEU 112  -9.616   9.579 -11.791
  842   1HD2  LEU 112          2HD2      LEU 112  -9.694  10.937  -8.139
  843   2HD2  LEU 112          1HD2      LEU 112  -8.063  11.575  -8.372
  844   3HD2  LEU 112          3HD2      LEU 112  -9.410  12.199  -9.338
  845    H    MET 113             H      MET 113 -11.538   7.179 -10.581
  846    HA   MET 113            HA      MET 113  -9.840   5.600 -12.469
  847   1HB   MET 113           2HB      MET 113 -12.095   4.752 -11.607
  848   2HB   MET 113           1HB      MET 113 -12.806   5.870 -12.721
  849   1HG   MET 113           2HG      MET 113 -10.900   4.622 -14.291
  850   2HG   MET 113           1HG      MET 113 -11.492   3.322 -13.303
  851   1HE   MET 113           2HE      MET 113 -11.815   2.296 -15.257
  852   2HE   MET 113           1HE      MET 113 -13.508   1.836 -15.093
  853   3HE   MET 113           3HE      MET 113 -12.948   2.658 -16.557
  854    H    GLY 114             H      GLY 114  -9.657   5.958 -14.585
  855   1HA   GLY 114           2HA      GLY 114 -10.751   8.413 -15.703
  856   2HA   GLY 114           1HA      GLY 114  -9.016   8.175 -15.732
  857    H    LYS 115             H      LYS 115 -10.852   8.410 -17.911
  858    HA   LYS 115            HA      LYS 115 -10.246   5.986 -19.429
  859   1HB   LYS 115           2HB      LYS 115 -12.869   7.444 -19.271
  860   2HB   LYS 115           1HB      LYS 115 -12.374   6.645 -20.766
  861   1HG   LYS 115           2HG      LYS 115 -11.803   4.661 -19.066
  862   2HG   LYS 115           1HG      LYS 115 -13.070   5.428 -18.141
  863   1HD   LYS 115           2HD      LYS 115 -14.607   5.264 -20.065
  864   2HD   LYS 115           1HD      LYS 115 -13.329   4.519 -21.024
  865   1HE   LYS 115           2HE      LYS 115 -13.488   2.506 -19.932
  866   2HE   LYS 115           1HE      LYS 115 -13.909   3.261 -18.393
  867   1HZ   LYS 115           2HZ      LYS 115 -15.749   3.169 -20.720
  868   2HZ   LYS 115           1HZ      LYS 115 -15.739   1.993 -19.491
  869   3HZ   LYS 115           3HZ      LYS 115 -16.120   3.602 -19.118
  870    H    GLU 116             H      GLU 116 -10.202   6.553 -21.756
  871    HA   GLU 116            HA      GLU 116  -8.289   7.901 -22.819
  872   1HB   GLU 116           2HB      GLU 116 -10.120   7.021 -23.787
  873   2HB   GLU 116           1HB      GLU 116 -10.958   8.497 -23.634
  874   1HG   GLU 116           2HG      GLU 116  -9.668   9.551 -25.267
  875   2HG   GLU 116           1HG      GLU 116  -8.296   8.483 -24.977
  876    H    GLY 117             H      GLY 117  -7.507   9.744 -23.620
  877   1HA   GLY 117           2HA      GLY 117  -6.928  12.043 -23.586
  878   2HA   GLY 117           1HA      GLY 117  -8.501  12.396 -22.811
  879    H    VAL 118             H      VAL 118  -7.020   9.529 -21.697
  880    HA   VAL 118            HA      VAL 118  -6.508  10.655 -19.077
  881    HB   VAL 118            HB      VAL 118  -8.211   8.877 -19.904
  882   1HG1  VAL 118          1HG1      VAL 118  -6.585   7.410 -20.969
  883   2HG1  VAL 118          3HG1      VAL 118  -5.964   7.004 -19.365
  884   3HG1  VAL 118          2HG1      VAL 118  -7.656   6.644 -19.771
  885   1HG2  VAL 118          1HG2      VAL 118  -6.554   8.880 -17.405
  886   2HG2  VAL 118          3HG2      VAL 118  -8.277   9.194 -17.607
  887   3HG2  VAL 118          2HG2      VAL 118  -7.677   7.524 -17.622
  888    H    HIS 119             H      HIS 119  -4.371  11.413 -19.230
  889    HA   HIS 119            HA      HIS 119  -2.215   9.801 -20.320
  890   1HB   HIS 119           2HB      HIS 119  -2.365  12.373 -19.973
  891   2HB   HIS 119           1HB      HIS 119  -1.786  12.015 -18.352
  892    HD1  HIS 119           HD1      HIS 119  -0.216  13.437 -20.853
  893    HD2  HIS 119           HD2      HIS 119   0.358   9.590 -19.357
  894    HE1  HIS 119           HE1      HIS 119   2.139  12.755 -21.497
  895    H    GLY 120             H      GLY 120  -3.627  10.405 -17.164
  896   1HA   GLY 120           2HA      GLY 120  -3.657   8.727 -15.417
  897   2HA   GLY 120           1HA      GLY 120  -2.144   8.076 -16.061
  898    H    GLY 121             H      GLY 121  -1.201  11.031 -16.347
  899   1HA   GLY 121           2HA      GLY 121   0.005  11.216 -13.656
  900   2HA   GLY 121           1HA      GLY 121   0.430  12.213 -15.052
  901    H    LEU 122             H      LEU 122  -2.461  12.785 -15.589
  902    HA   LEU 122            HA      LEU 122  -2.775  15.167 -13.891
  903   1HB   LEU 122           2HB      LEU 122  -4.981  14.014 -15.609
  904   2HB   LEU 122           1HB      LEU 122  -4.646  15.702 -15.233
  905    HG   LEU 122            HG      LEU 122  -2.420  14.428 -16.651
  906   1HD1  LEU 122          3HD1      LEU 122  -4.446  13.185 -17.567
  907   2HD1  LEU 122          2HD1      LEU 122  -4.988  14.745 -18.199
  908   3HD1  LEU 122          1HD1      LEU 122  -3.465  14.052 -18.755
  909   1HD2  LEU 122          1HD2      LEU 122  -4.177  16.830 -17.146
  910   2HD2  LEU 122          3HD2      LEU 122  -2.606  16.824 -16.336
  911   3HD2  LEU 122          2HD2      LEU 122  -2.722  16.455 -18.064
  912    H    ILE 123             H      ILE 123  -4.261  12.013 -14.320
  913    HA   ILE 123            HA      ILE 123  -6.214  12.311 -12.211
  914    HB   ILE 123            HB      ILE 123  -4.946  10.016 -13.653
  915   1HG1  ILE 123          2HG1      ILE 123  -7.814  11.006 -13.709
  916   2HG1  ILE 123          1HG1      ILE 123  -6.578  11.595 -14.830
  917   1HG2  ILE 123          3HG2      ILE 123  -6.221   9.784 -11.132
  918   2HG2  ILE 123          2HG2      ILE 123  -7.411   9.252 -12.310
  919   3HG2  ILE 123          1HG2      ILE 123  -5.832   8.477 -12.238
  920   1HD1  ILE 123          2HD1      ILE 123  -6.150   9.299 -15.538
  921   2HD1  ILE 123          1HD1      ILE 123  -7.406   8.723 -14.446
  922   3HD1  ILE 123          3HD1      ILE 123  -7.826   9.765 -15.791
  923    H    ASN 124             H      ASN 124  -2.842  11.248 -12.500
  924    HA   ASN 124            HA      ASN 124  -2.530  10.230  -9.841
  925   1HB   ASN 124           2HB      ASN 124  -0.878   9.884 -11.707
  926   2HB   ASN 124           1HB      ASN 124  -0.416  11.577 -11.519
  927   1HD2  ASN 124          2HD2      ASN 124   1.800  10.803  -8.907
  928   2HD2  ASN 124          1HD2      ASN 124   1.398  11.807 -10.216
  929    H    LYS 125             H      LYS 125  -2.675  13.385 -11.282
  930    HA   LYS 125            HA      LYS 125  -1.620  14.836  -8.877
  931   1HB   LYS 125           2HB      LYS 125  -2.911  15.752 -11.520
  932   2HB   LYS 125           1HB      LYS 125  -2.309  16.855 -10.267
  933   1HG   LYS 125           2HG      LYS 125  -0.430  14.738 -11.179
  934   2HG   LYS 125           1HG      LYS 125  -0.803  16.012 -12.352
  935   1HD   LYS 125           2HD      LYS 125   0.117  16.514  -9.497
  936   2HD   LYS 125           1HD      LYS 125   1.176  16.557 -10.910
  937   1HE   LYS 125           2HE      LYS 125  -1.237  18.184 -11.270
  938   2HE   LYS 125           1HE      LYS 125  -0.263  18.711  -9.899
  939   1HZ   LYS 125           2HZ      LYS 125   1.689  18.604 -11.432
  940   2HZ   LYS 125           1HZ      LYS 125   0.595  18.392 -12.716
  941   3HZ   LYS 125           3HZ      LYS 125   0.556  19.816 -11.796
  942    H    LYS 126             H      LYS 126  -4.720  13.961 -10.328
  943    HA   LYS 126            HA      LYS 126  -6.286  15.648  -8.525
  944   1HB   LYS 126           2HB      LYS 126  -7.067  13.742 -10.728
  945   2HB   LYS 126           1HB      LYS 126  -8.213  14.705  -9.787
  946   1HG   LYS 126           2HG      LYS 126  -7.213  16.769 -10.516
  947   2HG   LYS 126           1HG      LYS 126  -5.857  15.919 -11.246
  948   1HD   LYS 126           2HD      LYS 126  -8.335  14.913 -12.335
  949   2HD   LYS 126           1HD      LYS 126  -8.291  16.668 -12.482
  950   1HE   LYS 126           2HE      LYS 126  -5.711  15.844 -13.213
  951   2HE   LYS 126           1HE      LYS 126  -6.778  14.664 -13.963
  952   1HZ   LYS 126           3HZ      LYS 126  -8.083  16.873 -14.557
  953   2HZ   LYS 126           2HZ      LYS 126  -6.519  17.529 -14.449
  954   3HZ   LYS 126           1HZ      LYS 126  -6.842  16.266 -15.538
  955    H    CYS 127             H      CYS 127  -4.940  12.529  -8.443
  956    HA   CYS 127            HA      CYS 127  -6.951  11.435  -6.559
  957   1HB   CYS 127           2HB      CYS 127  -5.543  10.045  -8.356
  958   2HB   CYS 127           1HB      CYS 127  -4.326  10.102  -7.106
  959    HG   CYS 127            HG      CYS 127  -5.577   8.346  -5.906
  960    OH   TYR 128            OH      TYR 128   2.501  15.025  -2.208
  961    H    TYR 128             H      TYR 128  -3.703  12.717  -6.900
  962    HA   TYR 128            HA      TYR 128  -2.800  12.334  -4.214
  963   1HB   TYR 128           2HB      TYR 128  -1.462  12.917  -6.330
  964   2HB   TYR 128           1HB      TYR 128  -2.089  14.549  -6.188
  965    HD1  TYR 128           HD1      TYR 128  -1.147  12.500  -3.213
  966    HD2  TYR 128           HD2      TYR 128   0.002  15.570  -5.999
  967    HE1  TYR 128           HE1      TYR 128   0.745  13.102  -1.743
  968    HE2  TYR 128           HE2      TYR 128   1.904  16.186  -4.503
  969    HH   TYR 128            HH      TYR 128   3.292  15.082  -2.752
  970    H    GLU 129             H      GLU 129  -4.854  14.710  -5.884
  971    HA   GLU 129            HA      GLU 129  -5.011  16.524  -3.553
  972   1HB   GLU 129           2HB      GLU 129  -6.433  16.483  -6.229
  973   2HB   GLU 129           1HB      GLU 129  -6.700  17.716  -4.996
  974   1HG   GLU 129           2HG      GLU 129  -3.857  17.202  -5.668
  975   2HG   GLU 129           1HG      GLU 129  -4.817  17.927  -6.959
  976    H    MET 130             H      MET 130  -6.930  13.980  -5.105
  977    HA   MET 130            HA      MET 130  -9.421  14.272  -3.686
  978   1HB   MET 130           2HB      MET 130  -8.542  12.610  -5.669
  979   2HB   MET 130           1HB      MET 130  -8.346  11.518  -4.318
  980   1HG   MET 130           2HG      MET 130 -10.793  11.928  -3.747
  981   2HG   MET 130           1HG      MET 130 -10.934  12.846  -5.263
  982   1HE   MET 130           1HE      MET 130 -12.498  10.397  -4.175
  983   2HE   MET 130           3HE      MET 130 -12.989  10.932  -5.789
  984   3HE   MET 130           2HE      MET 130 -12.646   9.231  -5.484
  985    H    ALA 131             H      ALA 131  -6.463  12.468  -3.004
  986    HA   ALA 131            HA      ALA 131  -7.211  11.595  -0.335
  987   1HB   ALA 131           2HB      ALA 131  -4.798  11.291  -2.118
  988   2HB   ALA 131           1HB      ALA 131  -4.637  11.007  -0.375
  989   3HB   ALA 131           3HB      ALA 131  -5.774  10.045  -1.320
  990    H    SER 132             H      SER 132  -5.690  14.398  -1.774
  991    HA   SER 132            HA      SER 132  -4.105  15.210   0.466
  992   1HB   SER 132           2HB      SER 132  -4.054  17.403  -0.482
  993   2HB   SER 132           1HB      SER 132  -4.088  16.311  -1.851
  994    HG   SER 132            HG      SER 132  -5.968  18.129  -0.948
  995    H    HIS 133             H      HIS 133  -7.584  15.261  -0.244
  996    HA   HIS 133            HA      HIS 133  -8.154  16.912   2.116
  997   1HB   HIS 133           2HB      HIS 133  -9.710  16.690   0.049
  998   2HB   HIS 133           1HB      HIS 133 -10.284  15.191   0.837
  999    HD1  HIS 133           HD1      HIS 133  -9.961  18.939   1.443
 1000    HD2  HIS 133           HD2      HIS 133 -11.809  15.610   3.151
 1001    HE1  HIS 133           HE1      HIS 133 -11.493  19.824   3.262
 1002    H    LEU 134             H      LEU 134  -8.203  13.438   1.139
 1003    HA   LEU 134            HA      LEU 134  -9.174  12.582   3.768
 1004   1HB   LEU 134           2HB      LEU 134  -7.767  11.149   1.519
 1005   2HB   LEU 134           1HB      LEU 134  -8.226  10.342   3.019
 1006    HG   LEU 134            HG      LEU 134 -10.513  11.668   2.422
 1007   1HD1  LEU 134          1HD1      LEU 134  -9.068  11.161  -0.113
 1008   2HD1  LEU 134          3HD1      LEU 134 -10.811  10.944  -0.076
 1009   3HD1  LEU 134          2HD1      LEU 134 -10.108  12.505   0.330
 1010   1HD2  LEU 134          3HD2      LEU 134  -9.608   8.920   1.604
 1011   2HD2  LEU 134          2HD2      LEU 134 -10.516   9.362   3.048
 1012   3HD2  LEU 134          1HD2      LEU 134 -11.283   9.445   1.462
 1013    NH1  ARG 135           NH2      ARG 135  -0.505  11.122   6.384
 1014    NH2  ARG 135           NH1      ARG 135  -1.448   9.235   5.570
 1015    H    ARG 135             H      ARG 135  -6.263  13.926   2.887
 1016    HA   ARG 135            HA      ARG 135  -4.684  12.610   5.012
 1017   1HB   ARG 135           2HB      ARG 135  -4.056  14.451   2.722
 1018   2HB   ARG 135           1HB      ARG 135  -3.006  14.487   4.138
 1019   1HG   ARG 135           2HG      ARG 135  -3.717  11.800   3.079
 1020   2HG   ARG 135           1HG      ARG 135  -2.620  12.771   2.097
 1021   1HD   ARG 135           2HD      ARG 135  -1.025  11.884   3.464
 1022   2HD   ARG 135           1HD      ARG 135  -1.539  13.163   4.562
 1023    HE   ARG 135            HE      ARG 135  -3.256  11.114   5.182
 1024   1HH1  ARG 135          1HH2      ARG 135  -0.480  12.120   6.447
 1025   2HH1  ARG 135          2HH2      ARG 135   0.168  10.574   6.878
 1026   1HH2  ARG 135          2HH1      ARG 135  -2.145   8.787   5.009
 1027   2HH2  ARG 135          1HH1      ARG 135  -0.772   8.684   6.060
 1028    NH1  ARG 136           NH1      ARG 136  -6.080  21.559   7.772
 1029    NH2  ARG 136           NH2      ARG 136  -3.833  21.768   7.615
 1030    H    ARG 136             H      ARG 136  -6.204  15.628   4.011
 1031    HA   ARG 136            HA      ARG 136  -5.572  17.049   6.467
 1032   1HB   ARG 136           2HB      ARG 136  -7.202  17.616   4.009
 1033   2HB   ARG 136           1HB      ARG 136  -7.407  18.623   5.445
 1034   1HG   ARG 136           2HG      ARG 136  -4.580  18.240   4.876
 1035   2HG   ARG 136           1HG      ARG 136  -5.411  18.871   3.454
 1036   1HD   ARG 136           2HD      ARG 136  -4.955  20.853   4.552
 1037   2HD   ARG 136           1HD      ARG 136  -6.530  20.479   5.250
 1038    HE   ARG 136            HE      ARG 136  -4.454  19.274   6.831
 1039   1HH1  ARG 136          2HH1      ARG 136  -6.924  21.076   7.533
 1040   2HH1  ARG 136          1HH1      ARG 136  -6.115  22.361   8.367
 1041   1HH2  ARG 136          1HH2      ARG 136  -2.957  21.447   7.259
 1042   2HH2  ARG 136          2HH2      ARG 136  -3.866  22.573   8.210
 1043    H    SER 137             H      SER 137  -7.663  14.581   5.624
 1044    HA   SER 137            HA      SER 137  -9.988  15.337   7.187
 1045   1HB   SER 137           2HB      SER 137 -10.845  13.209   6.457
 1046   2HB   SER 137           1HB      SER 137  -9.921  13.796   5.101
 1047    HG   SER 137            HG      SER 137  -9.482  11.595   5.661
 1048    H    GLN 138             H      GLN 138  -6.904  13.732   7.667
 1049    HA   GLN 138            HA      GLN 138  -5.822  13.044   9.621
 1050   1HB   GLN 138           2HB      GLN 138  -7.795  14.814  10.600
 1051   2HB   GLN 138           1HB      GLN 138  -7.963  13.356  11.577
 1052   1HG   GLN 138           2HG      GLN 138  -5.862  13.573  12.512
 1053   2HG   GLN 138           1HG      GLN 138  -5.182  14.326  11.070
 1054   1HE2  GLN 138          2HE2      GLN 138  -6.951  16.663  13.934
 1055   2HE2  GLN 138          1HE2      GLN 138  -7.159  14.980  13.969
 1056    OH   TYR 139            OH      TYR 139 -14.411  11.213   8.545
 1057    H    TYR 139             H      TYR 139  -7.733  11.398   7.926
 1058    HA   TYR 139            HA      TYR 139  -8.816   9.398   9.792
 1059   1HB   TYR 139           2HB      TYR 139  -8.725   9.664   6.772
 1060   2HB   TYR 139           1HB      TYR 139  -9.186   8.137   7.533
 1061    HD1  TYR 139           HD2      TYR 139  -9.888  11.769   8.202
 1062    HD2  TYR 139           HD1      TYR 139 -11.487   7.824   7.642
 1063    HE1  TYR 139           HE2      TYR 139 -12.171  12.650   8.580
 1064    HE2  TYR 139           HE1      TYR 139 -13.776   8.700   8.023
 1065    HH   TYR 139            HH      TYR 139 -14.402  12.168   8.431
   
  Start of MODEL           5
 Raw file had 1065 H/Q atoms
  Start of MODEL    5
    1   1H    ALA   1            2H      ALA   1 -22.026  18.324   1.185
    2   2H    ALA   1            1H      ALA   1 -21.852  19.348   2.529
    3   3H    ALA   1            3H      ALA   1 -22.103  20.010   0.987
    4    HA   ALA   1            HA      ALA   1 -19.971  19.240   0.233
    5   1HB   ALA   1           2HB      ALA   1 -20.291  20.963   2.620
    6   2HB   ALA   1           1HB      ALA   1 -18.651  20.378   2.336
    7   3HB   ALA   1           3HB      ALA   1 -19.486  21.301   1.089
    8    H    GLY   2             H      GLY   2 -18.108  17.938   0.571
    9   1HA   GLY   2           2HA      GLY   2 -16.867  16.724   2.543
   10   2HA   GLY   2           1HA      GLY   2 -18.412  15.901   2.728
   11    CH2  TRP   3           CH2      TRP   3 -13.104  11.204   3.706
   12    H    TRP   3             H      TRP   3 -17.971  13.862   2.095
   13    HA   TRP   3            HA      TRP   3 -16.176  12.829   0.297
   14   1HB   TRP   3           2HB      TRP   3 -18.730  11.971   1.274
   15   2HB   TRP   3           1HB      TRP   3 -18.073  11.099  -0.066
   16    HD1  TRP   3           HD1      TRP   3 -18.170   9.245   2.009
   17    HE1  TRP   3           HE1      TRP   3 -16.274   8.437   3.541
   18    HE3  TRP   3           HE3      TRP   3 -14.847  13.203   1.592
   19    HZ2  TRP   3           HZ2      TRP   3 -13.741   9.297   4.449
   20    HZ3  TRP   3           HZ3      TRP   3 -12.728  13.112   2.813
   21    HH2  TRP   3           HH2      TRP   3 -12.163  11.183   4.238
   22    H    ASN   4             H      ASN   4 -19.515  13.793  -0.550
   23    HA   ASN   4            HA      ASN   4 -19.404  13.053  -3.306
   24   1HB   ASN   4           2HB      ASN   4 -21.283  14.794  -3.579
   25   2HB   ASN   4           1HB      ASN   4 -21.572  13.497  -2.416
   26   1HD2  ASN   4          2HD2      ASN   4 -21.649  15.663   0.386
   27   2HD2  ASN   4          1HD2      ASN   4 -21.667  14.056  -0.160
   28    H    ALA   5             H      ALA   5 -18.051  15.796  -1.748
   29    HA   ALA   5            HA      ALA   5 -17.735  17.482  -4.140
   30   1HB   ALA   5           1HB      ALA   5 -17.760  18.318  -1.701
   31   2HB   ALA   5           3HB      ALA   5 -16.127  17.670  -1.564
   32   3HB   ALA   5           2HB      ALA   5 -16.469  18.952  -2.724
   33    OH   TYR   6            OH      TYR   6 -13.755  17.683   1.734
   34    H    TYR   6             H      TYR   6 -15.772  15.132  -2.254
   35    HA   TYR   6            HA      TYR   6 -13.442  15.452  -4.039
   36   1HB   TYR   6           2HB      TYR   6 -13.913  13.077  -2.229
   37   2HB   TYR   6           1HB      TYR   6 -12.369  13.758  -2.767
   38    HD1  TYR   6           HD1      TYR   6 -12.044  16.323  -2.252
   39    HD2  TYR   6           HD2      TYR   6 -14.742  13.743  -0.279
   40    HE1  TYR   6           HE1      TYR   6 -12.243  17.976  -0.413
   41    HE2  TYR   6           HE2      TYR   6 -14.951  15.337   1.608
   42    HH   TYR   6            HH      TYR   6 -14.075  18.503   1.348
   43    H    ILE   7             H      ILE   7 -16.464  14.055  -4.323
   44    HA   ILE   7            HA      ILE   7 -15.703  12.116  -6.421
   45    HB   ILE   7            HB      ILE   7 -18.248  12.792  -5.000
   46   1HG1  ILE   7          2HG1      ILE   7 -16.504  11.066  -4.292
   47   2HG1  ILE   7          1HG1      ILE   7 -18.161  10.493  -4.386
   48   1HG2  ILE   7          1HG2      ILE   7 -17.955  11.727  -7.757
   49   2HG2  ILE   7          3HG2      ILE   7 -19.152  10.951  -6.716
   50   3HG2  ILE   7          2HG2      ILE   7 -19.271  12.676  -7.062
   51   1HD1  ILE   7          2HD1      ILE   7 -16.676  10.264  -6.903
   52   2HD1  ILE   7          1HD1      ILE   7 -15.992   9.310  -5.595
   53   3HD1  ILE   7          3HD1      ILE   7 -17.667   9.068  -6.073
   54    H    ASP   8             H      ASP   8 -16.957  15.341  -5.826
   55    HA   ASP   8            HA      ASP   8 -17.753  16.065  -8.424
   56   1HB   ASP   8           2HB      ASP   8 -17.168  17.458  -5.933
   57   2HB   ASP   8           1HB      ASP   8 -17.123  18.425  -7.350
   58    H    ASN   9             H      ASN   9 -14.733  15.513  -6.969
   59    HA   ASN   9            HA      ASN   9 -12.871  16.980  -8.348
   60   1HB   ASN   9           2HB      ASN   9 -11.731  15.632  -6.920
   61   2HB   ASN   9           1HB      ASN   9 -13.052  14.687  -6.675
   62   1HD2  ASN   9          2HD2      ASN   9 -11.505  11.660  -8.173
   63   2HD2  ASN   9          1HD2      ASN   9 -12.558  12.330  -6.991
   64    H    LEU  10             H      LEU  10 -14.390  14.144  -9.130
   65    HA   LEU  10            HA      LEU  10 -13.220  13.439 -11.569
   66   1HB   LEU  10           2HB      LEU  10 -15.843  12.817 -10.337
   67   2HB   LEU  10           1HB      LEU  10 -15.260  12.035 -11.772
   68    HG   LEU  10            HG      LEU  10 -14.575  10.566 -10.295
   69   1HD1  LEU  10          3HD1      LEU  10 -12.290  12.511 -10.044
   70   2HD1  LEU  10          2HD1      LEU  10 -12.197  10.825  -9.621
   71   3HD1  LEU  10          1HD1      LEU  10 -12.478  11.287 -11.278
   72   1HD2  LEU  10          3HD2      LEU  10 -14.473  12.766  -8.240
   73   2HD2  LEU  10          2HD2      LEU  10 -15.555  11.424  -8.270
   74   3HD2  LEU  10          1HD2      LEU  10 -13.864  11.203  -7.870
   75    H    MET  11             H      MET  11 -15.983  15.096 -10.587
   76    HA   MET  11            HA      MET  11 -16.928  15.271 -13.323
   77   1HB   MET  11           2HB      MET  11 -17.777  16.729 -10.791
   78   2HB   MET  11           1HB      MET  11 -18.749  16.497 -12.253
   79   1HG   MET  11           2HG      MET  11 -17.583  13.908 -10.903
   80   2HG   MET  11           1HG      MET  11 -19.009  14.727 -10.167
   81   1HE   MET  11           2HE      MET  11 -17.336  12.997 -12.715
   82   2HE   MET  11           1HE      MET  11 -18.525  11.703 -12.617
   83   3HE   MET  11           3HE      MET  11 -18.394  12.681 -14.088
   84    H    ALA  12             H      ALA  12 -14.859  17.179 -11.263
   85    HA   ALA  12            HA      ALA  12 -14.692  19.525 -12.936
   86   1HB   ALA  12           3HB      ALA  12 -13.762  18.714 -10.268
   87   2HB   ALA  12           2HB      ALA  12 -12.656  19.782 -11.144
   88   3HB   ALA  12           1HB      ALA  12 -14.314  20.296 -10.837
   89    H    ASP  13             H      ASP  13 -12.864  16.576 -12.670
   90    HA   ASP  13            HA      ASP  13 -10.354  17.646 -13.724
   91   1HB   ASP  13           2HB      ASP  13  -9.830  15.013 -13.906
   92   2HB   ASP  13           1HB      ASP  13  -9.719  15.900 -12.401
   93    H    GLY  14             H      GLY  14 -13.068  16.861 -15.522
   94   1HA   GLY  14           2HA      GLY  14 -13.329  16.015 -17.797
   95   2HA   GLY  14           1HA      GLY  14 -12.231  17.359 -18.070
   96    H    THR  15             H      THR  15 -11.366  14.381 -16.439
   97    HA   THR  15            HA      THR  15  -9.778  13.268 -18.627
   98    HB   THR  15            HB      THR  15  -8.705  14.138 -15.977
   99    HG1  THR  15           HG1      THR  15  -7.371  15.356 -17.192
  100   1HG2  THR  15          3HG2      THR  15  -7.650  12.165 -17.993
  101   2HG2  THR  15          2HG2      THR  15  -6.603  12.963 -16.785
  102   3HG2  THR  15          1HG2      THR  15  -7.955  11.934 -16.265
  103    H    CYS  16             H      CYS  16 -11.024  13.028 -15.400
  104    HA   CYS  16            HA      CYS  16 -10.554  10.269 -15.026
  105   1HB   CYS  16           2HB      CYS  16 -11.577  10.722 -12.942
  106   2HB   CYS  16           1HB      CYS  16 -11.237  12.339 -13.425
  107    HG   CYS  16            HG      CYS  16 -14.041  11.082 -13.951
  108    H    GLN  17             H      GLN  17 -12.835   9.097 -14.437
  109    HA   GLN  17            HA      GLN  17 -14.949   9.450 -16.377
  110   1HB   GLN  17           2HB      GLN  17 -13.122   7.909 -17.334
  111   2HB   GLN  17           1HB      GLN  17 -13.766   6.721 -16.205
  112   1HG   GLN  17           2HG      GLN  17 -15.014   6.398 -18.200
  113   2HG   GLN  17           1HG      GLN  17 -16.068   7.320 -17.142
  114   1HE2  GLN  17          2HE2      GLN  17 -16.020   8.926 -20.561
  115   2HE2  GLN  17          1HE2      GLN  17 -16.387   7.367 -20.000
  116    H    ASP  18             H      ASP  18 -13.492   7.516 -13.821
  117    HA   ASP  18            HA      ASP  18 -16.036   7.450 -12.361
  118   1HB   ASP  18           2HB      ASP  18 -16.098   5.248 -13.229
  119   2HB   ASP  18           1HB      ASP  18 -14.358   5.089 -13.198
  120    H    ALA  19             H      ALA  19 -15.443   6.643  -9.944
  121    HA   ALA  19            HA      ALA  19 -12.791   7.532  -8.925
  122   1HB   ALA  19           2HB      ALA  19 -15.178   9.240  -9.168
  123   2HB   ALA  19           1HB      ALA  19 -14.379   9.206  -7.570
  124   3HB   ALA  19           3HB      ALA  19 -13.454   9.579  -8.999
  125    H    ALA  20             H      ALA  20 -12.515   6.217  -6.945
  126    HA   ALA  20            HA      ALA  20 -15.146   5.848  -5.479
  127   1HB   ALA  20           3HB      ALA  20 -13.416   3.672  -6.473
  128   2HB   ALA  20           2HB      ALA  20 -14.337   3.446  -4.982
  129   3HB   ALA  20           1HB      ALA  20 -15.163   3.824  -6.503
  130    H    ILE  21             H      ILE  21 -14.859   6.765  -3.645
  131    HA   ILE  21            HA      ILE  21 -12.355   6.513  -2.087
  132    HB   ILE  21            HB      ILE  21 -15.013   7.781  -1.339
  133   1HG1  ILE  21          2HG1      ILE  21 -12.483   8.912  -2.588
  134   2HG1  ILE  21          1HG1      ILE  21 -14.105   8.925  -3.273
  135   1HG2  ILE  21          2HG2      ILE  21 -12.227   7.932  -0.109
  136   2HG2  ILE  21          1HG2      ILE  21 -13.587   8.944   0.393
  137   3HG2  ILE  21          3HG2      ILE  21 -13.652   7.194   0.621
  138   1HD1  ILE  21          2HD1      ILE  21 -14.575  10.187  -0.934
  139   2HD1  ILE  21          1HD1      ILE  21 -12.905  10.667  -1.213
  140   3HD1  ILE  21          3HD1      ILE  21 -14.141  11.039  -2.415
  141    H    VAL  22             H      VAL  22 -12.179   4.572  -0.920
  142    HA   VAL  22            HA      VAL  22 -14.767   3.208  -0.278
  143    HB   VAL  22            HB      VAL  22 -12.100   1.870  -0.918
  144   1HG1  VAL  22          2HG1      VAL  22 -13.988   0.717   0.470
  145   2HG1  VAL  22          1HG1      VAL  22 -14.826   0.603  -1.078
  146   3HG1  VAL  22          3HG1      VAL  22 -13.250  -0.173  -0.867
  147   1HG2  VAL  22          1HG2      VAL  22 -13.335   3.234  -2.811
  148   2HG2  VAL  22          3HG2      VAL  22 -12.738   1.603  -3.157
  149   3HG2  VAL  22          2HG2      VAL  22 -14.450   1.874  -2.795
  150    H    GLY  23             H      GLY  23 -15.027   3.168   1.990
  151   1HA   GLY  23           2HA      GLY  23 -12.867   3.351   3.920
  152   2HA   GLY  23           1HA      GLY  23 -14.520   2.832   4.288
  153    OH   TYR  24            OH      TYR  24  -5.417   1.716   4.643
  154    H    TYR  24             H      TYR  24 -11.446   1.756   3.145
  155    HA   TYR  24            HA      TYR  24 -12.110  -1.013   2.794
  156   1HB   TYR  24           2HB      TYR  24  -9.969  -1.201   1.789
  157   2HB   TYR  24           1HB      TYR  24 -10.488   0.420   1.406
  158    HD1  TYR  24           HD2      TYR  24  -9.928   1.706   4.191
  159    HD2  TYR  24           HD1      TYR  24  -7.656  -0.932   1.750
  160    HE1  TYR  24           HE2      TYR  24  -7.854   2.537   5.231
  161    HE2  TYR  24           HE1      TYR  24  -5.586  -0.126   2.747
  162    HH   TYR  24            HH      TYR  24  -5.458   1.518   5.581
  163    H    LYS  25             H      LYS  25 -12.355  -0.079   5.600
  164    HA   LYS  25            HA      LYS  25 -10.117  -1.023   7.098
  165   1HB   LYS  25           2HB      LYS  25 -12.937  -0.481   7.799
  166   2HB   LYS  25           1HB      LYS  25 -11.797  -1.069   8.980
  167   1HG   LYS  25           2HG      LYS  25 -11.634   1.258   9.213
  168   2HG   LYS  25           1HG      LYS  25 -10.285   0.865   8.158
  169   1HD   LYS  25           2HD      LYS  25 -11.311   1.690   6.292
  170   2HD   LYS  25           1HD      LYS  25 -12.935   1.473   6.951
  171   1HE   LYS  25           2HE      LYS  25 -10.957   3.433   8.096
  172   2HE   LYS  25           1HE      LYS  25 -12.125   3.885   6.864
  173   1HZ   LYS  25           3HZ      LYS  25 -13.877   3.037   8.390
  174   2HZ   LYS  25           2HZ      LYS  25 -12.693   2.842   9.587
  175   3HZ   LYS  25           1HZ      LYS  25 -13.047   4.386   8.990
  176    H    ASP  26             H      ASP  26 -11.573  -2.869   8.841
  177    HA   ASP  26            HA      ASP  26 -10.986  -5.405   7.787
  178   1HB   ASP  26           2HB      ASP  26 -13.018  -6.192   9.240
  179   2HB   ASP  26           1HB      ASP  26 -11.560  -5.623  10.013
  180    H    SER  27             H      SER  27 -14.212  -3.950   7.850
  181    HA   SER  27            HA      SER  27 -15.053  -5.587   5.559
  182   1HB   SER  27           2HB      SER  27 -17.276  -4.447   6.188
  183   2HB   SER  27           1HB      SER  27 -16.702  -5.724   7.223
  184    HG   SER  27            HG      SER  27 -17.380  -3.424   8.037
  185    HA   PRO  28            HA      PRO  28 -14.151  -1.823   3.343
  186   1HB   PRO  28           2HB      PRO  28 -14.474  -2.857   0.830
  187   2HB   PRO  28           1HB      PRO  28 -12.997  -3.038   1.798
  188   1HG   PRO  28           2HG      PRO  28 -15.058  -5.062   1.183
  189   2HG   PRO  28           1HG      PRO  28 -13.412  -5.275   1.720
  190   1HD   PRO  28           2HD      PRO  28 -15.758  -5.499   3.281
  191   2HD   PRO  28           1HD      PRO  28 -14.073  -5.609   3.836
  192    H    SER  29             H      SER  29 -15.327  -0.261   2.154
  193    HA   SER  29            HA      SER  29 -17.991  -0.854   1.237
  194   1HB   SER  29           2HB      SER  29 -19.052   0.851   2.698
  195   2HB   SER  29           1HB      SER  29 -18.418  -0.509   3.620
  196    HG   SER  29            HG      SER  29 -17.889   1.863   4.183
  197    H    VAL  30             H      VAL  30 -18.837   0.890   0.000
  198    HA   VAL  30            HA      VAL  30 -16.744   2.556  -1.128
  199    HB   VAL  30            HB      VAL  30 -19.584   1.891  -1.872
  200   1HG1  VAL  30          3HG1      VAL  30 -19.095   4.268  -2.479
  201   2HG1  VAL  30          2HG1      VAL  30 -17.662   3.713  -3.350
  202   3HG1  VAL  30          1HG1      VAL  30 -19.265   3.231  -3.904
  203   1HG2  VAL  30          2HG2      VAL  30 -17.046   0.686  -2.294
  204   2HG2  VAL  30          1HG2      VAL  30 -18.577   0.242  -3.038
  205   3HG2  VAL  30          3HG2      VAL  30 -17.517   1.393  -3.830
  206    CH2  TRP  31           CH2      TRP  31 -13.787   5.690   6.634
  207    H    TRP  31             H      TRP  31 -16.373   4.175   0.293
  208    HA   TRP  31            HA      TRP  31 -18.369   5.511   1.830
  209   1HB   TRP  31           2HB      TRP  31 -15.467   5.917   1.232
  210   2HB   TRP  31           1HB      TRP  31 -16.367   7.228   1.983
  211    HD1  TRP  31           HD1      TRP  31 -17.873   4.044   3.054
  212    HE1  TRP  31           HE1      TRP  31 -17.101   3.406   5.376
  213    HE3  TRP  31           HE3      TRP  31 -13.912   7.241   3.620
  214    HZ2  TRP  31           HZ2      TRP  31 -15.115   4.132   7.281
  215    HZ3  TRP  31           HZ3      TRP  31 -12.632   7.248   5.726
  216    HH2  TRP  31           HH2      TRP  31 -13.214   5.691   7.542
  217    H    ALA  32             H      ALA  32 -17.165   5.922  -1.398
  218    HA   ALA  32            HA      ALA  32 -19.276   7.636  -2.180
  219   1HB   ALA  32           3HB      ALA  32 -16.710   9.088  -1.432
  220   2HB   ALA  32           2HB      ALA  32 -17.949   9.806  -2.491
  221   3HB   ALA  32           1HB      ALA  32 -18.342   9.386  -0.817
  222    H    ALA  33             H      ALA  33 -19.064   6.049  -3.893
  223    HA   ALA  33            HA      ALA  33 -16.948   6.757  -5.841
  224   1HB   ALA  33           2HB      ALA  33 -18.284   4.079  -5.435
  225   2HB   ALA  33           1HB      ALA  33 -17.202   4.455  -6.773
  226   3HB   ALA  33           3HB      ALA  33 -16.595   4.459  -5.118
  227    H    VAL  34             H      VAL  34 -17.681   7.491  -7.762
  228    HA   VAL  34            HA      VAL  34 -20.338   8.262  -8.278
  229    HB   VAL  34            HB      VAL  34 -18.393   7.396 -10.454
  230   1HG1  VAL  34          1HG1      VAL  34 -20.808   9.176 -10.299
  231   2HG1  VAL  34          3HG1      VAL  34 -19.533   9.559 -11.467
  232   3HG1  VAL  34          2HG1      VAL  34 -20.369   7.992 -11.540
  233   1HG2  VAL  34          2HG2      VAL  34 -18.466   9.879  -8.727
  234   2HG2  VAL  34          1HG2      VAL  34 -17.094   8.835  -9.077
  235   3HG2  VAL  34          3HG2      VAL  34 -17.731   9.895 -10.330
  236    HA   PRO  35            HA      PRO  35 -21.914   4.020  -8.630
  237   1HB   PRO  35           2HB      PRO  35 -24.588   4.677  -8.635
  238   2HB   PRO  35           1HB      PRO  35 -23.610   4.499  -7.168
  239   1HG   PRO  35           2HG      PRO  35 -24.547   7.008  -8.511
  240   2HG   PRO  35           1HG      PRO  35 -24.214   6.710  -6.795
  241   1HD   PRO  35           2HD      PRO  35 -22.489   8.067  -8.544
  242   2HD   PRO  35           1HD      PRO  35 -22.006   7.336  -6.998
  243    H    GLY  36             H      GLY  36 -22.705   2.744 -10.308
  244   1HA   GLY  36           2HA      GLY  36 -23.937   2.435 -12.406
  245   2HA   GLY  36           1HA      GLY  36 -23.605   4.125 -12.799
  246    H    LYS  37             H      LYS  37 -20.745   3.749 -11.768
  247    HA   LYS  37            HA      LYS  37 -19.624   2.924 -14.337
  248   1HB   LYS  37           2HB      LYS  37 -18.215   3.778 -11.802
  249   2HB   LYS  37           1HB      LYS  37 -17.505   3.698 -13.415
  250   1HG   LYS  37           2HG      LYS  37 -19.815   5.484 -12.566
  251   2HG   LYS  37           1HG      LYS  37 -18.164   6.015 -12.869
  252   1HD   LYS  37           2HD      LYS  37 -18.362   5.254 -15.227
  253   2HD   LYS  37           1HD      LYS  37 -20.030   4.774 -14.917
  254   1HE   LYS  37           2HE      LYS  37 -20.181   7.298 -14.030
  255   2HE   LYS  37           1HE      LYS  37 -18.861   7.506 -15.181
  256   1HZ   LYS  37           3HZ      LYS  37 -20.427   6.166 -16.729
  257   2HZ   LYS  37           2HZ      LYS  37 -21.644   6.694 -15.669
  258   3HZ   LYS  37           1HZ      LYS  37 -20.688   7.826 -16.503
  259    H    THR  38             H      THR  38 -17.732   1.960 -11.467
  260    HA   THR  38            HA      THR  38 -18.426  -0.872 -11.675
  261    HB   THR  38            HB      THR  38 -16.181   0.308 -13.167
  262    HG1  THR  38           HG1      THR  38 -17.669  -2.055 -13.475
  263   1HG2  THR  38          1HG2      THR  38 -15.800  -2.150 -11.495
  264   2HG2  THR  38          3HG2      THR  38 -15.105  -2.139 -13.115
  265   3HG2  THR  38          2HG2      THR  38 -14.618  -0.914 -11.938
  266    H    PHE  39             H      PHE  39 -16.026   1.479 -10.521
  267    HA   PHE  39            HA      PHE  39 -14.742  -0.096  -8.540
  268   1HB   PHE  39           2HB      PHE  39 -15.356   2.848  -8.594
  269   2HB   PHE  39           1HB      PHE  39 -14.322   2.073  -7.407
  270    HD1  PHE  39           HD2      PHE  39 -14.066   0.566 -10.720
  271    HD2  PHE  39           HD1      PHE  39 -12.603   3.754  -8.247
  272    HE1  PHE  39           HE2      PHE  39 -12.136   0.846 -12.219
  273    HE2  PHE  39           HE1      PHE  39 -10.670   4.025  -9.760
  274    HZ   PHE  39            HZ      PHE  39 -10.454   2.562 -11.738
  275    H    VAL  40             H      VAL  40 -17.628   1.891  -8.291
  276    HA   VAL  40            HA      VAL  40 -18.089   1.867  -5.557
  277    HB   VAL  40            HB      VAL  40 -19.432   3.329  -6.870
  278   1HG1  VAL  40          2HG1      VAL  40 -20.058   0.835  -8.403
  279   2HG1  VAL  40          1HG1      VAL  40 -21.116   2.236  -8.497
  280   3HG1  VAL  40          3HG1      VAL  40 -19.425   2.380  -8.987
  281   1HG2  VAL  40          1HG2      VAL  40 -20.570   1.644  -5.004
  282   2HG2  VAL  40          3HG2      VAL  40 -21.383   3.044  -5.715
  283   3HG2  VAL  40          2HG2      VAL  40 -21.647   1.434  -6.386
  284    H    ASN  41             H      ASN  41 -18.444  -0.708  -7.860
  285    HA   ASN  41            HA      ASN  41 -20.019  -2.356  -6.026
  286   1HB   ASN  41           2HB      ASN  41 -19.036  -2.614  -8.838
  287   2HB   ASN  41           1HB      ASN  41 -19.506  -4.034  -7.934
  288   1HD2  ASN  41          2HD2      ASN  41 -22.986  -3.130  -7.779
  289   2HD2  ASN  41          1HD2      ASN  41 -21.779  -3.988  -6.946
  290    H    ILE  42             H      ILE  42 -17.265  -1.368  -5.287
  291    HA   ILE  42            HA      ILE  42 -15.427  -3.517  -5.585
  292    HB   ILE  42            HB      ILE  42 -15.531  -0.875  -4.162
  293   1HG1  ILE  42          2HG1      ILE  42 -13.151  -2.111  -5.513
  294   2HG1  ILE  42          1HG1      ILE  42 -14.540  -1.639  -6.488
  295   1HG2  ILE  42          1HG2      ILE  42 -14.738  -2.503  -2.358
  296   2HG2  ILE  42          3HG2      ILE  42 -13.353  -2.857  -3.389
  297   3HG2  ILE  42          2HG2      ILE  42 -13.598  -1.229  -2.765
  298   1HD1  ILE  42          2HD1      ILE  42 -14.369   0.637  -5.251
  299   2HD1  ILE  42          1HD1      ILE  42 -12.752   0.105  -4.801
  300   3HD1  ILE  42          3HD1      ILE  42 -13.170   0.290  -6.511
  301    H    THR  43             H      THR  43 -14.512  -4.514  -3.553
  302    HA   THR  43            HA      THR  43 -16.267  -5.312  -1.352
  303    HB   THR  43            HB      THR  43 -16.072  -7.723  -2.125
  304    HG1  THR  43           HG1      THR  43 -15.294  -8.164  -4.094
  305   1HG2  THR  43          3HG2      THR  43 -18.010  -6.098  -2.715
  306   2HG2  THR  43          2HG2      THR  43 -17.321  -6.176  -4.337
  307   3HG2  THR  43          1HG2      THR  43 -17.907  -7.648  -3.556
  308    HA   PRO  44            HA      PRO  44 -12.196  -6.160   0.405
  309   1HB   PRO  44           2HB      PRO  44 -12.343  -8.546   1.620
  310   2HB   PRO  44           1HB      PRO  44 -13.006  -7.081   2.296
  311   1HG   PRO  44           2HG      PRO  44 -14.433  -9.383   1.060
  312   2HG   PRO  44           1HG      PRO  44 -15.031  -8.198   2.233
  313   1HD   PRO  44           2HD      PRO  44 -15.580  -8.203  -0.514
  314   2HD   PRO  44           1HD      PRO  44 -15.886  -6.851   0.575
  315    H    ALA  45             H      ALA  45 -13.191  -7.933  -2.118
  316    HA   ALA  45            HA      ALA  45 -10.910  -9.738  -2.368
  317   1HB   ALA  45           3HB      ALA  45 -13.484  -9.294  -3.741
  318   2HB   ALA  45           2HB      ALA  45 -12.153  -9.817  -4.776
  319   3HB   ALA  45           1HB      ALA  45 -12.653 -10.815  -3.410
  320    H    GLU  46             H      GLU  46 -12.418  -7.325  -4.368
  321    HA   GLU  46            HA      GLU  46 -10.111  -6.676  -5.939
  322   1HB   GLU  46           2HB      GLU  46 -11.420  -4.335  -6.147
  323   2HB   GLU  46           1HB      GLU  46 -11.943  -5.758  -7.029
  324   1HG   GLU  46           2HG      GLU  46 -13.050  -5.555  -4.324
  325   2HG   GLU  46           1HG      GLU  46 -13.481  -4.204  -5.361
  326    H    VAL  47             H      VAL  47 -11.225  -5.529  -2.839
  327    HA   VAL  47            HA      VAL  47  -9.117  -3.543  -2.618
  328    HB   VAL  47            HB      VAL  47 -11.587  -4.082  -1.209
  329   1HG1  VAL  47          2HG1      VAL  47  -9.267  -2.949   0.206
  330   2HG1  VAL  47          1HG1      VAL  47 -10.932  -2.905   0.779
  331   3HG1  VAL  47          3HG1      VAL  47 -10.088  -4.451   0.641
  332   1HG2  VAL  47          3HG2      VAL  47 -10.870  -2.107  -2.694
  333   2HG2  VAL  47          2HG2      VAL  47 -11.746  -1.745  -1.203
  334   3HG2  VAL  47          1HG2      VAL  47  -9.962  -1.571  -1.251
  335    H    GLY  48             H      GLY  48  -9.585  -6.847  -1.800
  336   1HA   GLY  48           2HA      GLY  48  -7.686  -7.070   0.346
  337   2HA   GLY  48           1HA      GLY  48  -8.190  -8.380  -0.713
  338    H    VAL  49             H      VAL  49  -7.378  -6.829  -3.090
  339    HA   VAL  49            HA      VAL  49  -4.501  -7.447  -3.010
  340    HB   VAL  49            HB      VAL  49  -5.852  -8.492  -4.810
  341   1HG1  VAL  49          3HG1      VAL  49  -7.423  -6.539  -5.069
  342   2HG1  VAL  49          2HG1      VAL  49  -6.124  -5.666  -5.876
  343   3HG1  VAL  49          1HG1      VAL  49  -6.775  -7.136  -6.596
  344   1HG2  VAL  49          3HG2      VAL  49  -3.451  -6.820  -5.182
  345   2HG2  VAL  49          2HG2      VAL  49  -3.761  -8.484  -5.683
  346   3HG2  VAL  49          1HG2      VAL  49  -4.324  -7.150  -6.685
  347    H    LEU  50             H      LEU  50  -6.694  -4.823  -3.660
  348    HA   LEU  50            HA      LEU  50  -4.828  -2.847  -4.498
  349   1HB   LEU  50           2HB      LEU  50  -7.548  -2.938  -3.432
  350   2HB   LEU  50           1HB      LEU  50  -6.747  -1.439  -3.281
  351    HG   LEU  50            HG      LEU  50  -6.877  -2.801  -5.930
  352   1HD1  LEU  50          2HD1      LEU  50  -9.211  -2.705  -4.980
  353   2HD1  LEU  50          1HD1      LEU  50  -9.007  -0.972  -4.689
  354   3HD1  LEU  50          3HD1      LEU  50  -9.018  -1.612  -6.343
  355   1HD2  LEU  50          3HD2      LEU  50  -5.473  -0.738  -5.472
  356   2HD2  LEU  50          2HD2      LEU  50  -6.703  -0.502  -6.712
  357   3HD2  LEU  50          1HD2      LEU  50  -6.966   0.118  -5.080
  358    H    VAL  51             H      VAL  51  -5.517  -4.288  -1.466
  359    HA   VAL  51            HA      VAL  51  -3.808  -2.284  -0.067
  360    HB   VAL  51            HB      VAL  51  -5.605  -1.579   1.354
  361   1HG1  VAL  51          3HG1      VAL  51  -6.991  -2.428  -1.199
  362   2HG1  VAL  51          2HG1      VAL  51  -7.779  -1.482   0.028
  363   3HG1  VAL  51          1HG1      VAL  51  -6.366  -0.835  -0.793
  364   1HG2  VAL  51          3HG2      VAL  51  -6.549  -4.390   1.094
  365   2HG2  VAL  51          2HG2      VAL  51  -6.513  -3.340   2.514
  366   3HG2  VAL  51          1HG2      VAL  51  -7.810  -3.168   1.325
  367    H    GLY  52             H      GLY  52  -4.433  -5.582  -0.578
  368   1HA   GLY  52           2HA      GLY  52  -4.175  -6.747   1.993
  369   2HA   GLY  52           1HA      GLY  52  -3.657  -7.513   0.492
  370    H    LYS  53             H      LYS  53  -1.893  -8.337   1.791
  371    HA   LYS  53            HA      LYS  53   0.153  -6.514   2.654
  372   1HB   LYS  53           2HB      LYS  53  -0.422  -9.317   3.224
  373   2HB   LYS  53           1HB      LYS  53   1.292  -8.893   3.196
  374   1HG   LYS  53           2HG      LYS  53  -0.502  -7.018   4.652
  375   2HG   LYS  53           1HG      LYS  53  -0.250  -8.606   5.394
  376   1HD   LYS  53           2HD      LYS  53   1.949  -8.175   5.866
  377   2HD   LYS  53           1HD      LYS  53   2.252  -7.442   4.266
  378   1HE   LYS  53           2HE      LYS  53   1.172  -5.350   5.074
  379   2HE   LYS  53           1HE      LYS  53   0.923  -6.081   6.664
  380   1HZ   LYS  53           2HZ      LYS  53   3.321  -6.406   6.843
  381   2HZ   LYS  53           1HZ      LYS  53   3.550  -5.663   5.331
  382   3HZ   LYS  53           3HZ      LYS  53   2.944  -4.763   6.635
  383    H    ASP  54             H      ASP  54   0.342  -9.441   0.763
  384    HA   ASP  54            HA      ASP  54   2.812  -9.667  -0.076
  385   1HB   ASP  54           2HB      ASP  54   0.608 -10.643  -1.008
  386   2HB   ASP  54           1HB      ASP  54   0.885  -9.501  -2.291
  387    NH1  ARG  55           NH1      ARG  55   6.717  -2.113   2.476
  388    NH2  ARG  55           NH2      ARG  55   5.331  -2.350   4.247
  389    H    ARG  55             H      ARG  55   4.018  -7.849   0.073
  390    HA   ARG  55            HA      ARG  55   3.606  -5.372  -1.188
  391   1HB   ARG  55           2HB      ARG  55   6.240  -6.390  -0.125
  392   2HB   ARG  55           1HB      ARG  55   5.696  -4.716  -0.229
  393   1HG   ARG  55           2HG      ARG  55   3.755  -5.476   1.340
  394   2HG   ARG  55           1HG      ARG  55   4.778  -6.878   1.674
  395   1HD   ARG  55           2HD      ARG  55   5.569  -5.467   3.315
  396   2HD   ARG  55           1HD      ARG  55   6.625  -4.973   1.994
  397    HE   ARG  55            HE      ARG  55   4.192  -3.426   1.975
  398   1HH1  ARG  55          2HH1      ARG  55   6.996  -2.377   1.555
  399   2HH1  ARG  55          1HH1      ARG  55   7.217  -1.398   2.964
  400   1HH2  ARG  55          1HH2      ARG  55   4.548  -2.798   4.679
  401   2HH2  ARG  55          2HH2      ARG  55   5.831  -1.637   4.736
  402    H    SER  56             H      SER  56   4.033  -7.919  -2.989
  403    HA   SER  56            HA      SER  56   5.557  -6.453  -5.033
  404   1HB   SER  56           2HB      SER  56   7.320  -7.516  -3.684
  405   2HB   SER  56           1HB      SER  56   6.637  -9.087  -4.077
  406    HG   SER  56            HG      SER  56   7.183  -8.795  -6.181
  407    H    SER  57             H      SER  57   3.524  -9.118  -4.288
  408    HA   SER  57            HA      SER  57   3.607 -10.467  -6.784
  409   1HB   SER  57           2HB      SER  57   1.457 -11.541  -6.089
  410   2HB   SER  57           1HB      SER  57   2.744 -11.676  -4.902
  411    HG   SER  57            HG      SER  57   1.681  -9.604  -4.085
  412    H    PHE  58             H      PHE  58   0.535  -9.107  -5.885
  413    HA   PHE  58            HA      PHE  58  -0.608  -8.858  -8.287
  414   1HB   PHE  58           2HB      PHE  58  -1.930  -6.858  -7.452
  415   2HB   PHE  58           1HB      PHE  58  -2.020  -8.354  -6.556
  416    HD1  PHE  58           HD2      PHE  58  -0.987  -8.589  -4.371
  417    HD2  PHE  58           HD1      PHE  58  -0.778  -4.913  -6.569
  418    HE1  PHE  58           HE2      PHE  58  -0.301  -7.398  -2.318
  419    HE2  PHE  58           HE1      PHE  58  -0.111  -3.720  -4.504
  420    HZ   PHE  58            HZ      PHE  58   0.133  -4.961  -2.390
  421    OH   TYR  59            OH      TYR  59   2.771  -2.993  -3.352
  422    H    TYR  59             H      TYR  59   2.040  -6.715  -7.510
  423    HA   TYR  59            HA      TYR  59   1.331  -4.638  -9.284
  424   1HB   TYR  59           2HB      TYR  59   4.161  -5.456  -8.768
  425   2HB   TYR  59           1HB      TYR  59   3.580  -3.883  -9.301
  426    HD1  TYR  59           HD1      TYR  59   1.400  -3.209  -7.687
  427    HD2  TYR  59           HD2      TYR  59   4.966  -5.308  -6.601
  428    HE1  TYR  59           HE1      TYR  59   1.143  -2.422  -5.350
  429    HE2  TYR  59           HE2      TYR  59   4.705  -4.528  -4.279
  430    HH   TYR  59            HH      TYR  59   3.066  -3.700  -2.771
  431    H    VAL  60             H      VAL  60   1.811  -7.718 -10.205
  432    HA   VAL  60            HA      VAL  60   2.645  -6.911 -12.901
  433    HB   VAL  60            HB      VAL  60   3.237  -9.472 -12.951
  434   1HG1  VAL  60          3HG1      VAL  60   4.736  -7.495 -13.255
  435   2HG1  VAL  60          2HG1      VAL  60   4.961  -7.473 -11.506
  436   3HG1  VAL  60          1HG1      VAL  60   5.523  -8.854 -12.450
  437   1HG2  VAL  60          2HG2      VAL  60   2.369  -9.762 -10.560
  438   2HG2  VAL  60          1HG2      VAL  60   3.984 -10.398 -10.876
  439   3HG2  VAL  60          3HG2      VAL  60   3.789  -8.846 -10.050
  440    H    ASN  61             H      ASN  61   0.320  -8.860 -11.027
  441    HA   ASN  61            HA      ASN  61  -0.894  -9.861 -13.471
  442   1HB   ASN  61           2HB      ASN  61  -2.480 -10.930 -11.857
  443   2HB   ASN  61           1HB      ASN  61  -0.834 -11.392 -11.670
  444   1HD2  ASN  61          2HD2      ASN  61  -2.412  -8.983  -8.821
  445   2HD2  ASN  61          1HD2      ASN  61  -2.972  -8.858 -10.387
  446    H    GLY  62             H      GLY  62  -1.261  -7.240 -11.314
  447   1HA   GLY  62           2HA      GLY  62  -2.485  -5.257 -11.725
  448   2HA   GLY  62           1HA      GLY  62  -3.505  -6.121 -12.872
  449    H    LEU  63             H      LEU  63  -3.921  -4.449 -10.225
  450    HA   LEU  63            HA      LEU  63  -5.131  -6.188  -8.297
  451   1HB   LEU  63           2HB      LEU  63  -5.939  -3.287  -8.731
  452   2HB   LEU  63           1HB      LEU  63  -6.008  -4.199  -7.221
  453    HG   LEU  63            HG      LEU  63  -3.392  -3.582  -8.615
  454   1HD1  LEU  63          2HD1      LEU  63  -5.207  -1.703  -7.495
  455   2HD1  LEU  63          1HD1      LEU  63  -3.932  -1.934  -6.292
  456   3HD1  LEU  63          3HD1      LEU  63  -3.521  -1.433  -7.933
  457   1HD2  LEU  63          1HD2      LEU  63  -4.311  -4.669  -5.980
  458   2HD2  LEU  63          3HD2      LEU  63  -2.976  -5.203  -7.003
  459   3HD2  LEU  63          2HD2      LEU  63  -2.815  -3.741  -6.032
  460    H    THR  64             H      THR  64  -7.703  -4.776  -8.089
  461    HA   THR  64            HA      THR  64  -9.139  -5.221 -10.539
  462    HB   THR  64            HB      THR  64 -10.642  -6.935  -9.408
  463    HG1  THR  64           HG1      THR  64  -9.904  -7.913  -7.625
  464   1HG2  THR  64          2HG2      THR  64  -8.875  -7.429 -11.145
  465   2HG2  THR  64          1HG2      THR  64  -7.813  -7.899  -9.810
  466   3HG2  THR  64          3HG2      THR  64  -9.316  -8.783 -10.107
  467    H    LEU  65             H      LEU  65 -10.900  -4.000 -10.390
  468    HA   LEU  65            HA      LEU  65 -11.925  -3.205  -7.776
  469   1HB   LEU  65           2HB      LEU  65 -12.112  -0.821  -8.847
  470   2HB   LEU  65           1HB      LEU  65 -10.728  -1.323  -7.929
  471    HG   LEU  65            HG      LEU  65  -9.575  -1.939 -10.052
  472   1HD1  LEU  65          3HD1      LEU  65 -12.161  -0.951 -11.142
  473   2HD1  LEU  65          2HD1      LEU  65 -10.696  -0.678 -12.068
  474   3HD1  LEU  65          1HD1      LEU  65 -11.184  -2.316 -11.651
  475   1HD2  LEU  65          2HD2      LEU  65 -10.438   0.808  -9.292
  476   2HD2  LEU  65          1HD2      LEU  65  -8.813   0.123  -9.399
  477   3HD2  LEU  65          3HD2      LEU  65  -9.649   0.629 -10.864
  478    H    GLY  66             H      GLY  66 -13.838  -4.064  -7.911
  479   1HA   GLY  66           2HA      GLY  66 -16.107  -4.218  -8.469
  480   2HA   GLY  66           1HA      GLY  66 -15.819  -3.036  -9.747
  481    H    GLY  67             H      GLY  67 -13.808  -5.885  -9.389
  482   1HA   GLY  67           2HA      GLY  67 -13.730  -7.891 -10.617
  483   2HA   GLY  67           1HA      GLY  67 -15.228  -7.426 -11.425
  484    H    GLN  68             H      GLN  68 -12.964  -4.804 -11.493
  485    HA   GLN  68            HA      GLN  68 -12.254  -5.566 -14.318
  486   1HB   GLN  68           2HB      GLN  68 -13.585  -3.533 -14.041
  487   2HB   GLN  68           1HB      GLN  68 -12.261  -2.879 -13.142
  488   1HG   GLN  68           2HG      GLN  68 -11.684  -3.985 -15.835
  489   2HG   GLN  68           1HG      GLN  68 -12.443  -2.399 -15.725
  490   1HE2  GLN  68          2HE2      GLN  68  -8.524  -2.491 -15.351
  491   2HE2  GLN  68          1HE2      GLN  68  -9.489  -3.579 -16.234
  492    H    LYS  69             H      LYS  69 -10.281  -6.526 -14.333
  493    HA   LYS  69            HA      LYS  69  -8.187  -6.105 -12.435
  494   1HB   LYS  69           2HB      LYS  69  -8.685  -7.808 -14.605
  495   2HB   LYS  69           1HB      LYS  69  -7.211  -6.953 -15.050
  496   1HG   LYS  69           2HG      LYS  69  -5.980  -7.962 -13.421
  497   2HG   LYS  69           1HG      LYS  69  -7.292  -7.889 -12.246
  498   1HD   LYS  69           2HD      LYS  69  -8.299  -9.856 -13.061
  499   2HD   LYS  69           1HD      LYS  69  -7.441  -9.765 -14.598
  500   1HE   LYS  69           2HE      LYS  69  -6.210 -11.422 -13.509
  501   2HE   LYS  69           1HE      LYS  69  -5.296  -9.978 -13.063
  502   1HZ   LYS  69           3HZ      LYS  69  -7.519 -10.979 -11.393
  503   2HZ   LYS  69           2HZ      LYS  69  -5.938 -11.574 -11.211
  504   3HZ   LYS  69           1HZ      LYS  69  -6.264  -9.926 -10.959
  505    H    CYS  70             H      CYS  70  -7.034  -4.218 -12.136
  506    HA   CYS  70            HA      CYS  70  -6.173  -2.681 -14.623
  507   1HB   CYS  70           2HB      CYS  70  -5.996  -0.767 -12.969
  508   2HB   CYS  70           1HB      CYS  70  -7.604  -1.281 -13.370
  509    HG   CYS  70            HG      CYS  70  -7.599  -2.635 -11.031
  510    H    SER  71             H      SER  71  -4.064  -2.362 -14.679
  511    HA   SER  71            HA      SER  71  -2.412  -3.932 -12.881
  512   1HB   SER  71           2HB      SER  71  -0.968  -4.208 -14.602
  513   2HB   SER  71           1HB      SER  71  -2.484  -3.950 -15.427
  514    HG   SER  71            HG      SER  71  -0.333  -2.194 -15.062
  515    H    VAL  72             H      VAL  72  -1.370  -3.066 -11.284
  516    HA   VAL  72            HA      VAL  72  -0.944  -0.392 -10.672
  517    HB   VAL  72            HB      VAL  72   0.959  -2.578  -9.997
  518   1HG1  VAL  72          2HG1      VAL  72   1.229   0.010  -9.493
  519   2HG1  VAL  72          1HG1      VAL  72   0.165  -0.403  -8.153
  520   3HG1  VAL  72          3HG1      VAL  72   1.718  -1.214  -8.325
  521   1HG2  VAL  72          3HG2      VAL  72  -1.752  -1.970  -8.955
  522   2HG2  VAL  72          2HG2      VAL  72  -1.035  -3.536  -9.321
  523   3HG2  VAL  72          1HG2      VAL  72  -0.534  -2.647  -7.882
  524    H    ILE  73             H      ILE  73   0.489   1.019 -11.285
  525    HA   ILE  73            HA      ILE  73   2.825   0.244 -12.789
  526    HB   ILE  73            HB      ILE  73   0.756   2.148 -13.672
  527   1HG1  ILE  73          2HG1      ILE  73   2.169   0.447 -15.612
  528   2HG1  ILE  73          1HG1      ILE  73   1.323  -0.462 -14.359
  529   1HG2  ILE  73          1HG2      ILE  73   3.641   2.420 -14.043
  530   2HG2  ILE  73          3HG2      ILE  73   2.723   2.462 -15.548
  531   3HG2  ILE  73          2HG2      ILE  73   2.376   3.626 -14.270
  532   1HD1  ILE  73          1HD1      ILE  73  -0.772   0.809 -14.914
  533   2HD1  ILE  73          3HD1      ILE  73   0.096   1.595 -16.233
  534   3HD1  ILE  73          2HD1      ILE  73  -0.185  -0.158 -16.288
  535    NH1  ARG  74           NH1      ARG  74   9.664   4.623 -10.816
  536    NH2  ARG  74           NH2      ARG  74   9.811   4.094  -8.624
  537    H    ARG  74             H      ARG  74   3.564   0.578 -10.725
  538    HA   ARG  74            HA      ARG  74   5.223   1.602  -9.402
  539   1HB   ARG  74           2HB      ARG  74   4.692   3.732 -11.179
  540   2HB   ARG  74           1HB      ARG  74   4.360   4.389  -9.573
  541   1HG   ARG  74           2HG      ARG  74   6.584   3.469  -8.831
  542   2HG   ARG  74           1HG      ARG  74   6.904   3.025 -10.505
  543   1HD   ARG  74           2HD      ARG  74   7.076   5.242 -11.206
  544   2HD   ARG  74           1HD      ARG  74   6.104   5.843  -9.860
  545    HE   ARG  74            HE      ARG  74   8.113   6.087  -8.669
  546   1HH1  ARG  74          2HH1      ARG  74   9.192   5.088 -11.565
  547   2HH1  ARG  74          1HH1      ARG  74  10.497   4.099 -10.998
  548   1HH2  ARG  74          1HH2      ARG  74   9.455   4.156  -7.694
  549   2HH2  ARG  74          2HH2      ARG  74  10.638   3.561  -8.810
  550    H    ASP  75             H      ASP  75   4.257   0.636  -7.694
  551    HA   ASP  75            HA      ASP  75   1.873   1.814  -6.531
  552   1HB   ASP  75           2HB      ASP  75   1.717  -0.502  -6.537
  553   2HB   ASP  75           1HB      ASP  75   3.368  -0.693  -6.056
  554    H    SER  76             H      SER  76   2.369   3.711  -5.602
  555    HA   SER  76            HA      SER  76   4.340   3.639  -3.364
  556   1HB   SER  76           2HB      SER  76   4.286   5.547  -5.277
  557   2HB   SER  76           1HB      SER  76   3.082   6.219  -4.188
  558    HG   SER  76            HG      SER  76   5.798   5.674  -3.778
  559    H    LEU  77             H      LEU  77   1.266   2.868  -3.876
  560    HA   LEU  77            HA      LEU  77  -0.609   4.252  -2.433
  561   1HB   LEU  77           2HB      LEU  77  -0.721   1.970  -3.665
  562   2HB   LEU  77           1HB      LEU  77  -0.242   1.265  -2.122
  563    HG   LEU  77            HG      LEU  77  -2.208   2.227  -1.034
  564   1HD1  LEU  77          1HD1      LEU  77  -2.628   3.468  -3.762
  565   2HD1  LEU  77          3HD1      LEU  77  -3.964   3.255  -2.631
  566   3HD1  LEU  77          2HD1      LEU  77  -2.592   4.272  -2.192
  567   1HD2  LEU  77          2HD2      LEU  77  -2.170   0.114  -2.816
  568   2HD2  LEU  77          1HD2      LEU  77  -3.529   0.507  -1.757
  569   3HD2  LEU  77          3HD2      LEU  77  -3.515   1.079  -3.425
  570    H    LEU  78             H      LEU  78   2.137   2.542  -1.034
  571    HA   LEU  78            HA      LEU  78   0.962   3.074   1.578
  572   1HB   LEU  78           2HB      LEU  78   3.220   1.403   0.829
  573   2HB   LEU  78           1HB      LEU  78   2.752   1.631   2.478
  574    HG   LEU  78            HG      LEU  78   0.596   0.852   0.547
  575   1HD1  LEU  78          2HD1      LEU  78   2.602  -0.653   0.022
  576   2HD1  LEU  78          1HD1      LEU  78   2.388  -1.310   1.643
  577   3HD1  LEU  78          3HD1      LEU  78   1.076  -1.464   0.456
  578   1HD2  LEU  78          1HD2      LEU  78   1.312   0.094   3.391
  579   2HD2  LEU  78          3HD2      LEU  78   0.017   1.171   2.863
  580   3HD2  LEU  78          2HD2      LEU  78  -0.082  -0.560   2.519
  581    H    GLN  79             H      GLN  79   1.390   4.844   2.504
  582    HA   GLN  79            HA      GLN  79   2.681   6.962   1.706
  583   1HB   GLN  79           2HB      GLN  79   2.354   7.925   3.943
  584   2HB   GLN  79           1HB      GLN  79   0.925   7.047   3.414
  585   1HG   GLN  79           2HG      GLN  79   1.989   5.042   4.674
  586   2HG   GLN  79           1HG      GLN  79   2.952   6.283   5.474
  587   1HE2  GLN  79          2HE2      GLN  79  -0.764   5.698   6.765
  588   2HE2  GLN  79          1HE2      GLN  79   0.106   4.586   5.823
  589    H    ASP  80             H      ASP  80   4.536   6.203   1.006
  590    HA   ASP  80            HA      ASP  80   6.802   6.226   2.952
  591   1HB   ASP  80           2HB      ASP  80   6.641   4.430   1.067
  592   2HB   ASP  80           1HB      ASP  80   6.989   5.761  -0.038
  593    H    GLY  81             H      GLY  81   4.853   8.430   2.018
  594   1HA   GLY  81           2HA      GLY  81   5.311  10.778   1.910
  595   2HA   GLY  81           1HA      GLY  81   6.811  10.403   1.050
  596    H    GLU  82             H      GLU  82   3.827   8.653   0.249
  597    HA   GLU  82            HA      GLU  82   3.330  10.257  -2.133
  598   1HB   GLU  82           2HB      GLU  82   4.606   7.638  -1.995
  599   2HB   GLU  82           1HB      GLU  82   3.460   7.916  -3.262
  600   1HG   GLU  82           2HG      GLU  82   5.243   8.690  -4.400
  601   2HG   GLU  82           1HG      GLU  82   4.913  10.176  -3.487
  602    H    PHE  83             H      PHE  83   2.530   6.987  -0.987
  603    HA   PHE  83            HA      PHE  83   0.541   5.747  -0.959
  604   1HB   PHE  83           2HB      PHE  83  -1.580   7.503  -0.992
  605   2HB   PHE  83           1HB      PHE  83  -0.963   6.629   0.351
  606    HD1  PHE  83           HD1      PHE  83   0.995   7.723   1.598
  607    HD2  PHE  83           HD2      PHE  83  -1.632   9.860  -0.980
  608    HE1  PHE  83           HE1      PHE  83   1.646   9.842   2.731
  609    HE2  PHE  83           HE2      PHE  83  -1.006  11.993   0.126
  610    HZ   PHE  83            HZ      PHE  83   0.634  11.987   1.989
  611    H    SER  84             H      SER  84   1.312   7.652  -3.632
  612    HA   SER  84            HA      SER  84  -1.223   7.151  -5.068
  613   1HB   SER  84           2HB      SER  84  -0.022   8.433  -6.904
  614   2HB   SER  84           1HB      SER  84  -0.371   9.331  -5.424
  615    HG   SER  84            HG      SER  84   2.094   7.994  -5.950
  616    H    MET  85             H      MET  85  -1.505   5.610  -6.451
  617    HA   MET  85            HA      MET  85   0.810   3.919  -7.371
  618   1HB   MET  85           2HB      MET  85  -0.266   2.997  -5.397
  619   2HB   MET  85           1HB      MET  85  -1.814   3.266  -6.119
  620   1HG   MET  85           2HG      MET  85  -1.184   1.583  -7.862
  621   2HG   MET  85           1HG      MET  85   0.163   1.175  -6.831
  622   1HE   MET  85           3HE      MET  85  -0.206  -0.924  -6.345
  623   2HE   MET  85           2HE      MET  85  -1.361  -1.606  -5.211
  624   3HE   MET  85           1HE      MET  85  -1.802  -1.448  -6.915
  625    H    ASP  86             H      ASP  86   0.613   3.379  -9.621
  626    HA   ASP  86            HA      ASP  86  -1.819   4.552 -11.016
  627   1HB   ASP  86           2HB      ASP  86   0.936   3.855 -11.847
  628   2HB   ASP  86           1HB      ASP  86  -0.321   4.003 -13.051
  629    H    LEU  87             H      LEU  87  -3.311   2.668 -10.583
  630    HA   LEU  87            HA      LEU  87  -2.492   0.267 -12.095
  631   1HB   LEU  87           2HB      LEU  87  -4.716  -0.715 -11.079
  632   2HB   LEU  87           1HB      LEU  87  -3.208  -0.766 -10.242
  633    HG   LEU  87            HG      LEU  87  -4.975  -0.178  -8.727
  634   1HD1  LEU  87          2HD1      LEU  87  -2.634   1.217  -8.986
  635   2HD1  LEU  87          1HD1      LEU  87  -3.846   2.469  -8.732
  636   3HD1  LEU  87          3HD1      LEU  87  -3.683   1.160  -7.582
  637   1HD2  LEU  87          3HD2      LEU  87  -6.207   1.024 -10.747
  638   2HD2  LEU  87          2HD2      LEU  87  -6.549   1.434  -9.062
  639   3HD2  LEU  87          1HD2      LEU  87  -5.460   2.442 -10.012
  640    NH1  ARG  88           NH2      ARG  88   0.829   3.238 -18.322
  641    NH2  ARG  88           NH1      ARG  88   0.175   2.443 -20.335
  642    H    ARG  88             H      ARG  88  -2.851   0.344 -14.097
  643    HA   ARG  88            HA      ARG  88  -5.394   1.749 -14.989
  644   1HB   ARG  88           2HB      ARG  88  -4.296   2.639 -16.843
  645   2HB   ARG  88           1HB      ARG  88  -2.952   2.553 -15.728
  646   1HG   ARG  88           2HG      ARG  88  -2.144   0.487 -16.815
  647   2HG   ARG  88           1HG      ARG  88  -3.578   0.415 -17.853
  648   1HD   ARG  88           2HD      ARG  88  -2.673   1.845 -19.329
  649   2HD   ARG  88           1HD      ARG  88  -2.308   3.035 -18.049
  650    HE   ARG  88            HE      ARG  88  -0.439   0.788 -18.071
  651   1HH1  ARG  88          1HH2      ARG  88   0.759   3.230 -17.324
  652   2HH1  ARG  88          2HH2      ARG  88   1.475   3.856 -18.773
  653   1HH2  ARG  88          2HH1      ARG  88  -0.398   1.830 -20.878
  654   2HH2  ARG  88          1HH1      ARG  88   0.821   3.055 -20.788
  655    H    THR  89             H      THR  89  -6.897   0.698 -16.087
  656    HA   THR  89            HA      THR  89  -6.937  -2.122 -16.488
  657    HB   THR  89            HB      THR  89  -9.025  -1.778 -17.533
  658    HG1  THR  89           HG1      THR  89  -9.282  -0.516 -19.134
  659   1HG2  THR  89          2HG2      THR  89  -8.692  -0.397 -15.286
  660   2HG2  THR  89          1HG2      THR  89  -9.050   0.950 -16.370
  661   3HG2  THR  89          3HG2      THR  89 -10.218  -0.358 -16.168
  662    H    LYS  90             H      LYS  90  -4.931  -2.667 -17.614
  663    HA   LYS  90            HA      LYS  90  -4.290  -1.354 -20.046
  664   1HB   LYS  90           2HB      LYS  90  -2.987  -3.936 -19.416
  665   2HB   LYS  90           1HB      LYS  90  -2.337  -2.438 -20.019
  666   1HG   LYS  90           2HG      LYS  90  -2.730  -1.464 -17.719
  667   2HG   LYS  90           1HG      LYS  90  -2.890  -3.149 -17.172
  668   1HD   LYS  90           2HD      LYS  90  -0.587  -2.569 -19.033
  669   2HD   LYS  90           1HD      LYS  90  -0.444  -1.884 -17.423
  670   1HE   LYS  90           2HE      LYS  90   0.182  -3.900 -16.635
  671   2HE   LYS  90           1HE      LYS  90  -1.378  -4.564 -17.115
  672   1HZ   LYS  90           1HZ      LYS  90  -0.426  -4.830 -19.388
  673   2HZ   LYS  90           3HZ      LYS  90   1.090  -4.398 -18.761
  674   3HZ   LYS  90           2HZ      LYS  90   0.312  -5.805 -18.208
  675    H    SER  91             H      SER  91  -4.184  -2.358 -22.032
  676    HA   SER  91            HA      SER  91  -6.363  -4.283 -22.534
  677   1HB   SER  91           2HB      SER  91  -6.757  -2.535 -23.972
  678   2HB   SER  91           1HB      SER  91  -5.102  -2.078 -24.054
  679    HG   SER  91            HG      SER  91  -4.722  -3.689 -25.541
  680    H    THR  92             H      THR  92  -5.829  -5.705 -24.618
  681    HA   THR  92            HA      THR  92  -3.034  -6.699 -24.585
  682    HB   THR  92            HB      THR  92  -3.674  -8.988 -24.026
  683    HG1  THR  92           HG1      THR  92  -5.801  -9.466 -23.524
  684   1HG2  THR  92          2HG2      THR  92  -3.212  -7.261 -22.209
  685   2HG2  THR  92          1HG2      THR  92  -4.960  -7.151 -21.998
  686   3HG2  THR  92          3HG2      THR  92  -4.131  -8.678 -21.699
  687    H    GLY  93             H      GLY  93  -2.770  -6.313 -26.772
  688   1HA   GLY  93           2HA      GLY  93  -2.730  -7.266 -28.978
  689   2HA   GLY  93           1HA      GLY  93  -4.203  -8.151 -28.599
  690    H    GLY  94             H      GLY  94  -3.934  -4.662 -28.012
  691   1HA   GLY  94           2HA      GLY  94  -4.606  -2.951 -29.680
  692   2HA   GLY  94           1HA      GLY  94  -5.637  -4.162 -30.429
  693    H    ALA  95             H      ALA  95  -6.380  -4.928 -27.444
  694    HA   ALA  95            HA      ALA  95  -8.933  -3.711 -27.313
  695   1HB   ALA  95           2HB      ALA  95  -7.552  -5.512 -25.733
  696   2HB   ALA  95           1HB      ALA  95  -7.717  -4.121 -24.660
  697   3HB   ALA  95           3HB      ALA  95  -9.152  -4.861 -25.374
  698    HA   PRO  96            HA      PRO  96  -8.261   0.343 -25.762
  699   1HB   PRO  96           2HB      PRO  96 -10.616   0.754 -24.468
  700   2HB   PRO  96           1HB      PRO  96 -10.524   0.542 -26.229
  701   1HG   PRO  96           2HG      PRO  96 -11.555  -1.380 -24.184
  702   2HG   PRO  96           1HG      PRO  96 -11.907  -1.291 -25.916
  703   1HD   PRO  96           2HD      PRO  96 -10.060  -3.056 -24.614
  704   2HD   PRO  96           1HD      PRO  96 -10.406  -2.909 -26.349
  705    H    THR  97             H      THR  97  -7.274   1.354 -23.984
  706    HA   THR  97            HA      THR  97  -7.284  -0.147 -21.383
  707    HB   THR  97            HB      THR  97  -5.298   1.274 -20.815
  708    HG1  THR  97           HG1      THR  97  -5.613   3.065 -22.028
  709   1HG2  THR  97          3HG2      THR  97  -5.404  -0.891 -22.519
  710   2HG2  THR  97          2HG2      THR  97  -4.449   0.272 -23.435
  711   3HG2  THR  97          1HG2      THR  97  -3.937  -0.210 -21.811
  712    H    PHE  98             H      PHE  98  -7.159   1.311 -19.444
  713    HA   PHE  98            HA      PHE  98  -8.367   3.981 -19.606
  714   1HB   PHE  98           2HB      PHE  98  -9.703   1.707 -18.057
  715   2HB   PHE  98           1HB      PHE  98 -10.176   3.409 -17.996
  716    HD1  PHE  98           HD1      PHE  98 -10.399   4.479 -20.491
  717    HD2  PHE  98           HD2      PHE  98 -11.014   0.359 -19.472
  718    HE1  PHE  98           HE1      PHE  98 -11.791   4.199 -22.515
  719    HE2  PHE  98           HE2      PHE  98 -12.403   0.063 -21.520
  720    HZ   PHE  98            HZ      PHE  98 -12.793   1.992 -23.032
  721    H    ASN  99             H      ASN  99  -7.512   5.215 -17.813
  722    HA   ASN  99            HA      ASN  99  -5.701   3.565 -16.080
  723   1HB   ASN  99           2HB      ASN  99  -5.174   6.489 -16.529
  724   2HB   ASN  99           1HB      ASN  99  -4.039   5.204 -16.103
  725   1HD2  ASN  99          1HD2      ASN  99  -3.542   6.953 -18.322
  726   2HD2  ASN  99          2HD2      ASN  99  -3.600   6.034 -19.747
  727    H    VAL 100             H      VAL 100  -5.557   3.805 -13.960
  728    HA   VAL 100            HA      VAL 100  -7.471   5.625 -12.573
  729    HB   VAL 100            HB      VAL 100  -6.669   2.917 -11.495
  730   1HG1  VAL 100          1HG1      VAL 100  -7.814   4.676 -10.134
  731   2HG1  VAL 100          3HG1      VAL 100  -9.212   4.467 -11.171
  732   3HG1  VAL 100          2HG1      VAL 100  -8.645   3.121 -10.206
  733   1HG2  VAL 100          2HG2      VAL 100  -8.979   3.439 -13.408
  734   2HG2  VAL 100          1HG2      VAL 100  -7.580   2.420 -13.733
  735   3HG2  VAL 100          3HG2      VAL 100  -8.746   1.949 -12.498
  736    H    THR 101             H      THR 101  -6.604   6.484 -10.659
  737    HA   THR 101            HA      THR 101  -3.850   5.713  -9.896
  738    HB   THR 101            HB      THR 101  -5.170   8.444  -9.583
  739    HG1  THR 101           HG1      THR 101  -2.874   7.754 -11.085
  740   1HG2  THR 101          1HG2      THR 101  -3.019   7.171  -8.141
  741   2HG2  THR 101          3HG2      THR 101  -2.364   8.498  -9.099
  742   3HG2  THR 101          2HG2      THR 101  -3.656   8.802  -7.949
  743    H    VAL 102             H      VAL 102  -3.725   5.131  -7.754
  744    HA   VAL 102            HA      VAL 102  -6.184   5.358  -6.151
  745    HB   VAL 102            HB      VAL 102  -4.442   3.060  -6.933
  746   1HG1  VAL 102          3HG1      VAL 102  -5.264   3.542  -4.098
  747   2HG1  VAL 102          2HG1      VAL 102  -5.704   1.960  -4.739
  748   3HG1  VAL 102          1HG1      VAL 102  -4.021   2.472  -4.735
  749   1HG2  VAL 102          2HG2      VAL 102  -7.328   3.503  -6.244
  750   2HG2  VAL 102          1HG2      VAL 102  -6.611   3.290  -7.843
  751   3HG2  VAL 102          3HG2      VAL 102  -6.650   1.938  -6.712
  752    H    THR 103             H      THR 103  -5.888   6.663  -4.539
  753    HA   THR 103            HA      THR 103  -3.180   7.027  -3.330
  754    HB   THR 103            HB      THR 103  -4.255   9.105  -2.337
  755    HG1  THR 103           HG1      THR 103  -6.124   9.744  -3.188
  756   1HG2  THR 103          1HG2      THR 103  -3.490   8.556  -5.142
  757   2HG2  THR 103          3HG2      THR 103  -4.260  10.107  -4.830
  758   3HG2  THR 103          2HG2      THR 103  -2.773   9.669  -3.976
  759    H    LYS 104             H      LYS 104  -2.874   6.158  -1.339
  760    HA   LYS 104            HA      LYS 104  -5.166   5.233   0.275
  761   1HB   LYS 104           2HB      LYS 104  -3.275   3.694  -0.259
  762   2HB   LYS 104           1HB      LYS 104  -2.221   4.773   0.627
  763   1HG   LYS 104           2HG      LYS 104  -2.762   3.122   2.214
  764   2HG   LYS 104           1HG      LYS 104  -3.841   4.459   2.605
  765   1HD   LYS 104           2HD      LYS 104  -5.345   2.727   2.550
  766   2HD   LYS 104           1HD      LYS 104  -5.421   3.258   0.879
  767   1HE   LYS 104           2HE      LYS 104  -5.172   0.800   0.996
  768   2HE   LYS 104           1HE      LYS 104  -3.758   1.537   0.249
  769   1HZ   LYS 104           2HZ      LYS 104  -3.637   1.251   3.140
  770   2HZ   LYS 104           1HZ      LYS 104  -3.635  -0.204   2.264
  771   3HZ   LYS 104           3HZ      LYS 104  -2.446   0.965   1.963
  772    H    THR 105             H      THR 105  -5.694   6.188   2.141
  773    HA   THR 105            HA      THR 105  -3.977   8.392   3.187
  774    HB   THR 105            HB      THR 105  -5.989   9.139   4.391
  775    HG1  THR 105           HG1      THR 105  -7.669   7.899   4.609
  776   1HG2  THR 105          1HG2      THR 105  -5.971   8.742   1.472
  777   2HG2  THR 105          3HG2      THR 105  -7.563   9.075   2.158
  778   3HG2  THR 105          2HG2      THR 105  -6.234  10.217   2.409
  779    H    ASP 106             H      ASP 106  -5.447   7.985   5.889
  780    HA   ASP 106            HA      ASP 106  -3.707   5.773   6.834
  781   1HB   ASP 106           2HB      ASP 106  -3.662   8.106   7.878
  782   2HB   ASP 106           1HB      ASP 106  -5.232   7.709   8.568
  783    H    LYS 107             H      LYS 107  -6.956   6.298   5.951
  784    HA   LYS 107            HA      LYS 107  -7.805   3.778   7.223
  785   1HB   LYS 107           2HB      LYS 107  -8.995   6.470   7.908
  786   2HB   LYS 107           1HB      LYS 107  -9.862   4.972   8.165
  787   1HG   LYS 107           2HG      LYS 107  -7.791   4.184   9.427
  788   2HG   LYS 107           1HG      LYS 107  -7.310   5.873   9.424
  789   1HD   LYS 107           2HD      LYS 107  -9.681   6.340  10.362
  790   2HD   LYS 107           1HD      LYS 107  -9.718   4.616  10.729
  791   1HE   LYS 107           2HE      LYS 107  -7.853   4.783  12.197
  792   2HE   LYS 107           1HE      LYS 107  -7.430   6.387  11.600
  793   1HZ   LYS 107           1HZ      LYS 107  -9.964   5.764  13.012
  794   2HZ   LYS 107           3HZ      LYS 107  -8.585   6.384  13.778
  795   3HZ   LYS 107           2HZ      LYS 107  -9.377   7.301  12.587
  796    H    THR 108             H      THR 108  -7.657   5.363   4.422
  797    HA   THR 108            HA      THR 108 -10.275   4.338   3.499
  798    HB   THR 108            HB      THR 108 -10.945   6.381   2.510
  799    HG1  THR 108           HG1      THR 108  -9.192   7.237   1.596
  800   1HG2  THR 108          2HG2      THR 108 -11.026   6.212   5.082
  801   2HG2  THR 108          1HG2      THR 108  -9.611   7.288   5.085
  802   3HG2  THR 108          3HG2      THR 108 -11.145   7.843   4.404
  803    H    LEU 109             H      LEU 109 -10.322   4.126   1.168
  804    HA   LEU 109            HA      LEU 109  -7.690   3.779  -0.144
  805   1HB   LEU 109           2HB      LEU 109  -9.350   1.789   0.627
  806   2HB   LEU 109           1HB      LEU 109 -10.078   2.123  -0.921
  807    HG   LEU 109            HG      LEU 109  -8.021   0.364  -0.436
  808   1HD1  LEU 109          2HD1      LEU 109  -9.336   1.503  -2.757
  809   2HD1  LEU 109          1HD1      LEU 109  -7.773   0.753  -3.094
  810   3HD1  LEU 109          3HD1      LEU 109  -9.048  -0.180  -2.314
  811   1HD2  LEU 109          3HD2      LEU 109  -6.818   2.840  -1.619
  812   2HD2  LEU 109          2HD2      LEU 109  -6.306   1.947  -0.198
  813   3HD2  LEU 109          1HD2      LEU 109  -6.107   1.240  -1.789
  814    H    VAL 110             H      VAL 110  -7.996   6.003  -1.125
  815    HA   VAL 110            HA      VAL 110 -10.454   6.567  -2.552
  816    HB   VAL 110            HB      VAL 110  -7.822   7.995  -2.085
  817   1HG1  VAL 110          2HG1      VAL 110  -9.663   8.461  -4.397
  818   2HG1  VAL 110          1HG1      VAL 110  -8.955   9.854  -3.594
  819   3HG1  VAL 110          3HG1      VAL 110  -7.919   8.633  -4.317
  820   1HG2  VAL 110          2HG2      VAL 110 -10.715   8.324  -1.421
  821   2HG2  VAL 110          1HG2      VAL 110  -9.284   8.753  -0.469
  822   3HG2  VAL 110          3HG2      VAL 110  -9.841   9.829  -1.762
  823    H    LEU 111             H      LEU 111 -10.832   6.378  -4.704
  824    HA   LEU 111            HA      LEU 111  -8.708   5.290  -6.445
  825   1HB   LEU 111           2HB      LEU 111 -11.694   4.642  -6.499
  826   2HB   LEU 111           1HB      LEU 111 -10.564   4.150  -7.753
  827    HG   LEU 111            HG      LEU 111  -9.796   3.510  -5.034
  828   1HD1  LEU 111          3HD1      LEU 111 -12.117   2.125  -6.306
  829   2HD1  LEU 111          2HD1      LEU 111 -11.244   1.517  -4.901
  830   3HD1  LEU 111          1HD1      LEU 111 -12.136   3.024  -4.801
  831   1HD2  LEU 111          2HD2      LEU 111  -8.918   2.738  -7.486
  832   2HD2  LEU 111          1HD2      LEU 111  -8.667   1.742  -6.049
  833   3HD2  LEU 111          3HD2      LEU 111 -10.022   1.411  -7.135
  834    H    LEU 112             H      LEU 112  -8.519   6.311  -8.336
  835    HA   LEU 112            HA      LEU 112 -10.428   8.474  -8.961
  836   1HB   LEU 112           2HB      LEU 112  -8.036   9.133  -8.185
  837   2HB   LEU 112           1HB      LEU 112  -7.528   8.550  -9.742
  838    HG   LEU 112            HG      LEU 112  -7.832  10.768 -10.298
  839   1HD1  LEU 112          3HD1      LEU 112 -10.715   9.766 -10.448
  840   2HD1  LEU 112          2HD1      LEU 112 -10.120  11.237 -11.236
  841   3HD1  LEU 112          1HD1      LEU 112  -9.508   9.663 -11.737
  842   1HD2  LEU 112          3HD2      LEU 112  -9.760  10.757  -8.008
  843   2HD2  LEU 112          2HD2      LEU 112  -8.244  11.642  -8.181
  844   3HD2  LEU 112          1HD2      LEU 112  -9.664  12.128  -9.110
  845    H    MET 113             H      MET 113 -11.531   7.361 -10.496
  846    HA   MET 113            HA      MET 113  -9.960   5.669 -12.387
  847   1HB   MET 113           2HB      MET 113 -12.321   5.170 -11.355
  848   2HB   MET 113           1HB      MET 113 -12.845   6.116 -12.709
  849   1HG   MET 113           2HG      MET 113 -10.869   3.980 -13.236
  850   2HG   MET 113           1HG      MET 113 -12.544   3.511 -12.960
  851   1HE   MET 113           3HE      MET 113 -13.051   2.503 -14.910
  852   2HE   MET 113           2HE      MET 113 -14.404   3.629 -14.875
  853   3HE   MET 113           1HE      MET 113 -13.570   3.318 -16.394
  854    H    GLY 114             H      GLY 114  -9.811   5.980 -14.507
  855   1HA   GLY 114           2HA      GLY 114 -10.846   8.472 -15.661
  856   2HA   GLY 114           1HA      GLY 114  -9.120   8.191 -15.693
  857    H    LYS 115             H      LYS 115 -11.060   8.405 -17.826
  858    HA   LYS 115            HA      LYS 115 -10.456   5.959 -19.283
  859   1HB   LYS 115           2HB      LYS 115 -13.051   7.445 -19.201
  860   2HB   LYS 115           1HB      LYS 115 -12.576   6.534 -20.633
  861   1HG   LYS 115           2HG      LYS 115 -12.006   4.676 -18.782
  862   2HG   LYS 115           1HG      LYS 115 -13.281   5.522 -17.919
  863   1HD   LYS 115           2HD      LYS 115 -14.890   5.053 -19.605
  864   2HD   LYS 115           1HD      LYS 115 -13.645   4.643 -20.781
  865   1HE   LYS 115           2HE      LYS 115 -13.634   2.485 -20.116
  866   2HE   LYS 115           1HE      LYS 115 -13.405   2.948 -18.431
  867   1HZ   LYS 115           2HZ      LYS 115 -16.053   3.250 -19.682
  868   2HZ   LYS 115           1HZ      LYS 115 -15.551   1.717 -19.149
  869   3HZ   LYS 115           3HZ      LYS 115 -15.653   3.002 -18.048
  870    H    GLU 116             H      GLU 116 -10.367   6.424 -21.615
  871    HA   GLU 116            HA      GLU 116  -8.438   7.726 -22.702
  872   1HB   GLU 116           2HB      GLU 116 -10.258   6.802 -23.657
  873   2HB   GLU 116           1HB      GLU 116 -11.086   8.290 -23.591
  874   1HG   GLU 116           2HG      GLU 116  -9.706   9.272 -25.220
  875   2HG   GLU 116           1HG      GLU 116  -8.401   8.132 -24.899
  876    H    GLY 117             H      GLY 117  -7.655   9.509 -23.584
  877   1HA   GLY 117           2HA      GLY 117  -7.072  11.803 -23.671
  878   2HA   GLY 117           1HA      GLY 117  -8.645  12.199 -22.913
  879    H    VAL 118             H      VAL 118  -7.186   9.377 -21.647
  880    HA   VAL 118            HA      VAL 118  -6.650  10.634 -19.104
  881    HB   VAL 118            HB      VAL 118  -8.389   8.843 -19.812
  882   1HG1  VAL 118          3HG1      VAL 118  -6.858   7.239 -20.785
  883   2HG1  VAL 118          2HG1      VAL 118  -6.106   6.992 -19.204
  884   3HG1  VAL 118          1HG1      VAL 118  -7.819   6.582 -19.448
  885   1HG2  VAL 118          3HG2      VAL 118  -6.931   9.374 -17.334
  886   2HG2  VAL 118          2HG2      VAL 118  -8.638   8.983 -17.538
  887   3HG2  VAL 118          1HG2      VAL 118  -7.446   7.671 -17.345
  888    H    HIS 119             H      HIS 119  -4.558  11.220 -18.996
  889    HA   HIS 119            HA      HIS 119  -2.388   9.530 -20.025
  890   1HB   HIS 119           2HB      HIS 119  -1.997  11.913 -20.152
  891   2HB   HIS 119           1HB      HIS 119  -2.477  12.151 -18.477
  892    HD1  HIS 119           HD1      HIS 119  -0.480  12.641 -17.085
  893    HD2  HIS 119           HD2      HIS 119   0.380   9.828 -20.035
  894    HE1  HIS 119           HE1      HIS 119   1.939  11.970 -16.752
  895    H    GLY 120             H      GLY 120  -3.985  10.312 -16.975
  896   1HA   GLY 120           2HA      GLY 120  -4.112   8.842 -15.080
  897   2HA   GLY 120           1HA      GLY 120  -2.682   7.990 -15.678
  898    H    GLY 121             H      GLY 121  -1.540  10.904 -16.179
  899   1HA   GLY 121           2HA      GLY 121  -0.163  11.089 -13.589
  900   2HA   GLY 121           1HA      GLY 121   0.216  12.023 -15.037
  901    H    LEU 122             H      LEU 122  -2.561  12.896 -15.450
  902    HA   LEU 122            HA      LEU 122  -2.591  15.185 -13.598
  903   1HB   LEU 122           2HB      LEU 122  -4.976  14.644 -15.358
  904   2HB   LEU 122           1HB      LEU 122  -4.163  16.167 -15.029
  905    HG   LEU 122            HG      LEU 122  -2.361  14.497 -16.520
  906   1HD1  LEU 122          3HD1      LEU 122  -4.554  13.366 -17.162
  907   2HD1  LEU 122          2HD1      LEU 122  -4.987  14.884 -17.951
  908   3HD1  LEU 122          1HD1      LEU 122  -3.576  13.976 -18.497
  909   1HD2  LEU 122          1HD2      LEU 122  -2.910  17.117 -16.364
  910   2HD2  LEU 122          3HD2      LEU 122  -2.091  16.414 -17.760
  911   3HD2  LEU 122          2HD2      LEU 122  -3.825  16.731 -17.819
  912    H    ILE 123             H      ILE 123  -4.265  12.139 -14.153
  913    HA   ILE 123            HA      ILE 123  -6.389  12.558 -12.230
  914    HB   ILE 123            HB      ILE 123  -5.107  10.200 -13.579
  915   1HG1  ILE 123          2HG1      ILE 123  -7.863  11.492 -13.803
  916   2HG1  ILE 123          1HG1      ILE 123  -6.547  11.658 -14.968
  917   1HG2  ILE 123          3HG2      ILE 123  -6.103   9.643 -11.160
  918   2HG2  ILE 123          2HG2      ILE 123  -7.636   9.816 -11.983
  919   3HG2  ILE 123          1HG2      ILE 123  -6.507   8.595 -12.516
  920   1HD1  ILE 123          2HD1      ILE 123  -6.593   9.230 -15.333
  921   2HD1  ILE 123          1HD1      ILE 123  -7.943   9.093 -14.209
  922   3HD1  ILE 123          3HD1      ILE 123  -8.138   9.987 -15.714
  923    H    ASN 124             H      ASN 124  -3.101  11.285 -12.252
  924    HA   ASN 124            HA      ASN 124  -3.045  10.333  -9.559
  925   1HB   ASN 124           2HB      ASN 124  -1.360   9.769 -11.334
  926   2HB   ASN 124           1HB      ASN 124  -0.766  11.428 -11.210
  927   1HD2  ASN 124          2HD2      ASN 124   0.755  10.917  -8.007
  928   2HD2  ASN 124          1HD2      ASN 124   0.069  12.098  -9.015
  929    H    LYS 125             H      LYS 125  -2.873  13.483 -11.084
  930    HA   LYS 125            HA      LYS 125  -1.740  14.799  -8.626
  931   1HB   LYS 125           2HB      LYS 125  -1.460  16.678 -10.004
  932   2HB   LYS 125           1HB      LYS 125  -1.599  15.474 -11.285
  933   1HG   LYS 125           2HG      LYS 125  -3.101  17.033 -12.045
  934   2HG   LYS 125           1HG      LYS 125  -4.136  16.057 -11.054
  935   1HD   LYS 125           2HD      LYS 125  -4.692  18.116 -10.214
  936   2HD   LYS 125           1HD      LYS 125  -3.375  17.655  -9.131
  937   1HE   LYS 125           2HE      LYS 125  -1.958  18.778 -11.161
  938   2HE   LYS 125           1HE      LYS 125  -3.445  19.725 -11.255
  939   1HZ   LYS 125           3HZ      LYS 125  -3.234  20.123  -8.841
  940   2HZ   LYS 125           2HZ      LYS 125  -1.726  19.342  -8.864
  941   3HZ   LYS 125           1HZ      LYS 125  -1.954  20.782  -9.736
  942    H    LYS 126             H      LYS 126  -4.834  14.314 -10.237
  943    HA   LYS 126            HA      LYS 126  -6.423  15.938  -8.392
  944   1HB   LYS 126           2HB      LYS 126  -6.978  14.261 -10.810
  945   2HB   LYS 126           1HB      LYS 126  -8.305  14.519  -9.679
  946   1HG   LYS 126           2HG      LYS 126  -8.643  16.455 -10.819
  947   2HG   LYS 126           1HG      LYS 126  -7.268  17.058  -9.901
  948   1HD   LYS 126           2HD      LYS 126  -6.937  17.517 -12.283
  949   2HD   LYS 126           1HD      LYS 126  -5.769  16.345 -11.742
  950   1HE   LYS 126           2HE      LYS 126  -6.456  14.905 -13.316
  951   2HE   LYS 126           1HE      LYS 126  -8.063  14.908 -12.612
  952   1HZ   LYS 126           2HZ      LYS 126  -8.466  17.014 -13.853
  953   2HZ   LYS 126           1HZ      LYS 126  -6.987  16.767 -14.647
  954   3HZ   LYS 126           3HZ      LYS 126  -8.243  15.655 -14.840
  955    H    CYS 127             H      CYS 127  -5.091  12.815  -8.346
  956    HA   CYS 127            HA      CYS 127  -7.100  11.604  -6.565
  957   1HB   CYS 127           2HB      CYS 127  -5.645  10.336  -8.342
  958   2HB   CYS 127           1HB      CYS 127  -4.365  10.466  -7.155
  959    HG   CYS 127            HG      CYS 127  -6.499   8.422  -7.044
  960    OH   TYR 128            OH      TYR 128   2.620  14.042  -2.168
  961    H    TYR 128             H      TYR 128  -3.916  13.044  -6.675
  962    HA   TYR 128            HA      TYR 128  -3.106  12.613  -3.971
  963   1HB   TYR 128           2HB      TYR 128  -1.945  13.590  -6.209
  964   2HB   TYR 128           1HB      TYR 128  -2.410  15.112  -5.481
  965    HD1  TYR 128           HD1      TYR 128  -1.822  13.152  -2.647
  966    HD2  TYR 128           HD2      TYR 128   0.262  14.909  -5.980
  967    HE1  TYR 128           HE1      TYR 128   0.275  13.156  -1.323
  968    HE2  TYR 128           HE2      TYR 128   2.364  14.910  -4.648
  969    HH   TYR 128            HH      TYR 128   2.845  14.956  -1.977
  970    H    GLU 129             H      GLU 129  -5.150  14.992  -5.659
  971    HA   GLU 129            HA      GLU 129  -5.460  16.739  -3.301
  972   1HB   GLU 129           2HB      GLU 129  -6.522  16.704  -6.101
  973   2HB   GLU 129           1HB      GLU 129  -7.369  17.655  -4.882
  974   1HG   GLU 129           2HG      GLU 129  -4.428  17.982  -4.872
  975   2HG   GLU 129           1HG      GLU 129  -5.236  18.586  -6.318
  976    H    MET 130             H      MET 130  -7.258  14.148  -4.890
  977    HA   MET 130            HA      MET 130  -9.768  14.368  -3.495
  978   1HB   MET 130           2HB      MET 130  -8.844  12.807  -5.519
  979   2HB   MET 130           1HB      MET 130  -8.630  11.670  -4.198
  980   1HG   MET 130           2HG      MET 130 -11.086  12.153  -3.586
  981   2HG   MET 130           1HG      MET 130 -11.207  12.950  -5.169
  982   1HE   MET 130           3HE      MET 130 -12.885  10.912  -4.074
  983   2HE   MET 130           2HE      MET 130 -13.264  10.728  -5.786
  984   3HE   MET 130           1HE      MET 130 -12.853   9.309  -4.823
  985    H    ALA 131             H      ALA 131  -6.756  12.630  -2.805
  986    HA   ALA 131            HA      ALA 131  -7.561  11.695  -0.149
  987   1HB   ALA 131           1HB      ALA 131  -4.996  11.568  -1.781
  988   2HB   ALA 131           3HB      ALA 131  -5.037  11.101  -0.071
  989   3HB   ALA 131           2HB      ALA 131  -6.034  10.235  -1.240
  990    H    SER 132             H      SER 132  -6.103  14.557  -1.561
  991    HA   SER 132            HA      SER 132  -4.582  15.501   0.660
  992   1HB   SER 132           2HB      SER 132  -6.111  16.998  -1.477
  993   2HB   SER 132           1HB      SER 132  -5.250  17.838  -0.206
  994    HG   SER 132            HG      SER 132  -3.588  17.580  -1.459
  995    H    HIS 133             H      HIS 133  -8.085  15.369  -0.044
  996    HA   HIS 133            HA      HIS 133  -8.689  16.939   2.361
  997   1HB   HIS 133           2HB      HIS 133 -10.274  16.721   0.305
  998   2HB   HIS 133           1HB      HIS 133 -10.833  15.220   1.111
  999    HD1  HIS 133           HD1      HIS 133 -10.685  18.969   1.542
 1000    HD2  HIS 133           HD2      HIS 133 -12.062  15.641   3.645
 1001    HE1  HIS 133           HE1      HIS 133 -11.997  19.863   3.518
 1002    H    LEU 134             H      LEU 134  -8.677  13.484   1.336
 1003    HA   LEU 134            HA      LEU 134  -9.644  12.589   3.947
 1004   1HB   LEU 134           2HB      LEU 134  -8.167  11.213   1.711
 1005   2HB   LEU 134           1HB      LEU 134  -8.610  10.381   3.200
 1006    HG   LEU 134            HG      LEU 134 -10.948  11.698   2.517
 1007   1HD1  LEU 134          1HD1      LEU 134  -9.389  11.015   0.080
 1008   2HD1  LEU 134          3HD1      LEU 134 -11.111  10.652   0.068
 1009   3HD1  LEU 134          2HD1      LEU 134 -10.559  12.304   0.340
 1010   1HD2  LEU 134          2HD2      LEU 134 -10.404   9.262   3.262
 1011   2HD2  LEU 134          1HD2      LEU 134 -11.842   9.534   2.280
 1012   3HD2  LEU 134          3HD2      LEU 134 -10.367   8.911   1.538
 1013    NH1  ARG 135           NH2      ARG 135  -0.923  13.263   6.833
 1014    NH2  ARG 135           NH1      ARG 135   0.434  12.026   5.507
 1015    H    ARG 135             H      ARG 135  -6.756  14.022   3.110
 1016    HA   ARG 135            HA      ARG 135  -5.151  12.738   5.222
 1017   1HB   ARG 135           2HB      ARG 135  -4.595  14.645   2.971
 1018   2HB   ARG 135           1HB      ARG 135  -3.556  14.724   4.393
 1019   1HG   ARG 135           2HG      ARG 135  -3.876  11.962   3.729
 1020   2HG   ARG 135           1HG      ARG 135  -3.497  12.820   2.235
 1021   1HD   ARG 135           2HD      ARG 135  -1.344  12.527   2.972
 1022   2HD   ARG 135           1HD      ARG 135  -1.702  13.994   3.878
 1023    HE   ARG 135            HE      ARG 135  -2.399  11.511   5.278
 1024   1HH1  ARG 135          1HH2      ARG 135  -1.831  13.624   7.046
 1025   2HH1  ARG 135          2HH2      ARG 135  -0.144  13.491   7.418
 1026   1HH2  ARG 135          2HH1      ARG 135   0.564  11.443   4.704
 1027   2HH2  ARG 135          1HH1      ARG 135   1.208  12.239   6.100
 1028    NH1  ARG 136           NH2      ARG 136  -3.753  19.971   2.642
 1029    NH2  ARG 136           NH1      ARG 136  -4.691  21.811   1.723
 1030    H    ARG 136             H      ARG 136  -6.727  15.753   4.279
 1031    HA   ARG 136            HA      ARG 136  -6.203  17.092   6.816
 1032   1HB   ARG 136           2HB      ARG 136  -7.963  17.729   4.443
 1033   2HB   ARG 136           1HB      ARG 136  -7.971  18.717   5.901
 1034   1HG   ARG 136           2HG      ARG 136  -5.702  19.363   5.609
 1035   2HG   ARG 136           1HG      ARG 136  -5.419  18.101   4.404
 1036   1HD   ARG 136           2HD      ARG 136  -6.584  19.242   2.735
 1037   2HD   ARG 136           1HD      ARG 136  -7.540  20.165   3.894
 1038    HE   ARG 136            HE      ARG 136  -5.625  21.627   4.230
 1039   1HH1  ARG 136          1HH2      ARG 136  -3.744  19.265   3.350
 1040   2HH1  ARG 136          2HH2      ARG 136  -3.053  19.972   1.927
 1041   1HH2  ARG 136          2HH1      ARG 136  -5.402  22.515   1.727
 1042   2HH2  ARG 136          1HH1      ARG 136  -3.994  21.811   1.004
 1043    H    SER 137             H      SER 137  -8.197  14.588   5.846
 1044    HA   SER 137            HA      SER 137 -10.559  15.229   7.410
 1045   1HB   SER 137           2HB      SER 137 -11.413  13.152   6.550
 1046   2HB   SER 137           1HB      SER 137 -10.475  13.818   5.228
 1047    HG   SER 137            HG      SER 137 -10.061  11.570   5.698
 1048    H    GLN 138             H      GLN 138  -7.432  13.738   7.903
 1049    HA   GLN 138            HA      GLN 138  -6.442  12.800   9.811
 1050   1HB   GLN 138           2HB      GLN 138  -7.948  14.780  10.814
 1051   2HB   GLN 138           1HB      GLN 138  -8.822  13.415  11.513
 1052   1HG   GLN 138           2HG      GLN 138  -7.214  13.743  13.152
 1053   2HG   GLN 138           1HG      GLN 138  -6.375  12.587  12.117
 1054   1HE2  GLN 138          2HE2      GLN 138  -3.707  14.901  11.939
 1055   2HE2  GLN 138          1HE2      GLN 138  -4.214  13.342  12.387
 1056    OH   TYR 139            OH      TYR 139 -15.447  10.086   9.275
 1057    H    TYR 139             H      TYR 139  -8.379  11.330   8.047
 1058    HA   TYR 139            HA      TYR 139  -9.674   9.394   9.842
 1059   1HB   TYR 139           2HB      TYR 139  -9.753  10.041   6.947
 1060   2HB   TYR 139           1HB      TYR 139  -9.890   8.323   7.327
 1061    HD1  TYR 139           HD1      TYR 139 -11.369  11.674   7.981
 1062    HD2  TYR 139           HD2      TYR 139 -11.858   7.421   8.359
 1063    HE1  TYR 139           HE1      TYR 139 -13.734  12.005   8.663
 1064    HE2  TYR 139           HE2      TYR 139 -14.219   7.754   9.042
 1065    HH   TYR 139            HH      TYR 139 -16.008   9.691   8.605
   
  Start of MODEL           6
 Raw file had 1065 H/Q atoms
  Start of MODEL    6
    1   1H    ALA   1            1H      ALA   1 -21.815  17.205   4.065
    2   2H    ALA   1            3H      ALA   1 -22.560  18.600   3.455
    3   3H    ALA   1            2H      ALA   1 -23.326  17.091   3.297
    4    HA   ALA   1            HA      ALA   1 -21.956  16.386   1.628
    5   1HB   ALA   1           1HB      ALA   1 -23.305  18.409   0.966
    6   2HB   ALA   1           3HB      ALA   1 -21.878  19.397   1.278
    7   3HB   ALA   1           2HB      ALA   1 -21.845  18.176   0.005
    8    H    GLY   2             H      GLY   2 -19.890  15.862   1.118
    9   1HA   GLY   2           2HA      GLY   2 -17.604  17.603   1.434
   10   2HA   GLY   2           1HA      GLY   2 -17.670  16.408   2.734
   11    CH2  TRP   3           CH2      TRP   3 -13.063  11.558   3.753
   12    H    TRP   3             H      TRP   3 -18.229  14.110   1.843
   13    HA   TRP   3            HA      TRP   3 -16.147  13.127   0.276
   14   1HB   TRP   3           2HB      TRP   3 -18.691  12.132   1.129
   15   2HB   TRP   3           1HB      TRP   3 -17.869  11.252  -0.117
   16    HD1  TRP   3           HD1      TRP   3 -18.195   9.693   2.236
   17    HE1  TRP   3           HE1      TRP   3 -16.389   9.000   3.901
   18    HE3  TRP   3           HE3      TRP   3 -14.643  13.348   1.345
   19    HZ2  TRP   3           HZ2      TRP   3 -13.828   9.824   4.739
   20    HZ3  TRP   3           HZ3      TRP   3 -12.550  13.286   2.608
   21    HH2  TRP   3           HH2      TRP   3 -12.132  11.551   4.302
   22    H    ASN   4             H      ASN   4 -19.460  13.965  -0.697
   23    HA   ASN   4            HA      ASN   4 -19.289  13.097  -3.411
   24   1HB   ASN   4           2HB      ASN   4 -21.278  14.493  -3.815
   25   2HB   ASN   4           1HB      ASN   4 -21.444  13.638  -2.285
   26   1HD2  ASN   4          2HD2      ASN   4 -21.597  17.650  -2.300
   27   2HD2  ASN   4          1HD2      ASN   4 -21.664  16.711  -3.714
   28    H    ALA   5             H      ALA   5 -17.880  15.814  -1.902
   29    HA   ALA   5            HA      ALA   5 -17.547  17.485  -4.297
   30   1HB   ALA   5           1HB      ALA   5 -17.474  18.109  -1.664
   31   2HB   ALA   5           3HB      ALA   5 -15.754  17.817  -1.922
   32   3HB   ALA   5           2HB      ALA   5 -16.592  19.040  -2.876
   33    OH   TYR   6            OH      TYR   6 -13.191  17.944   1.381
   34    H    TYR   6             H      TYR   6 -15.716  15.104  -2.380
   35    HA   TYR   6            HA      TYR   6 -13.339  15.338  -4.106
   36   1HB   TYR   6           2HB      TYR   6 -14.021  13.081  -2.199
   37   2HB   TYR   6           1HB      TYR   6 -12.418  13.521  -2.819
   38    HD1  TYR   6           HD1      TYR   6 -11.556  15.909  -2.351
   39    HD2  TYR   6           HD2      TYR   6 -14.890  14.172  -0.423
   40    HE1  TYR   6           HE1      TYR   6 -11.504  17.715  -0.654
   41    HE2  TYR   6           HE2      TYR   6 -14.851  15.913   1.313
   42    HH   TYR   6            HH      TYR   6 -13.315  18.778   0.917
   43    H    ILE   7             H      ILE   7 -16.427  14.035  -4.402
   44    HA   ILE   7            HA      ILE   7 -15.698  12.132  -6.510
   45    HB   ILE   7            HB      ILE   7 -18.268  12.807  -5.172
   46   1HG1  ILE   7          2HG1      ILE   7 -16.688  11.183  -4.155
   47   2HG1  ILE   7          1HG1      ILE   7 -18.248  10.480  -4.548
   48   1HG2  ILE   7          3HG2      ILE   7 -17.882  11.298  -7.707
   49   2HG2  ILE   7          2HG2      ILE   7 -19.296  11.065  -6.692
   50   3HG2  ILE   7          1HG2      ILE   7 -18.977  12.641  -7.423
   51   1HD1  ILE   7          1HD1      ILE   7 -16.419  10.306  -6.788
   52   2HD1  ILE   7          3HD1      ILE   7 -15.750   9.535  -5.355
   53   3HD1  ILE   7          2HD1      ILE   7 -17.314   9.029  -5.981
   54    H    ASP   8             H      ASP   8 -16.807  15.387  -5.882
   55    HA   ASP   8            HA      ASP   8 -17.691  16.188  -8.415
   56   1HB   ASP   8           2HB      ASP   8 -16.820  17.568  -6.004
   57   2HB   ASP   8           1HB      ASP   8 -16.803  18.497  -7.438
   58    H    ASN   9             H      ASN   9 -14.627  15.441  -7.121
   59    HA   ASN   9            HA      ASN   9 -12.751  16.725  -8.682
   60   1HB   ASN   9           2HB      ASN   9 -11.737  15.368  -7.120
   61   2HB   ASN   9           1HB      ASN   9 -13.044  14.320  -7.097
   62   1HD2  ASN   9          2HD2      ASN   9 -11.184  11.555  -8.627
   63   2HD2  ASN   9          1HD2      ASN   9 -12.287  12.087  -7.395
   64    H    LEU  10             H      LEU  10 -14.147  13.720  -9.262
   65    HA   LEU  10            HA      LEU  10 -13.394  12.969 -11.768
   66   1HB   LEU  10           2HB      LEU  10 -16.088  12.758 -10.555
   67   2HB   LEU  10           1HB      LEU  10 -15.550  11.819 -11.918
   68    HG   LEU  10            HG      LEU  10 -15.093  10.351 -10.407
   69   1HD1  LEU  10          1HD1      LEU  10 -12.690  12.159 -10.091
   70   2HD1  LEU  10          3HD1      LEU  10 -12.786  10.645  -9.222
   71   3HD1  LEU  10          2HD1      LEU  10 -12.807  10.656 -10.980
   72   1HD2  LEU  10          3HD2      LEU  10 -16.259  11.604  -8.648
   73   2HD2  LEU  10          2HD2      LEU  10 -14.906  10.770  -7.980
   74   3HD2  LEU  10          1HD2      LEU  10 -14.799  12.447  -8.264
   75    H    MET  11             H      MET  11 -15.957  14.930 -10.766
   76    HA   MET  11            HA      MET  11 -16.878  15.145 -13.526
   77   1HB   MET  11           2HB      MET  11 -17.760  16.533 -10.973
   78   2HB   MET  11           1HB      MET  11 -18.703  16.359 -12.463
   79   1HG   MET  11           2HG      MET  11 -17.607  13.700 -11.195
   80   2HG   MET  11           1HG      MET  11 -19.012  14.510 -10.422
   81   1HE   MET  11           3HE      MET  11 -17.556  12.430 -12.748
   82   2HE   MET  11           2HE      MET  11 -18.788  11.830 -13.853
   83   3HE   MET  11           1HE      MET  11 -17.875  13.276 -14.271
   84    H    ALA  12             H      ALA  12 -14.930  17.032 -11.346
   85    HA   ALA  12            HA      ALA  12 -14.654  19.335 -13.065
   86   1HB   ALA  12           3HB      ALA  12 -13.570  18.604 -10.359
   87   2HB   ALA  12           2HB      ALA  12 -12.936  19.990 -11.244
   88   3HB   ALA  12           1HB      ALA  12 -14.641  19.940 -10.789
   89    H    ASP  13             H      ASP  13 -13.177  16.264 -13.151
   90    HA   ASP  13            HA      ASP  13 -10.484  17.313 -13.894
   91   1HB   ASP  13           2HB      ASP  13 -10.014  14.674 -14.018
   92   2HB   ASP  13           1HB      ASP  13  -9.953  15.580 -12.524
   93    H    GLY  14             H      GLY  14 -13.198  16.578 -15.729
   94   1HA   GLY  14           2HA      GLY  14 -13.445  15.675 -17.998
   95   2HA   GLY  14           1HA      GLY  14 -12.349  17.017 -18.283
   96    H    THR  15             H      THR  15 -11.579  14.027 -16.637
   97    HA   THR  15            HA      THR  15  -9.919  12.923 -18.777
   98    HB   THR  15            HB      THR  15  -8.940  13.795 -16.087
   99    HG1  THR  15           HG1      THR  15  -7.974  14.280 -18.704
  100   1HG2  THR  15          2HG2      THR  15  -7.807  11.883 -18.112
  101   2HG2  THR  15          1HG2      THR  15  -6.793  12.700 -16.904
  102   3HG2  THR  15          3HG2      THR  15  -8.103  11.632 -16.388
  103    H    CYS  16             H      CYS  16 -11.204  12.700 -15.552
  104    HA   CYS  16            HA      CYS  16 -10.699   9.959 -15.151
  105   1HB   CYS  16           2HB      CYS  16 -11.743  10.396 -13.098
  106   2HB   CYS  16           1HB      CYS  16 -11.457  12.022 -13.572
  107    HG   CYS  16            HG      CYS  16 -14.188  10.824 -13.211
  108    H    GLN  17             H      GLN  17 -12.881   8.713 -14.539
  109    HA   GLN  17            HA      GLN  17 -15.066   8.973 -16.403
  110   1HB   GLN  17           2HB      GLN  17 -13.239   7.526 -17.462
  111   2HB   GLN  17           1HB      GLN  17 -13.692   6.321 -16.265
  112   1HG   GLN  17           2HG      GLN  17 -15.819   7.657 -17.906
  113   2HG   GLN  17           1HG      GLN  17 -14.900   6.329 -18.594
  114   1HE2  GLN  17          2HE2      GLN  17 -17.951   4.990 -16.824
  115   2HE2  GLN  17          1HE2      GLN  17 -17.729   6.162 -18.029
  116    H    ASP  18             H      ASP  18 -13.410   7.058 -13.888
  117    HA   ASP  18            HA      ASP  18 -15.936   6.982 -12.379
  118   1HB   ASP  18           2HB      ASP  18 -15.166   4.726 -13.458
  119   2HB   ASP  18           1HB      ASP  18 -14.135   4.670 -12.046
  120    H    ALA  19             H      ALA  19 -15.320   6.235  -9.978
  121    HA   ALA  19            HA      ALA  19 -12.759   7.364  -8.946
  122   1HB   ALA  19           1HB      ALA  19 -14.188   9.116  -9.810
  123   2HB   ALA  19           3HB      ALA  19 -15.351   8.812  -8.536
  124   3HB   ALA  19           2HB      ALA  19 -13.690   9.288  -8.146
  125    H    ALA  20             H      ALA  20 -12.499   6.265  -6.890
  126    HA   ALA  20            HA      ALA  20 -15.048   5.960  -5.351
  127   1HB   ALA  20           1HB      ALA  20 -13.405   3.649  -6.225
  128   2HB   ALA  20           3HB      ALA  20 -14.439   3.563  -4.801
  129   3HB   ALA  20           2HB      ALA  20 -15.137   3.927  -6.376
  130    H    ILE  21             H      ILE  21 -14.771   6.774  -3.512
  131    HA   ILE  21            HA      ILE  21 -12.221   6.512  -2.012
  132    HB   ILE  21            HB      ILE  21 -14.885   7.787  -1.238
  133   1HG1  ILE  21          2HG1      ILE  21 -12.366   8.926  -2.489
  134   2HG1  ILE  21          1HG1      ILE  21 -14.005   8.985  -3.127
  135   1HG2  ILE  21          3HG2      ILE  21 -13.431   7.110   0.687
  136   2HG2  ILE  21          2HG2      ILE  21 -12.119   8.063   0.010
  137   3HG2  ILE  21          1HG2      ILE  21 -13.582   8.869   0.573
  138   1HD1  ILE  21          2HD1      ILE  21 -14.394  10.189  -0.741
  139   2HD1  ILE  21          1HD1      ILE  21 -12.716  10.639  -1.055
  140   3HD1  ILE  21          3HD1      ILE  21 -13.973  11.077  -2.214
  141    H    VAL  22             H      VAL  22 -12.105   4.607  -0.754
  142    HA   VAL  22            HA      VAL  22 -14.705   3.243  -0.157
  143    HB   VAL  22            HB      VAL  22 -12.048   1.919  -0.866
  144   1HG1  VAL  22          1HG1      VAL  22 -13.799   0.690   0.569
  145   2HG1  VAL  22          3HG1      VAL  22 -14.798   0.672  -0.886
  146   3HG1  VAL  22          2HG1      VAL  22 -13.223  -0.140  -0.880
  147   1HG2  VAL  22          1HG2      VAL  22 -13.298   3.298  -2.709
  148   2HG2  VAL  22          3HG2      VAL  22 -12.798   1.642  -3.083
  149   3HG2  VAL  22          2HG2      VAL  22 -14.479   1.986  -2.653
  150    H    GLY  23             H      GLY  23 -14.964   3.217   2.078
  151   1HA   GLY  23           2HA      GLY  23 -12.809   3.376   4.013
  152   2HA   GLY  23           1HA      GLY  23 -14.474   2.904   4.381
  153    OH   TYR  24            OH      TYR  24  -5.368   1.334   4.932
  154    H    TYR  24             H      TYR  24 -11.404   1.720   3.263
  155    HA   TYR  24            HA      TYR  24 -12.153  -1.044   3.022
  156   1HB   TYR  24           2HB      TYR  24 -10.026  -1.353   2.048
  157   2HB   TYR  24           1HB      TYR  24 -10.440   0.283   1.603
  158    HD1  TYR  24           HD1      TYR  24  -9.858   1.652   4.309
  159    HD2  TYR  24           HD2      TYR  24  -7.718  -1.276   2.065
  160    HE1  TYR  24           HE1      TYR  24  -7.755   2.364   5.394
  161    HE2  TYR  24           HE2      TYR  24  -5.618  -0.581   3.115
  162    HH   TYR  24            HH      TYR  24  -5.513   1.359   5.884
  163    H    LYS  25             H      LYS  25 -12.485  -0.005   5.746
  164    HA   LYS  25            HA      LYS  25 -10.357  -0.793   7.455
  165   1HB   LYS  25           2HB      LYS  25 -13.249  -0.319   7.874
  166   2HB   LYS  25           1HB      LYS  25 -12.226  -0.825   9.181
  167   1HG   LYS  25           2HG      LYS  25 -12.216   1.523   9.327
  168   2HG   LYS  25           1HG      LYS  25 -10.703   1.133   8.515
  169   1HD   LYS  25           2HD      LYS  25 -11.525   1.739   6.422
  170   2HD   LYS  25    HB      ALA  33 -16.654   4.401  -4.901
  227    H    VAL  34             H      VAL  34 -17.570   7.380  -7.674
  228    HA   VAL  34            HA      VAL  34 -20.154   8.295  -8.264
  229    HB   VAL  34            HB      VAL  34 -18.120   7.182 -10.239
  230   1HG1  VAL  34          3HG1      VAL  34 -20.699   7.829 -10.804
  231   2HG1  VAL  34          2HG1      VAL  34 -19.936   9.431 -10.961
  232   3HG1  VAL  34          1HG1      VAL  34 -19.367   8.065 -11.939
  233   1HG2  VAL  34          3HG2      VAL  34 -17.563   9.136  -8.519
  234   2HG2  VAL  34          2HG2      VAL  34 -17.072   9.267 -10.206
  235   3HG2  VAL  34          1HG2      VAL  34 -18.519  10.100  -9.641
  236    HA   PRO  35            HA      PRO  35 -22.005   4.129  -8.325
  237   1HB   PRO  35           2HB      PRO  35 -24.626   4.954  -8.233
  238   2HB   PRO  35           1HB      PRO  35 -23.579   4.826  -6.810
  239   1HG   PRO  35           2HG      PRO  35 -24.450   7.282  -8.284
  240   2HG   PRO  35           1HG      PRO  35 -24.035   7.091  -6.572
  241   1HD   PRO  35           2HD      PRO  35 -22.350   8.201  -8.533
  242   2HD   PRO  35           1HD      PRO  35 -21.825   7.601  -6.943
  243    H    GLY  36             H      GLY  36 -22.957   2.816  -9.869
  244   1HA   GLY  36           2HA      GLY  36 -24.393   2.460 -11.815
  245   2HA   GLY  36           1HA      GLY  36 -23.998   4.091 -12.353
  246    H    LYS  37             H      LYS  37 -21.032   3.396 -11.526
  247    HA   LYS  37            HA      LYS  37 -20.400   2.259 -14.192
  248   1HB   LYS  37           2HB      LYS  37 -18.475   3.473 -12.213
  249   2HB   LYS  37           1HB      LYS  37 -18.202   3.195 -13.927
  250   1HG   LYS  37           2HG      LYS  37 -20.235   5.114 -12.719
  251   2HG   LYS  37           1HG      LYS  37 -18.746   5.569 -13.543
  252   1HD   LYS  37           2HD      LYS  37 -19.564   4.742 -15.654
  253   2HD   LYS  37           1HD      LYS  37 -20.944   3.965 -14.883
  254   1HE   LYS  37           2HE      LYS  37 -21.729   6.026 -15.885
  255   2HE   LYS  37           1HE      LYS  37 -21.733   6.231 -14.134
  256   1HZ   LYS  37           3HZ      LYS  37 -19.234   6.962 -15.377
  257   2HZ   LYS  37           2HZ      LYS  37 -20.547   7.904 -15.898
  258   3HZ   LYS  37           1HZ      LYS  37 -20.171   7.805 -14.244
  259    H    THR  38             H      THR  38 -18.158   1.770 -11.415
  260    HA   THR  38            HA      THR  38 -18.713  -1.111 -11.319
  261    HB   THR  38            HB      THR  38 -16.575   0.052 -12.970
  262    HG1  THR  38           HG1      THR  38 -17.219  -1.450 -14.316
  263   1HG2  THR  38          2HG2      THR  38 -16.038  -2.527 -11.439
  264   2HG2  THR  38          1HG2      THR  38 -15.062  -1.932 -12.782
  265   3HG2  THR  38          3HG2      THR  38 -15.124  -1.020 -11.269
  266    H    PHE  39             H      PHE  39 -16.459   1.457 -10.407
  267    HA   PHE  39            HA      PHE  39 -14.978   0.112  -8.411
  268   1HB   PHE  39           2HB      PHE  39 -15.769   2.974  -8.758
  269   2HB   PHE  39           1HB      PHE  39 -14.783   2.418  -7.431
  270    HD1  PHE  39           HD2      PHE  39 -14.540   0.873 -10.796
  271    HD2  PHE  39           HD1      PHE  39 -12.816   3.660  -8.030
  272    HE1  PHE  39           HE2      PHE  39 -12.501   0.966 -12.158
  273    HE2  PHE  39           HE1      PHE  39 -10.772   3.765  -9.400
  274    HZ   PHE  39            HZ      PHE  39 -10.639   2.389 -11.464
  275    H    VAL  40             H      VAL  40 -17.983   1.899  -8.081
  276    HA   VAL  40            HA      VAL  40 -18.208   1.942  -5.304
  277    HB   VAL  40            HB      VAL  40 -19.694   3.343  -6.513
  278   1HG1  VAL  40          1HG1      VAL  40 -20.423   0.816  -7.957
  279   2HG1  VAL  40          3HG1      VAL  40 -21.466   2.238  -8.001
  280   3HG1  VAL  40          2HG1      VAL  40 -19.814   2.339  -8.617
  281   1HG2  VAL  40          2HG2      VAL  40 -20.624   1.673  -4.541
  282   2HG2  VAL  40          1HG2      VAL  40 -21.549   3.016  -5.222
  283   3HG2  VAL  40          3HG2      VAL  40 -21.795   1.375  -5.826
  284    H    ASN  41             H      ASN  41 -18.563  -0.702  -7.504
  285    HA   ASN  41            HA      ASN  41 -20.006  -2.372  -5.586
  286   1HB   ASN  41           2HB      ASN  41 -19.105  -2.631  -8.415
  287   2HB   ASN  41           1HB      ASN  41 -19.388  -4.073  -7.467
  288   1HD2  ASN  41          2HD2      ASN  41 -22.918  -3.163  -6.932
  289   2HD2  ASN  41          1HD2      ASN  41 -21.591  -3.611  -5.972
  290    H    ILE  42             H      ILE  42 -17.241  -1.195  -5.023
  291    HA   ILE  42            HA      ILE  42 -15.373  -3.373  -5.220
  292    HB   ILE  42            HB      ILE  42 -15.376  -0.575  -4.131
  293   1HG1  ILE  42          2HG1      ILE  42 -13.227  -2.110  -5.606
  294   2HG1  ILE  42          1HG1      ILE  42 -14.605  -1.381  -6.433
  295   1HG2  ILE  42          1HG2      ILE  42 -13.480  -2.721  -3.119
  296   2HG2  ILE  42          3HG2      ILE  42 -13.055  -1.011  -3.120
  297   3HG2  ILE  42          2HG2      ILE  42 -14.428  -1.577  -2.178
  298   1HD1  ILE  42          3HD1      ILE  42 -12.784   0.182  -4.590
  299   2HD1  ILE  42          2HD1      ILE  42 -12.512   0.064  -6.332
  300   3HD1  ILE  42          1HD1      ILE  42 -13.984   0.820  -5.715
  301    H    THR  43             H      THR  43 -15.200  -4.979  -3.911
  302    HA   THR  43            HA      THR  43 -16.450  -5.141  -1.208
  303    HB   THR  43            HB      THR  43 -16.089  -7.703  -1.893
  304    HG1  THR  43           HG1      THR  43 -16.016  -8.080  -4.021
  305   1HG2  THR  43          3HG2      THR  43 -18.179  -5.779  -2.771
  306   2HG2  THR  43          2HG2      THR  43 -18.270  -7.461  -3.314
  307   3HG2  THR  43          1HG2      THR  43 -18.299  -7.092  -1.592
  308    HA   PRO  44            HA      PRO  44 -12.354  -6.017   0.431
  309   1HB   PRO  44           2HB      PRO  44 -12.473  -8.378   1.703
  310   2HB   PRO  44           1HB      PRO  44 -13.072  -6.890   2.385
  311   1HG   PRO  44           2HG      PRO  44 -14.606  -9.168   1.208
  312   2HG   PRO  44           1HG      PRO  44 -15.101  -8.016   2.460
  313   1HD   PRO  44           2HD      PRO  44 -15.917  -7.898  -0.181
  314   2HD   PRO  44           1HD      PRO  44 -15.957  -6.526   0.920
  315    H    ALA  45             H      ALA  45 -13.490  -7.889  -1.986
  316    HA   ALA  45            HA      ALA  45 -11.270  -9.733  -2.325
  317   1HB   ALA  45           1HB      ALA  45 -13.716  -9.008  -3.910
  318   2HB   ALA  45           3HB      ALA  45 -12.439  -9.990  -4.633
  319   3HB   ALA  45           2HB      ALA  45 -13.297 -10.575  -3.207
  320    H    GLU  46             H      GLU  46 -12.643  -7.225  -4.312
  321    HA   GLU  46            HA      GLU  46 -10.315  -6.716  -5.908
  322   1HB   GLU  46           2HB      GLU  46 -11.520  -4.327  -6.158
  323   2HB   GLU  46           1HB      GLU  46 -12.118  -5.739  -7.008
  324   1HG   GLU  46           2HG      GLU  46 -13.150  -5.341  -4.268
  325   2HG   GLU  46           1HG      GLU  46 -13.612  -4.117  -5.444
  326    H    VAL  47             H      VAL  47 -11.435  -5.459  -2.845
  327    HA   VAL  47            HA      VAL  47  -9.283  -3.567  -2.622
  328    HB   VAL  47            HB      VAL  47 -11.727  -4.086  -1.160
  329   1HG1  VAL  47          3HG1      VAL  47 -10.021  -4.511   0.593
  330   2HG1  VAL  47          2HG1      VAL  47  -9.417  -2.890   0.251
  331   3HG1  VAL  47          1HG1      VAL  47 -11.046  -3.106   0.882
  332   1HG2  VAL  47          1HG2      VAL  47 -11.072  -2.091  -2.611
  333   2HG2  VAL  47          3HG2      VAL  47 -11.783  -1.718  -1.032
  334   3HG2  VAL  47          2HG2      VAL  47 -10.012  -1.624  -1.246
  335    H    GLY  48             H      GLY  48  -9.795  -6.868  -1.864
  336   1HA   GLY  48           2HA      GLY  48  -7.900  -7.260   0.223
  337   2HA   GLY  48           1HA      GLY  48  -8.379  -8.483  -0.953
  338    H    VAL  49             H      VAL  49  -7.545  -6.880  -3.236
  339    HA   VAL  49            HA      VAL  49  -4.621  -7.377  -3.041
  340    HB   VAL  49            HB      VAL  49  -5.831  -8.472  -4.918
  341   1HG1  VAL  49          2HG1      VAL  49  -7.221  -6.180  -5.161
  342   2HG1  VAL  49          1HG1      VAL  49  -5.986  -5.884  -6.381
  343   3HG1  VAL  49          3HG1      VAL  49  -7.021  -7.308  -6.497
  344   1HG2  VAL  49          2HG2      VAL  49  -3.501  -6.639  -5.199
  345   2HG2  VAL  49          1HG2      VAL  49  -3.636  -8.364  -5.552
  346   3HG2  VAL  49          3HG2      VAL  49  -4.234  -7.180  -6.713
  347    H    LEU  50             H      LEU  50  -6.870  -4.814  -3.710
  348    HA   LEU  50            HA      LEU  50  -5.054  -2.762  -4.506
  349   1HB   LEU  50           2HB      LEU  50  -7.754  -2.956  -3.428
  350   2HB   LEU  50           1HB      LEU  50  -6.997  -1.436  -3.270
  351    HG   LEU  50            HG      LEU  50  -7.102  -2.798  -5.915
  352   1HD1  LEU  50          1HD1      LEU  50  -9.291  -1.216  -4.473
  353   2HD1  LEU  50          3HD1      LEU  50  -9.247  -1.400  -6.239
  354   3HD1  LEU  50          2HD1      LEU  50  -9.425  -2.823  -5.217
  355   1HD2  LEU  50          3HD2      LEU  50  -6.983   0.053  -4.874
  356   2HD2  LEU  50          2HD2      LEU  50  -5.737  -0.808  -5.776
  357   3HD2  LEU  50          1HD2      LEU  50  -7.229  -0.339  -6.579
  358    H    VAL  51             H      VAL  51  -5.725  -4.264  -1.522
  359    HA   VAL  51            HA      VAL  51  -4.052  -2.303  -0.074
  360    HB   VAL  51            HB      VAL  51  -5.775  -1.819   1.490
  361   1HG1  VAL  51          1HG1      VAL  51  -7.212  -2.429  -1.101
  362   2HG1  VAL  51          3HG1      VAL  51  -7.947  -1.568   0.231
  363   3HG1  VAL  51          2HG1      VAL  51  -6.552  -0.885  -0.584
  364   1HG2  VAL  51          2HG2      VAL  51  -6.616  -4.613   0.992
  365   2HG2  VAL  51          1HG2      VAL  51  -6.703  -3.660   2.476
  366   3HG2  VAL  51          3HG2      VAL  51  -7.955  -3.488   1.243
  367    H    GLY  52             H      GLY  52  -4.708  -5.594  -0.692
  368   1HA   GLY  52           2HA      GLY  52  -4.191  -6.944   1.676
  369   2HA   GLY  52           1HA      GLY  52  -3.720  -7.542   0.086
  370    H    LYS  53             H      LYS  53  -2.327  -7.564   2.661
  371    HA   LYS  53            HA      LYS  53  -0.147  -5.781   2.641
  372   1HB   LYS  53           2HB      LYS  53   0.912  -7.342   4.235
  373   2HB   LYS  53           1HB      LYS  53  -0.736  -6.926   4.684
  374   1HG   LYS  53           2HG      LYS  53  -1.037  -9.174   4.845
  375   2HG   LYS  53           1HG      LYS  53  -1.148  -9.117   3.086
  376   1HD   LYS  53           2HD      LYS  53   0.473 -10.828   3.760
  377   2HD   LYS  53           1HD      LYS  53   1.305  -9.509   2.938
  378   1HE   LYS  53           2HE      LYS  53   2.675  -9.472   4.748
  379   2HE   LYS  53           1HE      LYS  53   1.338  -8.688   5.587
  380   1HZ   LYS  53           2HZ      LYS  53   0.520 -10.967   6.126
  381   2HZ   LYS  53           1HZ      LYS  53   1.992 -11.575   5.537
  382   3HZ   LYS  53           3HZ      LYS  53   1.982 -10.537   6.877
  383    H    ASP  54             H      ASP  54  -0.769  -8.394   0.595
  384    HA   ASP  54            HA      ASP  54   1.572  -9.678   0.068
  385   1HB   ASP  54           2HB      ASP  54  -0.759  -9.830  -1.067
  386   2HB   ASP  54           1HB      ASP  54  -0.053  -8.716  -2.232
  387    NH1  ARG  55           NH2      ARG  55   6.212  -2.995   3.146
  388    NH2  ARG  55           NH1      ARG  55   8.069  -4.276   3.309
  389    H    ARG  55             H      ARG  55   3.455  -9.052  -0.699
  390    HA   ARG  55            HA      ARG  55   3.816  -6.348  -1.687
  391   1HB   ARG  55           2HB      ARG  55   4.654  -7.084   0.684
  392   2HB   ARG  55           1HB      ARG  55   5.980  -7.799  -0.231
  393   1HG   ARG  55           2HG      ARG  55   6.957  -5.784  -0.489
  394   2HG   ARG  55           1HG      ARG  55   5.488  -5.118  -1.197
  395   1HD   ARG  55           2HD      ARG  55   4.904  -4.078   0.735
  396   2HD   ARG  55           1HD      ARG  55   5.291  -5.491   1.710
  397    HE   ARG  55            HE      ARG  55   7.638  -4.030   0.715
  398   1HH1  ARG  55          1HH2      ARG  55   5.444  -2.647   2.606
  399   2HH1  ARG  55          2HH2      ARG  55   6.319  -2.716   4.099
  400   1HH2  ARG  55          2HH1      ARG  55   8.724  -4.908   2.893
  401   2HH2  ARG  55          1HH1      ARG  55   8.179  -3.998   4.264
  402    H    SER  56             H      SER  56   3.472  -8.661  -3.484
  403    HA   SER  56            HA      SER  56   5.765  -8.167  -5.176
  404   1HB   SER  56           2HB      SER  56   6.872  -9.662  -3.642
  405   2HB   SER  56           1HB      SER  56   5.628 -10.878  -3.892
  406    HG   SER  56            HG      SER  56   6.621 -11.453  -5.649
  407    H    SER  57             H      SER  57   2.982 -10.158  -4.620
  408    HA   SER  57            HA      SER  57   2.824 -11.270  -7.244
  409   1HB   SER  57           2HB      SER  57   0.416 -11.731  -6.613
  410   2HB   SER  57           1HB      SER  57   1.645 -12.433  -5.574
  411    HG   SER  57            HG      SER  57  -0.198 -11.206  -4.598
  412    H    PHE  58             H      PHE  58  -0.018  -9.484  -6.376
  413    HA   PHE  58            HA      PHE  58  -0.760  -8.522  -8.770
  414   1HB   PHE  58           2HB      PHE  58  -2.132  -6.894  -7.739
  415   2HB   PHE  58           1HB      PHE  58  -2.012  -8.258  -6.648
  416    HD1  PHE  58           HD2      PHE  58  -0.818  -4.819  -7.301
  417    HD2  PHE  58           HD1      PHE  58  -1.019  -8.042  -4.472
  418    HE1  PHE  58           HE2      PHE  58  -0.056  -3.294  -5.510
  419    HE2  PHE  58           HE1      PHE  58  -0.255  -6.512  -2.675
  420    HZ   PHE  58            HZ      PHE  58   0.224  -4.139  -3.198
  421    OH   TYR  59            OH      TYR  59   3.166  -3.716  -2.386
  422    H    TYR  59             H      TYR  59   2.113  -7.118  -7.198
  423    HA   TYR  59            HA      TYR  59   2.010  -4.648  -8.543
  424   1HB   TYR  59           2HB      TYR  59   4.538  -6.111  -7.867
  425   2HB   TYR  59           1HB      TYR  59   4.388  -4.408  -8.274
  426    HD1  TYR  59           HD1      TYR  59   2.071  -3.582  -6.814
  427    HD2  TYR  59           HD2      TYR  59   5.269  -6.151  -5.614
  428    HE1  TYR  59           HE1      TYR  59   1.753  -2.863  -4.447
  429    HE2  TYR  59           HE2      TYR  59   4.958  -5.437  -3.256
  430    HH   TYR  59            HH      TYR  59   3.519  -2.826  -2.290
  431    H    VAL  60             H      VAL  60   2.236  -7.568 -10.029
  432    HA   VAL  60            HA      VAL  60   3.416  -6.349 -12.429
  433    HB   VAL  60            HB      VAL  60   3.889  -8.898 -12.901
  434   1HG1  VAL  60          3HG1      VAL  60   5.448  -7.004 -11.174
  435   2HG1  VAL  60          2HG1      VAL  60   6.128  -8.538 -11.727
  436   3HG1  VAL  60          1HG1      VAL  60   5.646  -7.313 -12.899
  437   1HG2  VAL  60          2HG2      VAL  60   3.865  -8.757  -9.882
  438   2HG2  VAL  60          1HG2      VAL  60   2.879  -9.821 -10.885
  439   3HG2  VAL  60          3HG2      VAL  60   4.626 -10.053 -10.807
  440    H    ASN  61             H      ASN  61   0.836  -8.441 -11.166
  441    HA   ASN  61            HA      ASN  61  -0.162  -8.913 -13.844
  442   1HB   ASN  61           2HB      ASN  61  -1.856 -10.275 -12.731
  443   2HB   ASN  61           1HB      ASN  61  -0.258 -10.758 -12.286
  444   1HD2  ASN  61          2HD2      ASN  61  -0.968 -10.459  -8.913
  445   2HD2  ASN  61          1HD2      ASN  61  -0.090 -11.216 -10.150
  446    H    GLY  62             H      GLY  62  -1.116  -7.072 -10.968
  447   1HA   GLY  62           2HA      GLY  62  -2.085  -4.845 -11.485
  448   2HA   GLY  62           1HA      GLY  62  -3.113  -5.679 -12.655
  449    H    LEU  63             H      LEU  63  -3.826  -4.045 -10.240
  450    HA   LEU  63            HA      LEU  63  -4.908  -5.843  -8.204
  451   1HB   LEU  63           2HB      LEU  63  -5.722  -2.942  -8.661
  452   2HB   LEU  63           1HB      LEU  63  -5.888  -3.864  -7.158
  453    HG   LEU  63            HG      LEU  63  -3.172  -3.418  -8.385
  454   1HD1  LEU  63          2HD1      LEU  63  -4.870  -1.313  -7.732
  455   2HD1  LEU  63          1HD1      LEU  63  -3.981  -1.572  -6.227
  456   3HD1  LEU  63          3HD1      LEU  63  -3.106  -1.235  -7.723
  457   1HD2  LEU  63          3HD2      LEU  63  -4.379  -4.124  -5.715
  458   2HD2  LEU  63          2HD2      LEU  63  -3.127  -4.970  -6.615
  459   3HD2  LEU  63          1HD2      LEU  63  -2.752  -3.451  -5.803
  460    H    THR  64             H      THR  64  -7.523  -4.514  -7.930
  461    HA   THR  64            HA      THR  64  -9.019  -5.037 -10.340
  462    HB   THR  64            HB      THR  64 -10.439  -6.761  -9.121
  463    HG1  THR  64           HG1      THR  64  -9.454  -7.795  -7.413
  464   1HG2  THR  64          1HG2      THR  64  -8.697  -7.182 -10.927
  465   2HG2  THR  64          3HG2      THR  64  -7.599  -7.652  -9.624
  466   3HG2  THR  64          2HG2      THR  64  -9.097  -8.558  -9.900
  467    H    LEU  65             H      LEU  65 -10.634  -3.681 -10.230
  468    HA   LEU  65            HA      LEU  65 -11.689  -2.858  -7.604
  469   1HB   LEU  65           2HB      LEU  65 -11.918  -0.524  -8.792
  470   2HB   LEU  65           1HB      LEU  65 -10.510  -0.967  -7.878
  471    HG   LEU  65            HG      LEU  65  -9.447  -1.743 -10.038
  472   1HD1  LEU  65          1HD1      LEU  65 -12.038  -0.759 -11.035
  473   2HD1  LEU  65          3HD1      LEU  65 -10.637  -0.292 -11.974
  474   3HD1  LEU  65          2HD1      LEU  65 -10.988  -1.991 -11.687
  475   1HD2  LEU  65          1HD2      LEU  65 -10.039   1.016  -9.142
  476   2HD2  LEU  65          3HD2      LEU  65  -8.489   0.251  -9.518
  477   3HD2  LEU  65          2HD2      LEU  65  -9.485   0.894 -10.822
  478    H    GLY  66             H      GLY  66 -13.635  -3.646  -7.622
  479   1HA   GLY  66           2HA      GLY  66 -15.909  -3.825  -8.147
  480   2HA   GLY  66           1HA      GLY  66 -15.632  -2.703  -9.482
  481    H    GLY  67             H      GLY  67 -13.560  -5.498  -9.153
  482   1HA   GLY  67           2HA      GLY  67 -13.604  -7.580 -10.274
  483   2HA   GLY  67           1HA      GLY  67 -15.105  -7.099 -11.067
  484    H    GLN  68             H      GLN  68 -12.735  -4.563 -11.208
  485    HA   GLN  68            HA      GLN  68 -12.097  -5.436 -14.026
  486   1HB   GLN  68           2HB      GLN  68 -13.406  -3.447 -14.053
  487   2HB   GLN  68           1HB      GLN  68 -12.334  -2.737 -12.904
  488   1HG   GLN  68           2HG      GLN  68 -12.066  -2.068 -15.431
  489   2HG   GLN  68           1HG      GLN  68 -10.623  -2.320 -14.462
  490   1HE2  GLN  68          2HE2      GLN  68  -9.495  -4.604 -16.939
  491   2HE2  GLN  68          1HE2      GLN  68  -9.162  -3.214 -16.020
  492    H    LYS  69             H      LYS  69 -10.160  -6.380 -14.010
  493    HA   LYS  69            HA      LYS  69  -8.030  -5.880 -12.247
  494   1HB   LYS  69           2HB      LYS  69  -8.593  -7.698 -14.202
  495   2HB   LYS  69           1HB      LYS  69  -7.317  -6.755 -14.970
  496   1HG   LYS  69           2HG      LYS  69  -5.720  -7.485 -13.515
  497   2HG   LYS  69           1HG      LYS  69  -6.826  -7.474 -12.141
  498   1HD   LYS  69           2HD      LYS  69  -7.482  -9.627 -12.475
  499   2HD   LYS  69           1HD      LYS  69  -7.429  -9.481 -14.232
  500   1HE   LYS  69           2HE      LYS  69  -5.564 -10.797 -14.019
  501   2HE   LYS  69           1HE      LYS  69  -4.775  -9.263 -13.650
  502   1HZ   LYS  69           1HZ      LYS  69  -5.262  -9.682 -11.284
  503   2HZ   LYS  69           3HZ      LYS  69  -5.879 -11.207 -11.694
  504   3HZ   LYS  69           2HZ      LYS  69  -4.238 -10.856 -11.959
  505    H    CYS  70             H      CYS  70  -6.863  -4.033 -12.049
  506    HA   CYS  70            HA      CYS  70  -6.198  -2.475 -14.543
  507   1HB   CYS  70           2HB      CYS  70  -5.751  -0.629 -12.864
  508   2HB   CYS  70           1HB      CYS  70  -7.432  -1.065 -13.043
  509    HG   CYS  70            HG      CYS  70  -5.727  -2.025 -10.599
  510    H    SER  71             H      SER  71  -3.913  -1.713 -14.365
  511    HA   SER  71            HA      SER  71  -2.176  -3.696 -13.011
  512   1HB   SER  71           2HB      SER  71  -0.653  -3.481 -14.832
  513   2HB   SER  71           1HB      SER  71  -2.278  -3.803 -15.440
  514    HG   SER  71            HG      SER  71  -2.418  -1.386 -15.578
  515    H    VAL  72             H      VAL  72  -1.097  -2.922 -11.392
  516    HA   VAL  72            HA      VAL  72  -0.592  -0.312 -10.658
  517    HB   VAL  72            HB      VAL  72   1.396  -2.463 -10.184
  518   1HG1  VAL  72          3HG1      VAL  72   1.769  -0.033  -9.478
  519   2HG1  VAL  72          2HG1      VAL  72   0.475  -0.311  -8.308
  520   3HG1  VAL  72          1HG1      VAL  72   1.955  -1.268  -8.237
  521   1HG2  VAL  72          1HG2      VAL  72  -1.336  -2.111  -9.110
  522   2HG2  VAL  72          3HG2      VAL  72  -0.479  -3.593  -9.507
  523   3HG2  VAL  72          2HG2      VAL  72  -0.077  -2.711  -8.039
  524    H    ILE  73             H      ILE  73   0.384   1.187 -11.798
  525    HA   ILE  73            HA      ILE  73   2.830   0.694 -13.135
  526    HB   ILE  73            HB      ILE  73   0.515   2.378 -13.842
  527   1HG1  ILE  73          2HG1      ILE  73   2.051   1.246 -16.044
  528   2HG1  ILE  73          1HG1      ILE  73   1.649   0.007 -14.856
  529   1HG2  ILE  73          2HG2      ILE  73   3.370   2.999 -14.465
  530   2HG2  ILE  73          1HG2      ILE  73   2.117   3.420 -15.632
  531   3HG2  ILE  73          3HG2      ILE  73   2.082   4.111 -14.009
  532   1HD1  ILE  73          2HD1      ILE  73  -0.771   0.826 -15.001
  533   2HD1  ILE  73          1HD1      ILE  73  -0.277   1.806 -16.364
  534   3HD1  ILE  73          3HD1      ILE  73  -0.177   0.035 -16.480
  535    NH1  ARG  74           NH1      ARG  74   7.448   3.176  -6.199
  536    NH2  ARG  74           NH2      ARG  74   7.839   5.208  -5.290
  537    H    ARG  74             H      ARG  74   3.463   0.954 -10.934
  538    HA   ARG  74            HA      ARG  74   5.101   2.153  -9.617
  539   1HB   ARG  74           2HB      ARG  74   4.310   4.304 -11.059
  540   2HB   ARG  74           1HB      ARG  74   3.503   4.662  -9.530
  541   1HG   ARG  74           2HG      ARG  74   6.432   3.916  -9.747
  542   2HG   ARG  74           1HG      ARG  74   5.857   5.582  -9.738
  543   1HD   ARG  74           2HD      ARG  74   4.770   5.175  -7.541
  544   2HD   ARG  74           1HD      ARG  74   5.411   3.532  -7.545
  545    HE   ARG  74            HE      ARG  74   7.322   5.805  -7.741
  546   1HH1  ARG  74          2HH1      ARG  74   7.096   2.618  -6.948
  547   2HH1  ARG  74          1HH1      ARG  74   7.853   2.739  -5.397
  548   1HH2  ARG  74          1HH2      ARG  74   7.791   6.205  -5.346
  549   2HH2  ARG  74          2HH2      ARG  74   8.230   4.772  -4.481
  550    H    ASP  75             H      ASP  75   4.749   1.231  -7.700
  551    HA   ASP  75            HA      ASP  75   2.178   1.690  -6.396
  552   1HB   ASP  75           2HB      ASP  75   2.204  -0.579  -6.422
  553   2HB   ASP  75           1HB      ASP  75   3.910  -0.652  -6.489
  554    H    SER  76             H      SER  76   2.313   3.530  -5.305
  555    HA   SER  76            HA      SER  76   4.289   3.644  -3.066
  556   1HB   SER  76           2HB      SER  76   4.213   5.489  -5.119
  557   2HB   SER  76           1HB      SER  76   3.147   6.227  -3.933
  558    HG   SER  76            HG      SER  76   5.870   5.620  -3.799
  559    H    LEU  77             H      LEU  77   1.187   2.943  -3.754
  560    HA   LEU  77            HA      LEU  77  -0.719   4.430  -2.348
  561   1HB   LEU  77           2HB      LEU  77  -0.855   2.154  -3.615
  562   2HB   LEU  77           1HB      LEU  77  -0.468   1.404  -2.086
  563    HG   LEU  77            HG      LEU  77  -2.699   3.384  -2.190
  564   1HD1  LEU  77          2HD1      LEU  77  -2.824   1.671  -4.163
  565   2HD1  LEU  77          1HD1      LEU  77  -3.104   0.463  -2.906
  566   3HD1  LEU  77          3HD1      LEU  77  -4.234   1.805  -3.105
  567   1HD2  LEU  77          1HD2      LEU  77  -1.840   0.983  -0.601
  568   2HD2  LEU  77          3HD2      LEU  77  -2.361   2.566  -0.026
  569   3HD2  LEU  77          2HD2      LEU  77  -3.549   1.413  -0.635
  570    H    LEU  78             H      LEU  78   1.923   2.555  -0.912
  571    HA   LEU  78            HA      LEU  78   0.731   3.120   1.690
  572   1HB   LEU  78           2HB      LEU  78   2.845   1.298   0.930
  573   2HB   LEU  78           1HB      LEU  78   2.467   1.605   2.591
  574    HG   LEU  78            HG      LEU  78   0.402   0.740   0.541
  575   1HD1  LEU  78          2HD1      LEU  78   2.317  -0.960   1.064
  576   2HD1  LEU  78          1HD1      LEU  78   1.508  -1.120   2.623
  577   3HD1  LEU  78          3HD1      LEU  78   0.630  -1.506   1.133
  578   1HD2  LEU  78          2HD2      LEU  78   0.435   0.865   3.571
  579   2HD2  LEU  78          1HD2      LEU  78  -0.547   1.839   2.476
  580   3HD2  LEU  78          3HD2      LEU  78  -0.855   0.109   2.629
  581    H    GLN  79             H      GLN  79   1.296   4.808   2.670
  582    HA   GLN  79            HA      GLN  79   2.719   6.857   1.921
  583   1HB   GLN  79           2HB      GLN  79   2.680   7.510   4.427
  584   2HB   GLN  79           1HB      GLN  79   1.173   7.384   3.551
  585   1HG   GLN  79           2HG      GLN  79   1.271   6.274   5.865
  586   2HG   GLN  79           1HG      GLN  79   0.652   5.285   4.553
  587   1HE2  GLN  79          2HE2      GLN  79   4.203   4.292   6.340
  588   2HE2  GLN  79          1HE2      GLN  79   3.485   5.800   6.653
  589    H    ASP  80             H      ASP  80   4.519   5.953   1.161
  590    HA   ASP  80            HA      ASP  80   6.781   5.808   3.099
  591   1HB   ASP  80           2HB      ASP  80   6.707   3.964   1.404
  592   2HB   ASP  80           1HB      ASP  80   6.689   5.170   0.113
  593    H    GLY  81             H      GLY  81   5.002   8.155   2.207
  594   1HA   GLY  81           2HA      GLY  81   5.642  10.465   2.098
  595   2HA   GLY  81           1HA      GLY  81   7.090   9.977   1.206
  596    H    GLU  82             H      GLU  82   3.901   8.544   0.488
  597    HA   GLU  82            HA      GLU  82   3.485  10.214  -1.842
  598   1HB   GLU  82           2HB      GLU  82   4.533   7.466  -1.849
  599   2HB   GLU  82           1HB      GLU  82   3.450   7.956  -3.095
  600   1HG   GLU  82           2HG      GLU  82   6.080   9.249  -2.455
  601   2HG   GLU  82           1HG      GLU  82   5.721   8.257  -3.876
  602    H    PHE  83             H      PHE  83   2.549   6.966  -0.759
  603    HA   PHE  83            HA      PHE  83   0.507   5.836  -0.668
  604   1HB   PHE  83           2HB      PHE  83  -1.436   7.732  -0.704
  605   2HB   PHE  83           1HB      PHE  83  -1.032   6.801   0.560
  606    HD1  PHE  83           HD2      PHE  83   1.252   7.714   1.458
  607    HD2  PHE  83           HD1      PHE  83  -1.844   9.853  -0.243
  608    HE1  PHE  83           HE2      PHE  83   2.071   9.701   2.736
  609    HE2  PHE  83           HE1      PHE  83  -1.153  11.934   0.973
  610    HZ   PHE  83            HZ      PHE  83   0.831  11.849   2.482
  611    H    SER  84             H      SER  84   1.463   7.510  -3.316
  612    HA   SER  84            HA      SER  84  -1.109   7.233  -4.762
  613   1HB   SER  84           2HB      SER  84  -0.049   8.525  -6.539
  614   2HB   SER  84           1HB      SER  84   0.045   9.379  -5.003
  615    HG   SER  84            HG      SER  84   2.183   8.645  -4.809
  616    H    MET  85             H      MET  85  -1.413   5.808  -6.274
  617    HA   MET  85            HA      MET  85   0.864   4.107  -7.203
  618   1HB   MET  85           2HB      MET  85  -0.350   3.140  -5.211
  619   2HB   MET  85           1HB      MET  85  -1.783   3.112  -6.213
  620   1HG   MET  85           2HG      MET  85  -1.096   1.342  -7.403
  621   2HG   MET  85           1HG      MET  85   0.571   1.866  -7.412
  622   1HE   MET  85           3HE      MET  85  -1.377  -0.543  -6.944
  623   2HE   MET  85           2HE      MET  85   0.095  -1.490  -6.524
  624   3HE   MET  85           1HE      MET  85  -1.243  -1.331  -5.350
  625    H    ASP  86             H      ASP  86   0.652   3.775  -9.475
  626    HA   ASP  86            HA      ASP  86  -1.999   4.635 -10.552
  627   1HB   ASP  86           2HB      ASP  86   0.574   3.877 -11.856
  628   2HB   ASP  86           1HB      ASP  86  -0.867   4.326 -12.721
  629    H    LEU  87             H      LEU  87  -3.248   3.147 -11.632
  630    HA   LEU  87            HA      LEU  87  -2.261   0.611 -12.281
  631   1HB   LEU  87           2HB      LEU  87  -4.305  -0.482 -11.077
  632   2HB   LEU  87           1HB      LEU  87  -2.773  -0.278 -10.345
  633    HG   LEU  87            HG      LEU  87  -4.628   0.248  -8.838
  634   1HD1  LEU  87          1HD1      LEU  87  -2.258   1.421  -8.960
  635   2HD1  LEU  87          3HD1      LEU  87  -3.288   2.833  -9.155
  636   3HD1  LEU  87          2HD1      LEU  87  -3.458   1.803  -7.735
  637   1HD2  LEU  87          2HD2      LEU  87  -5.831   1.357 -10.896
  638   2HD2  LEU  87          1HD2      LEU  87  -6.137   1.904  -9.263
  639   3HD2  LEU  87          3HD2      LEU  87  -5.029   2.805 -10.289
  640    NH1  ARG  88           NH1      ARG  88  -0.706   3.497 -19.870
  641    NH2  ARG  88           NH2      ARG  88   0.855   3.006 -18.312
  642    H    ARG  88             H      ARG  88  -2.906   0.266 -14.243
  643    HA   ARG  88            HA      ARG  88  -5.480   1.610 -15.084
  644   1HB   ARG  88           2HB      ARG  88  -4.472   2.415 -17.029
  645   2HB   ARG  88           1HB      ARG  88  -3.100   2.424 -15.945
  646   1HG   ARG  88           2HG      ARG  88  -2.235   0.353 -16.941
  647   2HG   ARG  88           1HG      ARG  88  -3.711   0.129 -17.892
  648   1HD   ARG  88           2HD      ARG  88  -2.779   1.295 -19.531
  649   2HD   ARG  88           1HD      ARG  88  -2.799   2.736 -18.494
  650    HE   ARG  88            HE      ARG  88  -0.503   0.863 -18.261
  651   1HH1  ARG  88          2HH1      ARG  88  -1.567   3.283 -20.331
  652   2HH1  ARG  88          1HH1      ARG  88  -0.179   4.300 -20.144
  653   1HH2  ARG  88          1HH2      ARG  88   1.191   2.418 -17.577
  654   2HH2  ARG  88          2HH2      ARG  88   1.383   3.809 -18.591
  655    H    THR  89             H      THR  89  -7.003   0.566 -16.198
  656    HA   THR  89            HA      THR  89  -7.051  -2.291 -16.504
  657    HB   THR  89            HB      THR  89  -9.134  -1.972 -17.550
  658    HG1  THR  89           HG1      THR  89  -9.243  -0.803 -19.227
  659   1HG2  THR  89          1HG2      THR  89  -8.674  -0.421 -15.348
  660   2HG2  THR  89          3HG2      THR  89  -9.378   0.733 -16.488
  661   3HG2  THR  89          2HG2      THR  89 -10.267  -0.730 -16.038
  662    H    LYS  90             H      LYS  90  -5.138  -2.895 -17.643
  663    HA   LYS  90            HA      LYS  90  -4.337  -1.493 -19.975
  664   1HB   LYS  90           2HB      LYS  90  -3.245  -4.203 -19.518
  665   2HB   LYS  90           1HB      LYS  90  -2.454  -2.701 -19.940
  666   1HG   LYS  90           2HG      LYS  90  -2.772  -1.910 -17.611
  667   2HG   LYS  90           1HG      LYS  90  -3.288  -3.560 -17.191
  668   1HD   LYS  90           2HD      LYS  90  -0.807  -3.340 -18.862
  669   2HD   LYS  90           1HD      LYS  90  -0.650  -2.804 -17.213
  670   1HE   LYS  90           2HE      LYS  90  -0.751  -4.919 -16.390
  671   2HE   LYS  90           1HE      LYS  90  -2.117  -5.332 -17.430
  672   1HZ   LYS  90           2HZ      LYS  90   0.551  -5.005 -18.621
  673   2HZ   LYS  90           1HZ      LYS  90   0.186  -6.446 -17.798
  674   3HZ   LYS  90           3HZ      LYS  90  -0.748  -5.974 -19.132
  675    H    SER  91             H      SER  91  -3.773  -2.887 -21.889
  676    HA   SER  91            HA      SER  91  -6.057  -4.633 -22.677
  677   1HB   SER  91           2HB      SER  91  -6.595  -2.811 -23.968
  678   2HB   SER  91           1HB      SER  91  -4.988  -2.194 -23.981
  679    HG   SER  91            HG      SER  91  -4.458  -3.518 -25.629
  680    H    THR  92             H      THR  92  -5.387  -5.797 -24.862
  681    HA   THR  92            HA      THR  92  -2.790  -7.157 -24.238
  682    HB   THR  92            HB      THR  92  -3.623  -9.012 -25.550
  683    HG1  THR  92           HG1      THR  92  -5.762  -7.295 -26.261
  684   1HG2  THR  92          1HG2      THR  92  -5.867  -7.772 -23.927
  685   2HG2  THR  92          3HG2      THR  92  -5.766  -9.474 -24.396
  686   3HG2  THR  92          2HG2      THR  92  -4.570  -8.790 -23.294
  687    H    GLY  93             H      GLY  93  -4.498  -5.970 -27.158
  688   1HA   GLY  93           2HA      GLY  93  -2.207  -4.638 -28.261
  689   2HA   GLY  93           1HA      GLY  93  -2.385  -6.228 -29.014
  690    H    GLY  94             H      GLY  94  -3.524  -3.004 -28.964
  691   1HA   GLY  94           2HA      GLY  94  -4.884  -2.003 -30.674
  692   2HA   GLY  94           1HA      GLY  94  -5.444  -3.614 -31.136
  693    H    ALA  95             H      ALA  95  -5.799  -3.984 -27.983
  694    HA   ALA  95            HA      ALA  95  -8.654  -3.374 -27.939
  695   1HB   ALA  95           3HB      ALA  95  -6.919  -5.096 -26.516
  696   2HB   ALA  95           2HB      ALA  95  -7.524  -3.947 -25.311
  697   3HB   ALA  95           1HB      ALA  95  -8.659  -4.906 -26.280
  698    HA   PRO  96            HA      PRO  96  -8.506   0.471 -25.848
  699   1HB   PRO  96           2HB      PRO  96 -10.840   0.376 -24.472
  700   2HB   PRO  96           1HB      PRO  96 -10.790   0.396 -26.246
  701   1HG   PRO  96           2HG      PRO  96 -11.475  -1.876 -24.436
  702   2HG   PRO  96           1HG      PRO  96 -11.871  -1.651 -26.150
  703   1HD   PRO  96           2HD      PRO  96  -9.731  -3.251 -25.048
  704   2HD   PRO  96           1HD      PRO  96 -10.166  -3.000 -26.757
  705    H    THR  97             H      THR  97  -7.448   1.272 -24.060
  706    HA   THR  97            HA      THR  97  -7.480  -0.345 -21.505
  707    HB   THR  97            HB      THR  97  -5.451   0.994 -20.877
  708    HG1  THR  97           HG1      THR  97  -5.573   2.827 -22.015
  709   1HG2  THR  97          3HG2      THR  97  -5.485  -1.186 -22.329
  710   2HG2  THR  97          2HG2      THR  97  -4.915  -0.115 -23.611
  711   3HG2  THR  97          1HG2      THR  97  -3.981  -0.288 -22.125
  712    H    PHE  98             H      PHE  98  -7.367   1.117 -19.559
  713    HA   PHE  98            HA      PHE  98  -8.574   3.770 -19.778
  714   1HB   PHE  98           2HB      PHE  98  -9.857   1.497 -18.207
  715   2HB   PHE  98           1HB      PHE  98 -10.387   3.183 -18.187
  716    HD1  PHE  98           HD1      PHE  98 -10.654   4.241 -20.668
  717    HD2  PHE  98           HD2      PHE  98 -11.002   0.057 -19.707
  718    HE1  PHE  98           HE1      PHE  98 -11.958   3.878 -22.738
  719    HE2  PHE  98           HE2      PHE  98 -12.313  -0.306 -21.806
  720    HZ   PHE  98            HZ      PHE  98 -12.792   1.615 -23.304
  721    H    ASN  99             H      ASN  99  -7.614   5.078 -18.135
  722    HA   ASN  99            HA      ASN  99  -5.823   3.488 -16.337
  723   1HB   ASN  99           2HB      ASN  99  -5.243   6.379 -16.939
  724   2HB   ASN  99           1HB      ASN  99  -4.127   5.085 -16.486
  725   1HD2  ASN  99          2HD2      ASN  99  -3.914   5.812 -20.220
  726   2HD2  ASN  99          1HD2      ASN  99  -3.891   6.843 -18.873
  727    H    VAL 100             H      VAL 100  -5.577   3.892 -14.282
  728    HA   VAL 100            HA      VAL 100  -7.454   5.729 -12.927
  729    HB   VAL 100            HB      VAL 100  -6.566   3.098 -11.691
  730   1HG1  VAL 100          2HG1      VAL 100  -8.152   5.115 -10.803
  731   2HG1  VAL 100          1HG1      VAL 100  -9.357   4.018 -11.434
  732   3HG1  VAL 100          3HG1      VAL 100  -8.215   3.477 -10.213
  733   1HG2  VAL 100          1HG2      VAL 100  -8.709   3.415 -13.836
  734   2HG2  VAL 100          3HG2      VAL 100  -7.402   2.233 -13.770
  735   3HG2  VAL 100          2HG2      VAL 100  -8.764   2.105 -12.657
  736    H    THR 101             H      THR 101  -6.681   6.353 -10.856
  737    HA   THR 101            HA      THR 101  -3.835   5.893 -10.227
  738    HB   THR 101            HB      THR 101  -5.432   8.519 -10.003
  739    HG1  THR 101           HG1      THR 101  -2.859   7.913 -11.018
  740   1HG2  THR 101          2HG2      THR 101  -4.362   8.043  -7.829
  741   2HG2  THR 101          1HG2      THR 101  -2.807   7.857  -8.641
  742   3HG2  THR 101          3HG2      THR 101  -3.628   9.408  -8.625
  743    H    VAL 102             H      VAL 102  -3.670   5.895  -7.755
  744    HA   VAL 102            HA      VAL 102  -6.206   5.684  -6.333
  745    HB   VAL 102            HB      VAL 102  -4.457   3.352  -7.066
  746   1HG1  VAL 102          1HG1      VAL 102  -6.095   3.664  -4.511
  747   2HG1  VAL 102          3HG1      VAL 102  -5.858   2.080  -5.253
  748   3HG1  VAL 102          2HG1      VAL 102  -4.470   3.006  -4.687
  749   1HG2  VAL 102          3HG2      VAL 102  -7.359   4.057  -7.017
  750   2HG2  VAL 102          2HG2      VAL 102  -6.339   3.624  -8.373
  751   3HG2  VAL 102          1HG2      VAL 102  -6.817   2.392  -7.212
  752    H    THR 103             H      THR 103  -5.879   6.872  -4.657
  753    HA   THR 103            HA      THR 103  -3.181   7.085  -3.483
  754    HB   THR 103            HB      THR 103  -4.243   9.067  -2.250
  755    HG1  THR 103           HG1      THR 103  -6.317   9.163  -2.633
  756   1HG2  THR 103          2HG2      THR 103  -2.707   9.031  -4.326
  757   2HG2  THR 103          1HG2      THR 103  -4.189   9.348  -5.268
  758   3HG2  THR 103          3HG2      THR 103  -3.649  10.496  -4.030
  759    H    LYS 104             H      LYS 104  -3.171   7.316  -1.075
  760    HA   LYS 104            HA      LYS 104  -5.261   5.701   0.299
  761   1HB   LYS 104           2HB      LYS 104  -3.436   4.193  -0.380
  762   2HB   LYS 104           1HB      LYS 104  -2.279   5.255   0.401
  763   1HG   LYS 104           2HG      LYS 104  -2.532   3.803   2.142
  764   2HG   LYS 104           1HG      LYS 104  -3.933   4.788   2.491
  765   1HD   LYS 104           2HD      LYS 104  -5.377   3.136   1.975
  766   2HD   LYS 104           1HD      LYS 104  -4.499   2.734   0.503
  767   1HE   LYS 104           2HE      LYS 104  -4.564   0.932   2.356
  768   2HE   LYS 104           1HE      LYS 104  -3.002   1.282   1.643
  769   1HZ   LYS 104           1HZ      LYS 104  -3.863   2.766   4.037
  770   2HZ   LYS 104           3HZ      LYS 104  -3.260   1.191   4.211
  771   3HZ   LYS 104           2HZ      LYS 104  -2.292   2.393   3.510
  772    H    THR 105             H      THR 105  -5.486   6.146   2.474
  773    HA   THR 105            HA      THR 105  -3.908   8.420   3.594
  774    HB   THR 105            HB      THR 105  -5.922   9.100   4.786
  775    HG1  THR 105           HG1      THR 105  -7.680   7.885   4.833
  776   1HG2  THR 105          3HG2      THR 105  -5.805   8.917   1.885
  777   2HG2  THR 105          2HG2      THR 105  -7.467   8.954   2.462
  778   3HG2  THR 105          1HG2      THR 105  -6.360  10.248   2.897
  779    H    ASP 106             H      ASP 106  -5.487   7.718   6.215
  780    HA   ASP 106            HA      ASP 106  -3.637   5.555   7.058
  781   1HB   ASP 106           2HB      ASP 106  -3.844   7.743   8.321
  782   2HB   ASP 106           1HB      ASP 106  -5.437   7.198   8.824
  783    H    LYS 107             H      LYS 107  -7.049   6.186   6.505
  784    HA   LYS 107            HA      LYS 107  -7.642   3.336   7.123
  785   1HB   LYS 107           2HB      LYS 107  -9.629   5.342   8.162
  786   2HB   LYS 107           1HB      LYS 107  -9.331   3.698   8.698
  787   1HG   LYS 107           2HG      LYS 107  -7.486   4.326  10.026
  788   2HG   LYS 107           1HG      LYS 107  -7.235   5.829   9.145
  789   1HD   LYS 107           2HD      LYS 107  -8.992   6.920  10.207
  790   2HD   LYS 107           1HD      LYS 107  -9.833   5.418  10.585
  791   1HE   LYS 107           2HE      LYS 107  -8.974   6.045  12.662
  792   2HE   LYS 107           1HE      LYS 107  -7.750   4.922  12.074
  793   1HZ   LYS 107           2HZ      LYS 107  -6.729   7.071  11.070
  794   2HZ   LYS 107           1HZ      LYS 107  -7.649   7.852  12.268
  795   3HZ   LYS 107           3HZ      LYS 107  -6.483   6.703  12.711
  796    H    THR 108             H      THR 108  -7.659   5.364   4.714
  797    HA   THR 108            HA      THR 108 -10.308   4.488   3.667
  798    HB   THR 108            HB      THR 108 -10.862   6.614   2.813
  799    HG1  THR 108           HG1      THR 108  -8.928   7.251   1.938
  800   1HG2  THR 108          2HG2      THR 108 -10.963   6.354   5.344
  801   2HG2  THR 108          1HG2      THR 108  -9.473   7.293   5.414
  802   3HG2  THR 108          3HG2      THR 108 -10.934   8.022   4.754
  803    H    LEU 109             H      LEU 109 -10.259   4.051   1.461
  804    HA   LEU 109            HA      LEU 109  -7.599   3.788   0.165
  805   1HB   LEU 109           2HB      LEU 109  -9.332   1.828   0.913
  806   2HB   LEU 109           1HB      LEU 109  -9.971   2.143  -0.680
  807    HG   LEU 109            HG      LEU 109  -8.050   0.337  -0.095
  808   1HD1  LEU 109          3HD1      LEU 109  -9.320   1.304  -2.364
  809   2HD1  LEU 109          2HD1      LEU 109  -7.608   1.186  -2.773
  810   3HD1  LEU 109          1HD1      LEU 109  -8.473  -0.228  -2.151
  811   1HD2  LEU 109          2HD2      LEU 109  -6.559   2.733  -1.118
  812   2HD2  LEU 109          1HD2      LEU 109  -6.319   1.895   0.413
  813   3HD2  LEU 109          3HD2      LEU 109  -5.928   1.087  -1.099
  814    H    VAL 110             H      VAL 110  -7.749   5.935  -1.014
  815    HA   VAL 110            HA      VAL 110 -10.281   6.472  -2.426
  816    HB   VAL 110            HB      VAL 110  -7.728   8.007  -1.848
  817   1HG1  VAL 110          3HG1      VAL 110  -9.667   8.637  -4.075
  818   2HG1  VAL 110          2HG1      VAL 110  -8.624   9.850  -3.352
  819   3HG1  VAL 110          1HG1      VAL 110  -7.925   8.476  -4.196
  820   1HG2  VAL 110          1HG2      VAL 110 -10.437   7.997  -0.936
  821   2HG2  VAL 110          3HG2      VAL 110  -9.125   9.051  -0.400
  822   3HG2  VAL 110          2HG2      VAL 110 -10.176   9.553  -1.741
  823    H    LEU 111             H      LEU 111 -10.532   6.407  -4.608
  824    HA   LEU 111            HA      LEU 111  -8.228   5.653  -6.299
  825   1HB   LEU 111           2HB      LEU 111 -10.942   4.539  -6.976
  826   2HB   LEU 111           1HB      LEU 111  -9.358   3.944  -7.454
  827    HG   LEU 111            HG      LEU 111 -10.531   3.749  -4.689
  828   1HD1  LEU 111          1HD1      LEU 111 -11.257   2.261  -6.861
  829   2HD1  LEU 111          3HD1      LEU 111  -9.900   1.299  -6.247
  830   3HD1  LEU 111          2HD1      LEU 111 -11.292   1.650  -5.207
  831   1HD2  LEU 111          2HD2      LEU 111  -7.947   3.838  -5.164
  832   2HD2  LEU 111          1HD2      LEU 111  -8.613   2.761  -3.960
  833   3HD2  LEU 111          3HD2      LEU 111  -8.202   2.141  -5.560
  834    H    LEU 112             H      LEU 112  -8.482   6.445  -8.396
  835    HA   LEU 112            HA      LEU 112 -10.634   8.344  -8.959
  836   1HB   LEU 112           2HB      LEU 112  -8.710   9.649  -8.135
  837   2HB   LEU 112           1HB      LEU 112  -7.677   8.743  -9.187
  838    HG   LEU 112            HG      LEU 112  -8.249   9.929 -11.078
  839   1HD1  LEU 112          1HD1      LEU 112 -10.938   9.813 -10.128
  840   2HD1  LEU 112          3HD1      LEU 112 -10.557  11.482 -10.535
  841   3HD1  LEU 112          2HD1      LEU 112 -10.352  10.212 -11.737
  842   1HD2  LEU 112          2HD2      LEU 112  -7.550  11.366  -8.927
  843   2HD2  LEU 112          1HD2      LEU 112  -7.720  12.045 -10.549
  844   3HD2  LEU 112          3HD2      LEU 112  -9.040  12.190  -9.387
  845    H    MET 113             H      MET 113 -11.483   7.082 -10.533
  846    HA   MET 113            HA      MET 113  -9.703   5.669 -12.443
  847   1HB   MET 113           2HB      MET 113 -11.906   4.735 -11.493
  848   2HB   MET 113           1HB      MET 113 -12.660   5.741 -12.682
  849   1HG   MET 113           2HG      MET 113 -10.533   4.302 -13.951
  850   2HG   MET 113           1HG      MET 113 -11.559   3.176 -13.110
  851   1HE   MET 113           1HE      MET 113 -11.863   2.191 -15.553
  852   2HE   MET 113           3HE      MET 113 -13.195   1.982 -14.402
  853   3HE   MET 113           2HE      MET 113 -13.531   2.405 -16.081
  854    H    GLY 114             H      GLY 114  -9.809   5.888 -14.644
  855   1HA   GLY 114           2HA      GLY 114 -11.106   8.194 -15.778
  856   2HA   GLY 114           1HA      GLY 114  -9.369   8.182 -15.842
  857    H    LYS 115             H      LYS 115 -11.169   8.175 -18.006
  858    HA   LYS 115            HA      LYS 115 -10.410   5.736 -19.422
  859   1HB   LYS 115           2HB      LYS 115 -13.083   7.118 -19.376
  860   2HB   LYS 115           1HB      LYS 115 -12.558   6.181 -20.781
  861   1HG   LYS 115           2HG      LYS 115 -11.946   4.386 -18.913
  862   2HG   LYS 115           1HG      LYS 115 -13.205   5.225 -18.031
  863   1HD   LYS 115           2HD      LYS 115 -14.811   4.816 -19.787
  864   2HD   LYS 115           1HD      LYS 115 -13.561   4.172 -20.834
  865   1HE   LYS 115           2HE      LYS 115 -13.356   2.198 -19.605
  866   2HE   LYS 115           1HE      LYS 115 -14.019   2.931 -18.144
  867   1HZ   LYS 115           1HZ      LYS 115 -16.146   3.162 -19.478
  868   2HZ   LYS 115           3HZ      LYS 115 -15.456   2.075 -20.581
  869   3HZ   LYS 115           2HZ      LYS 115 -15.724   1.596 -18.973
  870    H    GLU 116             H      GLU 116 -10.354   6.184 -21.773
  871    HA   GLU 116            HA      GLU 116  -8.503   7.574 -22.882
  872   1HB   GLU 116           2HB      GLU 116 -10.250   6.517 -23.829
  873   2HB   GLU 116           1HB      GLU 116 -11.180   7.944 -23.791
  874   1HG   GLU 116           2HG      GLU 116  -9.942   8.957 -25.490
  875   2HG   GLU 116           1HG      GLU 116  -8.490   8.056 -25.065
  876    H    GLY 117             H      GLY 117  -7.837   9.405 -23.819
  877   1HA   GLY 117           2HA      GLY 117  -7.426  11.732 -23.966
  878   2HA   GLY 117           1HA      GLY 117  -8.992  12.029 -23.151
  879    H    VAL 118             H      VAL 118  -7.364   9.332 -21.891
  880    HA   VAL 118            HA      VAL 118  -6.770  10.652 -19.406
  881    HB   VAL 118            HB      VAL 118  -8.475   8.755 -20.053
  882   1HG1  VAL 118          1HG1      VAL 118  -6.745   7.224 -20.920
  883   2HG1  VAL 118          3HG1      VAL 118  -6.200   7.012 -19.255
  884   3HG1  VAL 118          2HG1      VAL 118  -7.860   6.572 -19.695
  885   1HG2  VAL 118          2HG2      VAL 118  -7.432   9.721 -17.690
  886   2HG2  VAL 118          1HG2      VAL 118  -8.724   8.522 -17.769
  887   3HG2  VAL 118          3HG2      VAL 118  -7.040   7.987 -17.522
  888    H    HIS 119             H      HIS 119  -4.617  11.351 -19.540
  889    HA   HIS 119            HA      HIS 119  -2.528   9.647 -20.684
  890   1HB   HIS 119           2HB      HIS 119  -2.409  12.168 -20.616
  891   2HB   HIS 119           1HB      HIS 119  -2.146  12.042 -18.879
  892    HD1  HIS 119           HD1      HIS 119  -0.519  11.375 -22.181
  893    HD2  HIS 119           HD2      HIS 119   0.376  10.936 -18.135
  894    HE1  HIS 119           HE1      HIS 119   1.958  10.859 -22.046
  895    H    GLY 120             H      GLY 120  -3.862  10.390 -17.517
  896   1HA   GLY 120           2HA      GLY 120  -3.865   8.791 -15.708
  897   2HA   GLY 120           1HA      GLY 120  -2.392   8.078 -16.380
  898    H    GLY 121             H      GLY 121  -1.523  11.133 -16.733
  899   1HA   GLY 121           2HA      GLY 121  -0.057  11.255 -14.178
  900   2HA   GLY 121           1HA      GLY 121   0.193  12.312 -15.566
  901    H    LEU 122             H      LEU 122  -2.613  13.083 -15.811
  902    HA   LEU 122            HA      LEU 122  -2.736  15.209 -13.837
  903   1HB   LEU 122           2HB      LEU 122  -5.151  14.609 -15.520
  904   2HB   LEU 122           1HB      LEU 122  -4.475  16.162 -15.079
  905    HG   LEU 122            HG      LEU 122  -4.027  16.124 -17.360
  906   1HD1  LEU 122          3HD1      LEU 122  -1.813  15.923 -15.806
  907   2HD1  LEU 122          2HD1      LEU 122  -1.551  14.567 -16.902
  908   3HD1  LEU 122          1HD1      LEU 122  -1.762  16.192 -17.549
  909   1HD2  LEU 122          1HD2      LEU 122  -4.270  13.238 -16.997
  910   2HD2  LEU 122          3HD2      LEU 122  -4.634  14.225 -18.413
  911   3HD2  LEU 122          2HD2      LEU 122  -2.990  13.655 -18.135
  912    H    ILE 123             H      ILE 123  -4.304  12.137 -14.516
  913    HA   ILE 123            HA      ILE 123  -6.328  12.288 -12.476
  914    HB   ILE 123            HB      ILE 123  -4.895  10.073 -13.908
  915   1HG1  ILE 123          2HG1      ILE 123  -7.729  11.215 -14.043
  916   2HG1  ILE 123          1HG1      ILE 123  -6.474  11.377 -15.271
  917   1HG2  ILE 123          2HG2      ILE 123  -6.341   9.771 -11.406
  918   2HG2  ILE 123          1HG2      ILE 123  -7.267   8.994 -12.687
  919   3HG2  ILE 123          3HG2      ILE 123  -5.598   8.513 -12.386
  920   1HD1  ILE 123          2HD1      ILE 123  -7.658   8.742 -14.376
  921   2HD1  ILE 123          1HD1      ILE 123  -8.157   9.652 -15.792
  922   3HD1  ILE 123          3HD1      ILE 123  -6.527   9.003 -15.702
  923    H    ASN 124             H      ASN 124  -2.959  11.176 -12.625
  924    HA   ASN 124            HA      ASN 124  -2.723  10.147 -10.003
  925   1HB   ASN 124           2HB      ASN 124  -0.988   9.984 -11.827
  926   2HB   ASN 124           1HB      ASN 124  -0.575  11.661 -11.477
  927   1HD2  ASN 124          2HD2      ASN 124   1.588  10.651  -8.895
  928   2HD2  ASN 124          1HD2      ASN 124   1.269  11.713 -10.180
  929    H    LYS 125             H      LYS 125  -2.758  13.382 -11.338
  930    HA   LYS 125            HA      LYS 125  -1.890  14.696  -8.788
  931   1HB   LYS 125           2HB      LYS 125  -2.889  15.643 -11.495
  932   2HB   LYS 125           1HB      LYS 125  -2.748  16.774 -10.138
  933   1HG   LYS 125           2HG      LYS 125  -0.364  15.091 -10.403
  934   2HG   LYS 125           1HG      LYS 125  -0.687  16.012 -11.872
  935   1HD   LYS 125           2HD      LYS 125  -0.856  18.086 -10.511
  936   2HD   LYS 125           1HD      LYS 125  -0.447  17.150  -9.072
  937   1HE   LYS 125           2HE      LYS 125   1.665  17.882  -9.654
  938   2HE   LYS 125           1HE      LYS 125   1.606  16.389 -10.592
  939   1HZ   LYS 125           1HZ      LYS 125   0.527  17.974 -12.355
  940   2HZ   LYS 125           3HZ      LYS 125   1.379  19.166 -11.498
  941   3HZ   LYS 125           2HZ      LYS 125   2.216  17.864 -12.198
  942    H    LYS 126             H      LYS 126  -4.996  14.037 -10.420
  943    HA   LYS 126            HA      LYS 126  -6.578  15.648  -8.583
  944   1HB   LYS 126           2HB      LYS 126  -7.118  13.902 -10.940
  945   2HB   LYS 126           1HB      LYS 126  -8.439  14.171  -9.800
  946   1HG   LYS 126           2HG      LYS 126  -8.788  16.071 -11.020
  947   2HG   LYS 126           1HG      LYS 126  -7.469  16.713 -10.046
  948   1HD   LYS 126           2HD      LYS 126  -7.010  17.142 -12.405
  949   2HD   LYS 126           1HD      LYS 126  -5.864  15.960 -11.791
  950   1HE   LYS 126           2HE      LYS 126  -6.571  14.409 -13.273
  951   2HE   LYS 126           1HE      LYS 126  -8.243  14.632 -12.792
  952   1HZ   LYS 126           3HZ      LYS 126  -7.942  16.827 -14.174
  953   2HZ   LYS 126           2HZ      LYS 126  -6.732  15.913 -14.941
  954   3HZ   LYS 126           1HZ      LYS 126  -8.338  15.361 -14.926
  955    H    CYS 127             H      CYS 127  -5.207  12.544  -8.435
  956    HA   CYS 127            HA      CYS 127  -7.223  11.458  -6.579
  957   1HB   CYS 127           2HB      CYS 127  -5.801  10.123  -8.385
  958   2HB   CYS 127           1HB      CYS 127  -4.597  10.123  -7.121
  959    HG   CYS 127            HG      CYS 127  -7.368   9.196  -6.187
  960    OH   TYR 128            OH      TYR 128   2.519  13.881  -2.361
  961    H    TYR 128             H      TYR 128  -4.019  12.850  -6.808
  962    HA   TYR 128            HA      TYR 128  -3.119  12.458  -4.112
  963   1HB   TYR 128           2HB      TYR 128  -2.043  13.453  -6.391
  964   2HB   TYR 128           1HB      TYR 128  -2.522  14.969  -5.656
  965    HD1  TYR 128           HD1      TYR 128  -2.028  13.748  -2.710
  966    HD2  TYR 128           HD2      TYR 128   0.270  14.085  -6.335
  967    HE1  TYR 128           HE1      TYR 128   0.065  13.726  -1.377
  968    HE2  TYR 128           HE2      TYR 128   2.368  14.059  -4.995
  969    HH   TYR 128            HH      TYR 128   3.110  14.540  -2.731
  970    H    GLU 129             H      GLU 129  -5.244  14.805  -5.750
  971    HA   GLU 129            HA      GLU 129  -5.474  16.581  -3.387
  972   1HB   GLU 129           2HB      GLU 129  -6.817  16.476  -6.089
  973   2HB   GLU 129           1HB      GLU 129  -7.362  17.589  -4.836
  974   1HG   GLU 129           2HG      GLU 129  -4.717  18.084  -4.716
  975   2HG   GLU 129           1HG      GLU 129  -4.835  17.598  -6.410
  976    H    MET 130             H      MET 130  -7.439  14.071  -4.948
  977    HA   MET 130            HA      MET 130  -9.847  14.292  -3.423
  978   1HB   MET 130           2HB      MET 130  -9.018  12.732  -5.487
  979   2HB   MET 130           1HB      MET 130  -8.755  11.587  -4.187
  980   1HG   MET 130           2HG      MET 130 -11.199  12.053  -3.492
  981   2HG   MET 130           1HG      MET 130 -11.376  12.855  -5.069
  982   1HE   MET 130           2HE      MET 130 -13.100  10.905  -4.117
  983   2HE   MET 130           1HE      MET 130 -13.380  10.736  -5.847
  984   3HE   MET 130           3HE      MET 130 -13.082   9.303  -4.849
  985    H    ALA 131             H      ALA 131  -6.782  12.593  -2.812
  986    HA   ALA 131            HA      ALA 131  -7.519  11.619  -0.135
  987   1HB   ALA 131           3HB      ALA 131  -5.150  11.370  -1.976
  988   2HB   ALA 131           2HB      ALA 131  -4.857  11.229  -0.229
  989   3HB   ALA 131           1HB      ALA 131  -5.986  10.136  -1.013
  990    H    SER 132             H      SER 132  -6.068  14.477  -1.534
  991    HA   SER 132            HA      SER 132  -4.488  15.373   0.661
  992   1HB   SER 132           2HB      SER 132  -6.021  16.885  -1.459
  993   2HB   SER 132           1HB      SER 132  -5.104  17.718  -0.217
  994    HG   SER 132            HG      SER 132  -3.708  17.425  -1.875
  995    H    HIS 133             H      HIS 133  -7.987  15.393   0.043
  996    HA   HIS 133            HA      HIS 133  -8.457  16.937   2.503
  997   1HB   HIS 133           2HB      HIS 133 -10.038  16.960   0.503
  998   2HB   HIS 133           1HB      HIS 133 -10.634  15.379   1.097
  999    HD1  HIS 133           HD1      HIS 133 -12.076  15.392   3.169
 1000    HD2  HIS 133           HD2      HIS 133 -10.337  19.122   2.476
 1001    HE1  HIS 133           HE1      HIS 133 -13.117  16.993   4.838
 1002    H    LEU 134             H      LEU 134  -8.644  13.506   1.367
 1003    HA   LEU 134            HA      LEU 134  -9.699  12.568   3.903
 1004   1HB   LEU 134           2HB      LEU 134  -8.165  11.243   1.695
 1005   2HB   LEU 134           1HB      LEU 134  -8.586  10.383   3.176
 1006    HG   LEU 134            HG      LEU 134 -10.944  11.646   2.501
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.384  11.102   0.062
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.061  10.571   0.044
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.675  12.262   0.339
 1010   1HD2  LEU 134          3HD2      LEU 134 -10.427   9.260   3.285
 1011   2HD2  LEU 134          2HD2      LEU 134 -11.785   9.444   2.176
 1012   3HD2  LEU 134          1HD2      LEU 134 -10.228   8.868   1.580
 1013    NH1  ARG 135           NH1      ARG 135  -1.994  11.945   7.183
 1014    NH2  ARG 135           NH2      ARG 135   0.044  11.813   6.213
 1015    H    ARG 135             H      ARG 135  -6.683  13.850   3.178
 1016    HA   ARG 135            HA      ARG 135  -5.281  12.540   5.420
 1017   1HB   ARG 135           2HB      ARG 135  -4.463  14.599   3.343
 1018   2HB   ARG 135           1HB      ARG 135  -3.463  14.273   4.759
 1019   1HG   ARG 135           2HG      ARG 135  -4.410  12.072   2.915
 1020   2HG   ARG 135           1HG      ARG 135  -2.894  12.939   2.651
 1021   1HD   ARG 135           2HD      ARG 135  -3.611  11.501   5.224
 1022   2HD   ARG 135           1HD      ARG 135  -2.591  10.827   3.958
 1023    HE   ARG 135            HE      ARG 135  -1.360  13.218   4.512
 1024   1HH1  ARG 135          2HH1      ARG 135  -2.972  12.144   7.120
 1025   2HH1  ARG 135          1HH1      ARG 135  -1.601  11.644   8.052
 1026   1HH2  ARG 135          1HH2      ARG 135   0.627  11.904   5.405
 1027   2HH2  ARG 135          2HH2      ARG 135   0.440  11.526   7.084
 1028    NH1  ARG 136           NH2      ARG 136  -7.531  22.312   4.769
 1029    NH2  ARG 136           NH1      ARG 136  -7.253  22.139   2.532
 1030    H    ARG 136             H      ARG 136  -6.684  15.592   4.351
 1031    HA   ARG 136            HA      ARG 136  -6.276  16.942   6.910
 1032   1HB   ARG 136           2HB      ARG 136  -7.724  17.573   4.359
 1033   2HB   ARG 136           1HB      ARG 136  -8.076  18.513   5.807
 1034   1HG   ARG 136           2HG      ARG 136  -5.970  19.473   5.870
 1035   2HG   ARG 136           1HG      ARG 136  -5.207  18.103   5.063
 1036   1HD   ARG 136           2HD      ARG 136  -5.439  19.088   3.046
 1037   2HD   ARG 136           1HD      ARG 136  -7.165  19.336   3.308
 1038    HE   ARG 136            HE      ARG 136  -5.051  21.256   4.206
 1039   1HH1  ARG 136          1HH2      ARG 136  -7.267  22.050   5.697
 1040   2HH1  ARG 136          2HH2      ARG 136  -8.271  22.972   4.627
 1041   1HH2  ARG 136          2HH1      ARG 136  -6.774  21.746   1.747
 1042   2HH2  ARG 136          1HH1      ARG 136  -7.995  22.794   2.389
 1043    H    SER 137             H      SER 137  -8.267  14.458   5.926
 1044    HA   SER 137            HA      SER 137 -10.689  15.221   7.358
 1045   1HB   SER 137           2HB      SER 137 -11.614  13.223   6.403
 1046   2HB   SER 137           1HB      SER 137 -10.564  13.836   5.151
 1047    HG   SER 137            HG      SER 137 -10.318  11.576   5.583
 1048    H    GLN 138             H      GLN 138  -7.642  13.676   8.012
 1049    HA   GLN 138            HA      GLN 138  -6.793  12.714   9.977
 1050   1HB   GLN 138           2HB      GLN 138  -9.144  14.235  10.890
 1051   2HB   GLN 138           1HB      GLN 138  -8.799  12.843  11.914
 1052   1HG   GLN 138           2HG      GLN 138  -6.381  14.344  11.155
 1053   2HG   GLN 138           1HG      GLN 138  -7.532  15.308  12.078
 1054   1HE2  GLN 138          2HE2      GLN 138  -5.222  12.922  14.164
 1055   2HE2  GLN 138          1HE2      GLN 138  -4.844  13.660  12.683
 1056    OH   TYR 139            OH      TYR 139 -15.470  10.039   9.771
 1057    H    TYR 139             H      TYR 139  -8.529  11.278   7.966
 1058    HA   TYR 139            HA      TYR 139  -9.662   9.070   9.621
 1059   1HB   TYR 139           2HB      TYR 139 -10.089  10.068   6.836
 1060   2HB   TYR 139           1HB      TYR 139 -10.240   8.333   7.088
 1061    HD1  TYR 139           HD1      TYR 139 -11.427   7.956   9.642
 1062    HD2  TYR 139           HD2      TYR 139 -12.181  11.082   6.798
 1063    HE1  TYR 139           HE1      TYR 139 -13.689   8.276  10.598
 1064    HE2  TYR 139           HE2      TYR 139 -14.442  11.406   7.758
 1065    HH   TYR 139            HH      TYR 139 -16.047   9.365   9.398
   
  Start of MODEL           7
 Raw file had 1065 H/Q atoms
  Start of MODEL    7
    1   1H    ALA   1            2H      ALA   1 -14.271  15.165   5.380
    2   2H    ALA   1            1H      ALA   1 -14.931  14.564   6.826
    3   3H    ALA   1            3H      ALA   1 -15.086  13.673   5.392
    4    HA   ALA   1            HA      ALA   1 -17.153  14.618   5.537
    5   1HB   ALA   1           3HB      ALA   1 -15.694  16.534   7.166
    6   2HB   ALA   1           2HB      ALA   1 -16.791  17.362   6.063
    7   3HB   ALA   1           1HB      ALA   1 -17.415  16.147   7.177
    8    H    GLY   2             H      GLY   2 -18.227  15.677   3.807
    9   1HA   GLY   2           2HA      GLY   2 -18.426  16.974   1.812
   10   2HA   GLY   2           1HA      GLY   2 -16.725  17.429   1.970
   11    CH2  TRP   3           CH2      TRP   3 -12.828  11.377   3.810
   12    H    TRP   3             H      TRP   3 -17.712  14.075   2.193
   13    HA   TRP   3            HA      TRP   3 -15.928  12.990   0.391
   14   1HB   TRP   3           2HB      TRP   3 -18.483  12.161   1.410
   15   2HB   TRP   3           1HB      TRP   3 -17.811  11.242   0.098
   16    HD1  TRP   3           HD1      TRP   3 -18.000   9.553   2.329
   17    HE1  TRP   3           HE1      TRP   3 -16.124   8.774   3.887
   18    HE3  TRP   3           HE3      TRP   3 -14.491  13.310   1.547
   19    HZ2  TRP   3           HZ2      TRP   3 -13.552   9.571   4.700
   20    HZ3  TRP   3           HZ3      TRP   3 -12.358  13.194   2.767
   21    HH2  TRP   3           HH2      TRP   3 -11.885  11.343   4.335
   22    H    ASN   4             H      ASN   4 -19.295  13.854  -0.318
   23    HA   ASN   4            HA      ASN   4 -19.339  13.124  -3.053
   24   1HB   ASN   4           2HB      ASN   4 -21.184  14.968  -3.229
   25   2HB   ASN   4           1HB      ASN   4 -21.473  13.599  -2.157
   26   1HD2  ASN   4          2HD2      ASN   4 -20.680  17.281  -0.490
   27   2HD2  ASN   4          1HD2      ASN   4 -20.156  16.965  -2.073
   28    H    ALA   5             H      ALA   5 -17.919  15.879  -1.580
   29    HA   ALA   5            HA      ALA   5 -17.650  17.572  -3.954
   30   1HB   ALA   5           3HB      ALA   5 -17.505  18.425  -1.562
   31   2HB   ALA   5           2HB      ALA   5 -15.955  17.600  -1.414
   32   3HB   ALA   5           1HB      ALA   5 -16.145  18.914  -2.575
   33    OH   TYR   6            OH      TYR   6 -13.033  17.915   1.446
   34    H    TYR   6             H      TYR   6 -15.624  15.168  -2.237
   35    HA   TYR   6            HA      TYR   6 -13.395  15.447  -4.126
   36   1HB   TYR   6           2HB      TYR   6 -13.896  13.125  -2.249
   37   2HB   TYR   6           1HB      TYR   6 -12.346  13.650  -2.930
   38    HD1  TYR   6           HD2      TYR   6 -11.602  16.070  -2.461
   39    HD2  TYR   6           HD1      TYR   6 -14.673  14.079  -0.329
   40    HE1  TYR   6           HE2      TYR   6 -11.497  17.820  -0.704
   41    HE2  TYR   6           HE1      TYR   6 -14.603  15.789   1.441
   42    HH   TYR   6            HH      TYR   6 -13.767  18.512   1.270
   43    H    ILE   7             H      ILE   7 -16.451  14.075  -4.239
   44    HA   ILE   7            HA      ILE   7 -15.851  12.172  -6.396
   45    HB   ILE   7            HB      ILE   7 -18.294  12.882  -4.826
   46   1HG1  ILE   7          2HG1      ILE   7 -16.469  11.191  -4.146
   47   2HG1  ILE   7          1HG1      ILE   7 -18.136  10.646  -4.057
   48   1HG2  ILE   7          1HG2      ILE   7 -18.141  11.680  -7.536
   49   2HG2  ILE   7          3HG2      ILE   7 -19.271  10.952  -6.388
   50   3HG2  ILE   7          2HG2      ILE   7 -19.424  12.659  -6.820
   51   1HD1  ILE   7          1HD1      ILE   7 -16.841  10.206  -6.662
   52   2HD1  ILE   7          3HD1      ILE   7 -16.114   9.303  -5.334
   53   3HD1  ILE   7          2HD1      ILE   7 -17.827   9.110  -5.703
   54    H    ASP   8             H      ASP   8 -16.973  15.400  -5.709
   55    HA   ASP   8            HA      ASP   8 -18.003  16.142  -8.206
   56   1HB   ASP   8           2HB      ASP   8 -17.182  17.526  -5.775
   57   2HB   ASP   8           1HB      ASP   8 -17.265  18.497  -7.184
   58    H    ASN   9             H      ASN   9 -14.849  15.588  -7.019
   59    HA   ASN   9            HA      ASN   9 -13.159  17.097  -8.598
   60   1HB   ASN   9           2HB      ASN   9 -11.843  15.860  -7.214
   61   2HB   ASN   9           1HB      ASN   9 -13.107  14.844  -6.842
   62   1HD2  ASN   9          2HD2      ASN   9 -11.520  11.876  -8.344
   63   2HD2  ASN   9          1HD2      ASN   9 -12.535  12.530  -7.128
   64    H    LEU  10             H      LEU  10 -14.206  13.972  -9.186
   65    HA   LEU  10            HA      LEU  10 -13.505  13.296 -11.750
   66   1HB   LEU  10           2HB      LEU  10 -16.083  12.827 -10.302
   67   2HB   LEU  10           1HB      LEU  10 -15.595  11.940 -11.707
   68    HG   LEU  10            HG      LEU  10 -14.850  10.502 -10.209
   69   1HD1  LEU  10          3HD1      LEU  10 -12.571  12.489 -10.119
   70   2HD1  LEU  10          2HD1      LEU  10 -12.459  10.876  -9.469
   71   3HD1  LEU  10          1HD1      LEU  10 -12.737  11.106 -11.173
   72   1HD2  LEU  10          1HD2      LEU  10 -15.003  12.774  -8.295
   73   2HD2  LEU  10          3HD2      LEU  10 -15.699  11.196  -8.150
   74   3HD2  LEU  10          2HD2      LEU  10 -13.991  11.466  -7.839
   75    H    MET  11             H      MET  11 -16.230  14.957 -10.560
   76    HA   MET  11            HA      MET  11 -17.347  15.170 -13.222
   77   1HB   MET  11           2HB      MET  11 -18.098  16.521 -10.606
   78   2HB   MET  11           1HB      MET  11 -19.141  16.316 -12.022
   79   1HG   MET  11           2HG      MET  11 -17.815  13.796 -10.636
   80   2HG   MET  11           1HG      MET  11 -19.419  14.453 -10.140
   81   1HE   MET  11           3HE      MET  11 -17.752  11.950 -11.880
   82   2HE   MET  11           2HE      MET  11 -18.445  11.679 -13.480
   83   3HE   MET  11           1HE      MET  11 -17.331  13.021 -13.225
   84    H    ALA  12             H      ALA  12 -15.384  17.251 -11.233
   85    HA   ALA  12            HA      ALA  12 -15.357  19.536 -13.006
   86   1HB   ALA  12           1HB      ALA  12 -14.069  18.901 -10.366
   87   2HB   ALA  12           3HB      ALA  12 -13.566  20.314 -11.301
   88   3HB   ALA  12           2HB      ALA  12 -15.237  20.173 -10.747
   89    H    ASP  13             H      ASP  13 -13.592  16.608 -13.086
   90    HA   ASP  13            HA      ASP  13 -11.023  17.860 -13.998
   91   1HB   ASP  13           2HB      ASP  13 -10.393  15.238 -14.074
   92   2HB   ASP  13           1HB      ASP  13 -10.302  16.198 -12.615
   93    H    GLY  14             H      GLY  14 -13.707  16.763 -15.705
   94   1HA   GLY  14           2HA      GLY  14 -13.959  15.933 -17.972
   95   2HA   GLY  14           1HA      GLY  14 -12.784  17.192 -18.296
   96    H    THR  15             H      THR  15 -11.548  14.531 -16.424
   97    HA   THR  15            HA      THR  15 -10.317  13.105 -18.681
   98    HB   THR  15            HB      THR  15  -9.003  14.267 -16.256
   99    HG1  THR  15           HG1      THR  15  -8.343  15.617 -17.691
  100   1HG2  THR  15          3HG2      THR  15  -8.016  12.101 -18.133
  101   2HG2  THR  15          2HG2      THR  15  -6.959  13.019 -17.027
  102   3HG2  THR  15          1HG2      THR  15  -8.259  12.005 -16.371
  103    H    CYS  16             H      CYS  16 -12.082  13.005 -15.782
  104    HA   CYS  16            HA      CYS  16 -11.194  10.456 -14.964
  105   1HB   CYS  16           2HB      CYS  16 -12.308  10.961 -12.999
  106   2HB   CYS  16           1HB      CYS  16 -12.083  12.536 -13.616
  107    HG   CYS  16            HG      CYS  16 -14.776  11.095 -13.493
  108    H    GLN  17             H      GLN  17 -13.328   9.143 -14.248
  109    HA   GLN  17            HA      GLN  17 -15.283   8.838 -16.387
  110   1HB   GLN  17           2HB      GLN  17 -13.034   7.475 -16.623
  111   2HB   GLN  17           1HB      GLN  17 -13.825   6.393 -15.541
  112   1HG   GLN  17           2HG      GLN  17 -15.227   7.377 -17.977
  113   2HG   GLN  17           1HG      GLN  17 -13.997   6.098 -18.129
  114   1HE2  GLN  17          2HE2      GLN  17 -17.671   5.223 -16.581
  115   2HE2  GLN  17          1HE2      GLN  17 -17.295   6.778 -17.152
  116    H    ASP  18             H      ASP  18 -13.777   7.481 -13.487
  117    HA   ASP  18            HA      ASP  18 -16.273   7.609 -12.017
  118   1HB   ASP  18           2HB      ASP  18 -15.759   5.273 -13.050
  119   2HB   ASP  18           1HB      ASP  18 -14.706   5.138 -11.650
  120    H    ALA  19             H      ALA  19 -15.506   6.633  -9.624
  121    HA   ALA  19            HA      ALA  19 -12.867   7.660  -8.732
  122   1HB   ALA  19           1HB      ALA  19 -15.319   9.290  -8.873
  123   2HB   ALA  19           3HB      ALA  19 -14.472   9.272  -7.301
  124   3HB   ALA  19           2HB      ALA  19 -13.604   9.668  -8.752
  125    H    ALA  20             H      ALA  20 -12.495   6.477  -6.724
  126    HA   ALA  20            HA      ALA  20 -15.033   5.944  -5.186
  127   1HB   ALA  20           3HB      ALA  20 -13.264   3.807  -6.210
  128   2HB   ALA  20           2HB      ALA  20 -14.163   3.575  -4.707
  129   3HB   ALA  20           1HB      ALA  20 -15.017   3.933  -6.209
  130    H    ILE  21             H      ILE  21 -14.798   6.791  -3.353
  131    HA   ILE  21            HA      ILE  21 -12.243   6.585  -1.861
  132    HB   ILE  21            HB      ILE  21 -14.925   7.763  -0.990
  133   1HG1  ILE  21          2HG1      ILE  21 -12.560   8.933  -2.492
  134   2HG1  ILE  21          1HG1      ILE  21 -14.271   9.058  -2.886
  135   1HG2  ILE  21          2HG2      ILE  21 -13.367   7.150   0.853
  136   2HG2  ILE  21          1HG2      ILE  21 -12.095   8.105   0.099
  137   3HG2  ILE  21          3HG2      ILE  21 -13.538   8.902   0.732
  138   1HD1  ILE  21          1HD1      ILE  21 -14.441  10.361  -0.634
  139   2HD1  ILE  21          3HD1      ILE  21 -12.697  10.536  -0.801
  140   3HD1  ILE  21          2HD1      ILE  21 -13.772  11.183  -2.040
  141    H    VAL  22             H      VAL  22 -12.068   4.691  -0.556
  142    HA   VAL  22            HA      VAL  22 -14.612   3.197  -0.042
  143    HB   VAL  22            HB      VAL  22 -11.916   2.064  -0.932
  144   1HG1  VAL  22          2HG1      VAL  22 -13.298   0.563   0.579
  145   2HG1  VAL  22          1HG1      VAL  22 -14.548   0.586  -0.663
  146   3HG1  VAL  22          3HG1      VAL  22 -12.960  -0.104  -1.021
  147   1HG2  VAL  22          3HG2      VAL  22 -14.514   2.579  -2.380
  148   2HG2  VAL  22          2HG2      VAL  22 -12.887   3.097  -2.833
  149   3HG2  VAL  22          1HG2      VAL  22 -13.342   1.395  -2.968
  150    H    GLY  23             H      GLY  23 -14.840   2.993   2.197
  151   1HA   GLY  23           2HA      GLY  23 -12.658   3.139   4.108
  152   2HA   GLY  23           1HA      GLY  23 -14.304   2.585   4.466
  153    OH   TYR  24            OH      TYR  24  -5.376   1.323   5.347
  154    H    TYR  24             H      TYR  24 -11.236   1.595   3.202
  155    HA   TYR  24            HA      TYR  24 -11.812  -1.175   2.728
  156   1HB   TYR  24           2HB      TYR  24  -9.645  -1.202   1.755
  157   2HB   TYR  24           1HB      TYR  24 -10.156   0.442   1.569
  158    HD1  TYR  24           HD1      TYR  24  -9.631   1.930   3.901
  159    HD2  TYR  24           HD2      TYR  24  -7.520  -1.477   2.534
  160    HE1  TYR  24           HE1      TYR  24  -7.668   2.611   5.223
  161    HE2  TYR  24           HE2      TYR  24  -5.542  -0.823   3.811
  162    HH   TYR  24            HH      TYR  24  -5.235   0.658   6.025
  163    H    LYS  25             H      LYS  25 -12.051  -0.247   5.623
  164    HA   LYS  25            HA      LYS  25  -9.895  -1.159   7.171
  165   1HB   LYS  25           2HB      LYS  25 -12.773  -0.778   7.750
  166   2HB   LYS  25           1HB      LYS  25 -11.678  -1.352   8.970
  167   1HG   LYS  25           2HG      LYS  25 -11.716   0.993   9.276
  168   2HG   LYS  25           1HG      LYS  25 -10.223   0.687   8.395
  169   1HD   LYS  25           2HD      LYS  25 -11.043   1.532   6.428
  170   2HD   LYS  25           1HD      LYS  25 -12.720   1.194   6.856
  171   1HE   LYS  25           2HE      LYS  25 -11.017   3.282   8.238
  172   2HE   LYS  25           1HE      LYS  25 -12.142   3.641   6.927
  173   1HZ   LYS  25           3HZ      LYS  25 -13.869   2.489   8.361
  174   2HZ   LYS  25           2HZ      LYS  25 -12.757   2.616   9.637
  175   3HZ   LYS  25           1HZ      LYS  25 -13.345   4.012   8.881
  176    H    ASP  26             H      ASP  26 -11.186  -3.074   8.877
  177    HA   ASP  26            HA      ASP  26 -10.463  -5.585   7.873
  178   1HB   ASP  26           2HB      ASP  26 -12.477  -6.449   9.317
  179   2HB   ASP  26           1HB      ASP  26 -11.052  -5.800  10.094
  180    H    SER  27             H      SER  27 -13.734  -4.269   7.858
  181    HA   SER  27            HA      SER  27 -14.434  -5.931   5.537
  182   1HB   SER  27           2HB      SER  27 -16.753  -5.082   6.193
  183   2HB   SER  27           1HB      SER  27 -16.042  -6.283   7.233
  184    HG   SER  27            HG      SER  27 -16.117  -4.865   8.771
  185    HA   PRO  28            HA      PRO  28 -13.853  -2.014   3.545
  186   1HB   PRO  28           2HB      PRO  28 -14.228  -2.868   0.972
  187   2HB   PRO  28           1HB      PRO  28 -12.723  -3.070   1.888
  188   1HG   PRO  28           2HG      PRO  28 -14.691  -5.123   1.142
  189   2HG   PRO  28           1HG      PRO  28 -13.055  -5.302   1.726
  190   1HD   PRO  28           2HD      PRO  28 -15.472  -5.637   3.192
  191   2HD   PRO  28           1HD      PRO  28 -13.798  -5.862   3.743
  192    H    SER  29             H      SER  29 -15.034  -0.458   2.204
  193    HA   SER  29            HA      SER  29 -17.748  -0.974   1.458
  194   1HB   SER  29           2HB      SER  29 -18.659   0.807   2.994
  195   2HB   SER  29           1HB      SER  29 -18.187  -0.678   3.804
  196    HG   SER  29            HG      SER  29 -17.274   1.805   4.186
  197    H    VAL  30             H      VAL  30 -18.683   0.892   0.407
  198    HA   VAL  30            HA      VAL  30 -16.637   2.555  -0.851
  199    HB   VAL  30            HB      VAL  30 -19.527   1.908  -1.447
  200   1HG1  VAL  30          2HG1      VAL  30 -18.937   4.287  -2.082
  201   2HG1  VAL  30          1HG1      VAL  30 -17.654   3.628  -3.099
  202   3HG1  VAL  30          3HG1      VAL  30 -19.338   3.252  -3.461
  203   1HG2  VAL  30          1HG2      VAL  30 -16.893   0.849  -2.184
  204   2HG2  VAL  30          3HG2      VAL  30 -18.495   0.132  -2.412
  205   3HG2  VAL  30          2HG2      VAL  30 -17.860   1.270  -3.588
  206    CH2  TRP  31           CH2      TRP  31 -13.567   5.682   6.998
  207    H    TRP  31             H      TRP  31 -16.194   4.184   0.562
  208    HA   TRP  31            HA      TRP  31 -18.138   5.491   2.210
  209   1HB   TRP  31           2HB      TRP  31 -15.248   5.905   1.541
  210   2HB   TRP  31           1HB      TRP  31 -16.115   7.218   2.336
  211    HD1  TRP  31           HD1      TRP  31 -17.534   3.928   3.323
  212    HE1  TRP  31           HE1      TRP  31 -16.756   3.273   5.639
  213    HE3  TRP  31           HE3      TRP  31 -13.744   7.316   4.019
  214    HZ2  TRP  31           HZ2      TRP  31 -14.828   4.040   7.578
  215    HZ3  TRP  31           HZ3      TRP  31 -12.475   7.323   6.141
  216    HH2  TRP  31           HH2      TRP  31 -13.002   5.685   7.915
  217    H    ALA  32             H      ALA  32 -17.028   5.964  -1.045
  218    HA   ALA  32            HA      ALA  32 -19.203   7.623  -1.781
  219   1HB   ALA  32           2HB      ALA  32 -16.664   9.197  -1.218
  220   2HB   ALA  32           1HB      ALA  32 -18.068   9.844  -2.102
  221   3HB   ALA  32           3HB      ALA  32 -18.216   9.382  -0.396
  222    H    ALA  33             H      ALA  33 -19.029   6.119  -3.531
  223    HA   ALA  33            HA      ALA  33 -16.931   6.863  -5.499
  224   1HB   ALA  33           1HB      ALA  33 -18.194   4.144  -5.079
  225   2HB   ALA  33           3HB      ALA  33 -17.114   4.552  -6.410
  226   3HB   ALA  33           2HB      ALA  33 -16.518   4.576  -4.746
  227    H    VAL  34             H      VAL  34 -17.690   7.535  -7.425
  228    HA   VAL  34            HA      VAL  34 -20.367   8.241  -7.966
  229    HB   VAL  34            HB      VAL  34 -18.329   7.367 -10.025
  230   1HG1  VAL  34          3HG1      VAL  34 -20.860   7.831 -10.591
  231   2HG1  VAL  34          2HG1      VAL  34 -20.357   9.528 -10.427
  232   3HG1  VAL  34          1HG1      VAL  34 -19.583   8.482 -11.627
  233   1HG2  VAL  34          1HG2      VAL  34 -18.758  10.026  -8.663
  234   2HG2  VAL  34          3HG2      VAL  34 -17.300   9.038  -8.621
  235   3HG2  VAL  34          2HG2      VAL  34 -17.784   9.822 -10.119
  236    HA   PRO  35            HA      PRO  35 -21.789   3.924  -8.200
  237   1HB   PRO  35           2HB      PRO  35 -24.486   4.463  -8.025
  238   2HB   PRO  35           1HB      PRO  35 -23.401   4.351  -6.623
  239   1HG   PRO  35           2HG      PRO  35 -24.559   6.789  -7.915
  240   2HG   PRO  35           1HG      PRO  35 -24.064   6.541  -6.232
  241   1HD   PRO  35           2HD      PRO  35 -22.572   7.935  -8.178
  242   2HD   PRO  35           1HD      PRO  35 -21.940   7.325  -6.635
  243    H    GLY  36             H      GLY  36 -22.616   2.599  -9.807
  244   1HA   GLY  36           2HA      GLY  36 -24.113   2.273 -11.752
  245   2HA   GLY  36           1HA      GLY  36 -23.727   3.917 -12.248
  246    H    LYS  37             H      LYS  37 -20.813   3.574 -11.629
  247    HA   LYS  37            HA      LYS  37 -20.070   2.426 -14.218
  248   1HB   LYS  37           2HB      LYS  37 -18.694   3.965 -12.081
  249   2HB   LYS  37           1HB      LYS  37 -17.721   3.120 -13.280
  250   1HG   LYS  37           2HG      LYS  37 -18.161   5.389 -14.074
  251   2HG   LYS  37           1HG      LYS  37 -19.036   4.244 -15.086
  252   1HD   LYS  37           2HD      LYS  37 -21.109   4.685 -13.861
  253   2HD   LYS  37           1HD      LYS  37 -20.251   5.751 -12.747
  254   1HE   LYS  37           2HE      LYS  37 -21.351   7.140 -14.395
  255   2HE   LYS  37           1HE      LYS  37 -19.620   7.180 -14.728
  256   1HZ   LYS  37           2HZ      LYS  37 -21.402   5.220 -16.044
  257   2HZ   LYS  37           1HZ      LYS  37 -21.185   6.782 -16.676
  258   3HZ   LYS  37           3HZ      LYS  37 -19.859   5.740 -16.526
  259    H    THR  38             H      THR  38 -17.831   1.892 -11.467
  260    HA   THR  38            HA      THR  38 -18.321  -1.012 -11.420
  261    HB   THR  38            HB      THR  38 -16.223   0.258 -13.048
  262    HG1  THR  38           HG1      THR  38 -17.334  -2.307 -13.230
  263   1HG2  THR  38          2HG2      THR  38 -15.573  -2.039 -11.243
  264   2HG2  THR  38          1HG2      THR  38 -14.911  -2.056 -12.871
  265   3HG2  THR  38          3HG2      THR  38 -14.521  -0.718 -11.776
  266    H    PHE  39             H      PHE  39 -16.090   1.582 -10.488
  267    HA   PHE  39            HA      PHE  39 -14.572   0.278  -8.498
  268   1HB   PHE  39           2HB      PHE  39 -15.464   3.116  -8.843
  269   2HB   PHE  39           1HB      PHE  39 -14.510   2.608  -7.475
  270    HD1  PHE  39           HD2      PHE  39 -14.124   1.107 -10.837
  271    HD2  PHE  39           HD1      PHE  39 -12.528   3.889  -7.984
  272    HE1  PHE  39           HE2      PHE  39 -12.057   1.266 -12.143
  273    HE2  PHE  39           HE1      PHE  39 -10.450   4.040  -9.310
  274    HZ   PHE  39            HZ      PHE  39 -10.247   2.703 -11.385
  275    H    VAL  40             H      VAL  40 -17.573   2.069  -8.105
  276    HA   VAL  40            HA      VAL  40 -17.828   2.013  -5.332
  277    HB   VAL  40            HB      VAL  40 -19.285   3.438  -6.574
  278   1HG1  VAL  40          2HG1      VAL  40 -19.791   0.948  -8.096
  279   2HG1  VAL  40          1HG1      VAL  40 -21.129   2.087  -7.963
  280   3HG1  VAL  40          3HG1      VAL  40 -19.594   2.606  -8.665
  281   1HG2  VAL  40          1HG2      VAL  40 -20.225   1.761  -4.592
  282   2HG2  VAL  40          3HG2      VAL  40 -21.115   3.141  -5.248
  283   3HG2  VAL  40          2HG2      VAL  40 -21.415   1.520  -5.875
  284    H    ASN  41             H      ASN  41 -18.244  -0.561  -7.622
  285    HA   ASN  41            HA      ASN  41 -19.752  -2.271  -5.805
  286   1HB   ASN  41           2HB      ASN  41 -18.561  -2.578  -8.553
  287   2HB   ASN  41           1HB      ASN  41 -19.206  -3.936  -7.665
  288   1HD2  ASN  41          2HD2      ASN  41 -22.546  -3.137  -8.408
  289   2HD2  ASN  41          1HD2      ASN  41 -21.439  -4.293  -7.847
  290    H    ILE  42             H      ILE  42 -16.915  -1.155  -5.165
  291    HA   ILE  42            HA      ILE  42 -15.158  -3.395  -5.327
  292    HB   ILE  42            HB      ILE  42 -15.085  -0.631  -4.172
  293   1HG1  ILE  42          2HG1      ILE  42 -12.830  -2.090  -5.514
  294   2HG1  ILE  42          1HG1      ILE  42 -14.247  -1.648  -6.463
  295   1HG2  ILE  42          3HG2      ILE  42 -13.176  -2.809  -3.228
  296   2HG2  ILE  42          2HG2      ILE  42 -12.902  -1.081  -3.019
  297   3HG2  ILE  42          1HG2      ILE  42 -14.266  -1.858  -2.221
  298   1HD1  ILE  42          1HD1      ILE  42 -13.330   0.553  -4.777
  299   2HD1  ILE  42          3HD1      ILE  42 -12.087   0.001  -5.900
  300   3HD1  ILE  42          2HD1      ILE  42 -13.653   0.526  -6.512
  301    H    THR  43             H      THR  43 -15.073  -5.034  -4.066
  302    HA   THR  43            HA      THR  43 -16.381  -5.270  -1.401
  303    HB   THR  43            HB      THR  43 -16.025  -7.808  -2.198
  304    HG1  THR  43           HG1      THR  43 -14.840  -7.336  -4.030
  305   1HG2  THR  43          3HG2      THR  43 -18.076  -5.882  -3.208
  306   2HG2  THR  43          2HG2      THR  43 -18.193  -7.620  -3.505
  307   3HG2  THR  43          1HG2      THR  43 -18.223  -7.006  -1.853
  308    HA   PRO  44            HA      PRO  44 -12.343  -6.264   0.313
  309   1HB   PRO  44           2HB      PRO  44 -12.493  -8.686   1.458
  310   2HB   PRO  44           1HB      PRO  44 -13.114  -7.228   2.200
  311   1HG   PRO  44           2HG      PRO  44 -14.607  -9.448   0.866
  312   2HG   PRO  44           1HG      PRO  44 -15.142  -8.351   2.155
  313   1HD   PRO  44           2HD      PRO  44 -15.870  -8.110  -0.506
  314   2HD   PRO  44           1HD      PRO  44 -15.956  -6.796   0.656
  315    H    ALA  45             H      ALA  45 -13.379  -7.989  -2.228
  316    HA   ALA  45            HA      ALA  45 -11.138  -9.785  -2.576
  317   1HB   ALA  45           2HB      ALA  45 -13.733  -9.602  -3.599
  318   2HB   ALA  45           1HB      ALA  45 -12.692  -9.179  -4.962
  319   3HB   ALA  45           3HB      ALA  45 -12.487 -10.728  -4.144
  320    H    GLU  46             H      GLU  46 -12.475  -7.223  -4.502
  321    HA   GLU  46            HA      GLU  46 -10.104  -6.582  -5.964
  322   1HB   GLU  46           2HB      GLU  46 -11.339  -4.214  -6.154
  323   2HB   GLU  46           1HB      GLU  46 -11.887  -5.603  -7.076
  324   1HG   GLU  46           2HG      GLU  46 -13.000  -5.357  -4.363
  325   2HG   GLU  46           1HG      GLU  46 -13.432  -4.073  -5.476
  326    H    VAL  47             H      VAL  47 -11.307  -5.532  -2.865
  327    HA   VAL  47            HA      VAL  47  -9.242  -3.553  -2.508
  328    HB   VAL  47            HB      VAL  47 -11.696  -4.221  -1.119
  329   1HG1  VAL  47          1HG1      VAL  47  -9.323  -3.264   0.374
  330   2HG1  VAL  47          3HG1      VAL  47 -10.969  -3.150   0.965
  331   3HG1  VAL  47          2HG1      VAL  47 -10.217  -4.732   0.724
  332   1HG2  VAL  47          1HG2      VAL  47 -11.003  -2.133  -2.433
  333   2HG2  VAL  47          3HG2      VAL  47 -11.791  -1.866  -0.871
  334   3HG2  VAL  47          2HG2      VAL  47 -10.011  -1.736  -0.993
  335    H    GLY  48             H      GLY  48  -9.701  -6.893  -1.832
  336   1HA   GLY  48           2HA      GLY  48  -7.735  -7.274   0.196
  337   2HA   GLY  48           1HA      GLY  48  -8.206  -8.481  -1.000
  338    H    VAL  49             H      VAL  49  -7.505  -6.700  -3.228
  339    HA   VAL  49            HA      VAL  49  -4.585  -7.182  -3.230
  340    HB   VAL  49            HB      VAL  49  -5.901  -8.125  -5.106
  341   1HG1  VAL  49          3HG1      VAL  49  -6.429  -5.199  -5.666
  342   2HG1  VAL  49          2HG1      VAL  49  -6.664  -6.477  -6.857
  343   3HG1  VAL  49          1HG1      VAL  49  -7.617  -6.465  -5.377
  344   1HG2  VAL  49          1HG2      VAL  49  -3.802  -6.017  -5.635
  345   2HG2  VAL  49          3HG2      VAL  49  -3.614  -7.767  -5.565
  346   3HG2  VAL  49          2HG2      VAL  49  -4.450  -7.032  -6.925
  347    H    LEU  50             H      LEU  50  -6.855  -4.584  -3.584
  348    HA   LEU  50            HA      LEU  50  -5.045  -2.481  -4.260
  349   1HB   LEU  50           2HB      LEU  50  -7.782  -2.758  -3.327
  350   2HB   LEU  50           1HB      LEU  50  -7.057  -1.240  -3.049
  351    HG   LEU  50            HG      LEU  50  -6.959  -2.444  -5.768
  352   1HD1  LEU  50          3HD1      LEU  50  -9.334  -2.601  -4.990
  353   2HD1  LEU  50          2HD1      LEU  50  -9.301  -0.881  -4.550
  354   3HD1  LEU  50          1HD1      LEU  50  -9.158  -1.376  -6.249
  355   1HD2  LEU  50          3HD2      LEU  50  -5.757  -0.304  -5.047
  356   2HD2  LEU  50          2HD2      LEU  50  -6.841  -0.129  -6.428
  357   3HD2  LEU  50          1HD2      LEU  50  -7.357   0.414  -4.824
  358    H    VAL  51             H      VAL  51  -5.569  -4.214  -1.381
  359    HA   VAL  51            HA      VAL  51  -3.968  -2.276   0.184
  360    HB   VAL  51            HB      VAL  51  -5.667  -1.849   1.804
  361   1HG1  VAL  51          1HG1      VAL  51  -6.286  -0.886  -0.416
  362   2HG1  VAL  51          3HG1      VAL  51  -7.358  -2.260  -0.637
  363   3HG1  VAL  51          2HG1      VAL  51  -7.643  -1.124   0.670
  364   1HG2  VAL  51          2HG2      VAL  51  -6.690  -4.530   1.030
  365   2HG2  VAL  51          1HG2      VAL  51  -6.591  -3.778   2.625
  366   3HG2  VAL  51          3HG2      VAL  51  -7.901  -3.346   1.531
  367    H    GLY  52             H      GLY  52  -5.265  -5.518  -0.093
  368   1HA   GLY  52           2HA      GLY  52  -4.281  -6.646   2.329
  369   2HA   GLY  52           1HA      GLY  52  -4.570  -7.569   0.865
  370    H    LYS  53             H      LYS  53  -2.226  -6.375   2.938
  371    HA   LYS  53            HA      LYS  53   0.025  -5.933   1.374
  372   1HB   LYS  53           2HB      LYS  53   1.350  -6.572   3.364
  373   2HB   LYS  53           1HB      LYS  53   0.003  -5.512   3.784
  374   1HG   LYS  53           2HG      LYS  53  -0.347  -7.154   5.364
  375   2HG   LYS  53           1HG      LYS  53  -1.260  -7.862   4.031
  376   1HD   LYS  53           2HD      LYS  53   0.065  -9.685   4.316
  377   2HD   LYS  53           1HD      LYS  53   1.315  -8.739   3.506
  378   1HE   LYS  53           2HE      LYS  53   1.798  -7.781   5.885
  379   2HE   LYS  53           1HE      LYS  53   0.910  -9.194   6.457
  380   1HZ   LYS  53           3HZ      LYS  53   2.444 -10.511   4.948
  381   2HZ   LYS  53           2HZ      LYS  53   3.407  -9.113   4.871
  382   3HZ   LYS  53           1HZ      LYS  53   3.125  -9.873   6.364
  383    H    ASP  54             H      ASP  54  -1.470  -8.913   2.262
  384    HA   ASP  54            HA      ASP  54   0.667 -10.547   1.236
  385   1HB   ASP  54           2HB      ASP  54  -0.825 -11.141   3.221
  386   2HB   ASP  54           1HB      ASP  54  -2.061 -11.518   2.028
  387    NH1  ARG  55           NH1      ARG  55  -6.571 -11.976  -3.326
  388    NH2  ARG  55           NH2      ARG  55  -6.471 -11.751  -1.081
  389    H    ARG  55             H      ARG  55   0.475  -9.429  -0.864
  390    HA   ARG  55            HA      ARG  55  -0.850 -10.964  -2.834
  391   1HB   ARG  55           2HB      ARG  55  -2.556  -9.158  -1.679
  392   2HB   ARG  55           1HB      ARG  55  -1.890  -8.202  -2.994
  393   1HG   ARG  55           2HG      ARG  55  -2.942  -9.436  -4.602
  394   2HG   ARG  55           1HG      ARG  55  -2.658 -10.952  -3.748
  395   1HD   ARG  55           2HD      ARG  55  -4.577  -9.057  -2.486
  396   2HD   ARG  55           1HD      ARG  55  -5.113  -9.857  -3.961
  397    HE   ARG  55            HE      ARG  55  -3.953 -11.633  -1.916
  398   1HH1  ARG  55          2HH1      ARG  55  -6.148 -11.882  -4.227
  399   2HH1  ARG  55          1HH1      ARG  55  -7.495 -12.349  -3.245
  400   1HH2  ARG  55          1HH2      ARG  55  -5.966 -11.491  -0.258
  401   2HH2  ARG  55          2HH2      ARG  55  -7.405 -12.095  -1.006
  402    H    SER  56             H      SER  56   1.737 -10.451  -2.554
  403    HA   SER  56            HA      SER  56   2.747  -8.053  -3.644
  404   1HB   SER  56           2HB      SER  56   4.046  -9.563  -2.167
  405   2HB   SER  56           1HB      SER  56   4.142 -10.715  -3.497
  406    HG   SER  56            HG      SER  56   5.916  -9.561  -3.840
  407    H    SER  57             H      SER  57   1.302 -10.662  -5.194
  408    HA   SER  57            HA      SER  57   2.791 -10.678  -7.613
  409   1HB   SER  57           2HB      SER  57   0.696 -11.698  -8.573
  410   2HB   SER  57           1HB      SER  57   1.379 -12.556  -7.196
  411    HG   SER  57            HG      SER  57  -0.744 -12.304  -6.722
  412    H    PHE  58             H      PHE  58  -0.275  -9.220  -6.774
  413    HA   PHE  58            HA      PHE  58  -0.938  -7.894  -9.116
  414   1HB   PHE  58           2HB      PHE  58  -2.330  -6.411  -8.000
  415   2HB   PHE  58           1HB      PHE  58  -2.214  -7.779  -6.942
  416    HD1  PHE  58           HD2      PHE  58  -0.509  -4.460  -7.493
  417    HD2  PHE  58           HD1      PHE  58  -1.882  -7.406  -4.718
  418    HE1  PHE  58           HE2      PHE  58   0.106  -2.983  -5.609
  419    HE2  PHE  58           HE1      PHE  58  -1.287  -5.924  -2.829
  420    HZ   PHE  58            HZ      PHE  58  -0.287  -3.709  -3.276
  421    OH   TYR  59            OH      TYR  59   2.507  -4.565  -1.912
  422    H    TYR  59             H      TYR  59   1.854  -6.897  -7.213
  423    HA   TYR  59            HA      TYR  59   2.066  -4.291  -8.250
  424   1HB   TYR  59           2HB      TYR  59   4.408  -6.022  -7.557
  425   2HB   TYR  59           1HB      TYR  59   4.404  -4.269  -7.684
  426    HD1  TYR  59           HD1      TYR  59   2.269  -3.249  -6.259
  427    HD2  TYR  59           HD2      TYR  59   4.538  -6.761  -5.344
  428    HE1  TYR  59           HE1      TYR  59   1.731  -2.984  -3.854
  429    HE2  TYR  59           HE2      TYR  59   3.975  -6.501  -2.942
  430    HH   TYR  59            HH      TYR  59   1.587  -4.282  -1.852
  431    H    VAL  60             H      VAL  60   2.323  -7.038 -10.008
  432    HA   VAL  60            HA      VAL  60   3.697  -5.668 -12.184
  433    HB   VAL  60            HB      VAL  60   4.215  -8.080 -12.872
  434   1HG1  VAL  60          2HG1      VAL  60   5.447  -6.549 -10.622
  435   2HG1  VAL  60          1HG1      VAL  60   6.146  -8.091 -11.123
  436   3HG1  VAL  60          3HG1      VAL  60   6.048  -6.755 -12.269
  437   1HG2  VAL  60          3HG2      VAL  60   2.659  -9.047 -11.106
  438   2HG2  VAL  60          2HG2      VAL  60   4.268  -9.764 -11.179
  439   3HG2  VAL  60          1HG2      VAL  60   3.885  -8.583  -9.926
  440    H    ASN  61             H      ASN  61   1.032  -7.855 -11.265
  441    HA   ASN  61            HA      ASN  61   0.113  -7.968 -14.006
  442   1HB   ASN  61           2HB      ASN  61  -1.553  -9.501 -13.238
  443   2HB   ASN  61           1HB      ASN  61  -0.023  -9.990 -12.586
  444   1HD2  ASN  61          2HD2      ASN  61  -1.199  -9.905  -9.303
  445   2HD2  ASN  61          1HD2      ASN  61  -0.034 -10.447 -10.411
  446    H    GLY  62             H      GLY  62  -1.135  -6.721 -10.894
  447   1HA   GLY  62           2HA      GLY  62  -1.971  -4.338 -11.228
  448   2HA   GLY  62           1HA      GLY  62  -3.008  -5.047 -12.478
  449    H    LEU  63             H      LEU  63  -3.649  -3.622  -9.981
  450    HA   LEU  63            HA      LEU  63  -4.742  -5.423  -8.032
  451   1HB   LEU  63           2HB      LEU  63  -5.765  -2.613  -8.576
  452   2HB   LEU  63           1HB      LEU  63  -5.828  -3.495  -7.043
  453    HG   LEU  63            HG      LEU  63  -3.215  -2.741  -8.353
  454   1HD1  LEU  63          3HD1      LEU  63  -5.106  -0.904  -7.569
  455   2HD1  LEU  63          2HD1      LEU  63  -4.207  -1.154  -6.069
  456   3HD1  LEU  63          1HD1      LEU  63  -3.368  -0.627  -7.526
  457   1HD2  LEU  63          2HD2      LEU  63  -4.145  -3.530  -5.590
  458   2HD2  LEU  63          1HD2      LEU  63  -3.111  -4.461  -6.660
  459   3HD2  LEU  63          3HD2      LEU  63  -2.522  -2.965  -5.952
  460    H    THR  64             H      THR  64  -7.405  -4.279  -7.889
  461    HA   THR  64            HA      THR  64  -8.766  -4.841 -10.353
  462    HB   THR  64            HB      THR  64 -10.131  -6.683  -9.264
  463    HG1  THR  64           HG1      THR  64  -8.687  -6.075  -7.181
  464   1HG2  THR  64          3HG2      THR  64  -8.279  -6.972 -10.969
  465   2HG2  THR  64          2HG2      THR  64  -7.218  -7.394  -9.615
  466   3HG2  THR  64          1HG2      THR  64  -8.639  -8.387  -9.982
  467    H    LEU  65             H      LEU  65 -10.483  -3.625 -10.274
  468    HA   LEU  65            HA      LEU  65 -11.615  -2.871  -7.651
  469   1HB   LEU  65           2HB      LEU  65 -11.905  -0.527  -8.819
  470   2HB   LEU  65           1HB      LEU  65 -10.495  -0.940  -7.885
  471    HG   LEU  65            HG      LEU  65  -9.416  -1.709 -10.076
  472   1HD1  LEU  65          3HD1      LEU  65 -11.991  -0.597 -11.031
  473   2HD1  LEU  65          2HD1      LEU  65 -10.560  -0.186 -11.971
  474   3HD1  LEU  65          1HD1      LEU  65 -10.993  -1.872 -11.708
  475   1HD2  LEU  65          3HD2      LEU  65  -9.962   1.044  -9.116
  476   2HD2  LEU  65          2HD2      LEU  65  -8.422   0.238  -9.445
  477   3HD2  LEU  65          1HD2      LEU  65  -9.352   0.926 -10.774
  478    H    GLY  66             H      GLY  66 -13.476  -3.832  -7.752
  479   1HA   GLY  66           2HA      GLY  66 -15.719  -4.127  -8.253
  480   2HA   GLY  66           1HA      GLY  66 -15.553  -2.877  -9.488
  481    H    GLY  67             H      GLY  67 -13.317  -5.578  -9.442
  482   1HA   GLY  67           2HA      GLY  67 -13.364  -7.593 -10.714
  483   2HA   GLY  67           1HA      GLY  67 -14.836  -7.040 -11.512
  484    H    GLN  68             H      GLN  68 -12.511  -4.483 -11.410
  485    HA   GLN  68            HA      GLN  68 -11.678  -5.225 -14.229
  486   1HB   GLN  68           2HB      GLN  68 -12.998  -3.285 -14.395
  487   2HB   GLN  68           1HB      GLN  68 -12.204  -2.610 -13.030
  488   1HG   GLN  68           2HG      GLN  68 -11.513  -1.625 -15.305
  489   2HG   GLN  68           1HG      GLN  68 -10.201  -2.090 -14.229
  490   1HE2  GLN  68          2HE2      GLN  68  -8.896  -3.898 -17.020
  491   2HE2  GLN  68          1HE2      GLN  68  -8.673  -2.580 -15.971
  492    H    LYS  69             H      LYS  69  -9.747  -6.193 -13.948
  493    HA   LYS  69            HA      LYS  69  -7.845  -5.357 -11.988
  494   1HB   LYS  69           2HB      LYS  69  -6.498  -7.140 -12.662
  495   2HB   LYS  69           1HB      LYS  69  -8.067  -7.698 -13.236
  496   1HG   LYS  69           2HG      LYS  69  -7.426  -6.520 -15.465
  497   2HG   LYS  69           1HG      LYS  69  -5.786  -6.513 -14.826
  498   1HD   LYS  69           2HD      LYS  69  -7.207  -9.101 -14.595
  499   2HD   LYS  69           1HD      LYS  69  -6.858  -8.589 -16.246
  500   1HE   LYS  69           2HE      LYS  69  -4.545  -8.642 -15.919
  501   2HE   LYS  69           1HE      LYS  69  -4.679  -8.423 -14.173
  502   1HZ   LYS  69           2HZ      LYS  69  -5.479 -10.863 -15.676
  503   2HZ   LYS  69           1HZ      LYS  69  -4.065 -10.691 -14.748
  504   3HZ   LYS  69           3HZ      LYS  69  -5.582 -10.650 -13.992
  505    H    CYS  70             H      CYS  70  -6.578  -3.669 -12.006
  506    HA   CYS  70            HA      CYS  70  -5.818  -2.388 -14.642
  507   1HB   CYS  70           2HB      CYS  70  -5.496  -0.368 -13.091
  508   2HB   CYS  70           1HB      CYS  70  -7.104  -0.815 -13.539
  509    HG   CYS  70            HG      CYS  70  -6.973  -0.348 -10.912
  510    H    SER  71             H      SER  71  -3.648  -2.085 -14.816
  511    HA   SER  71            HA      SER  71  -1.930  -3.451 -12.909
  512   1HB   SER  71           2HB      SER  71  -0.498  -3.927 -14.579
  513   2HB   SER  71           1HB      SER  71  -1.988  -3.703 -15.454
  514    HG   SER  71            HG      SER  71   0.259  -2.105 -15.319
  515    H    VAL  72             H      VAL  72  -0.930  -2.478 -11.438
  516    HA   VAL  72            HA      VAL  72  -0.621   0.231 -10.958
  517    HB   VAL  72            HB      VAL  72   1.466  -1.727 -10.174
  518   1HG1  VAL  72          2HG1      VAL  72   0.750   0.966  -9.464
  519   2HG1  VAL  72          1HG1      VAL  72   0.685  -0.082  -8.059
  520   3HG1  VAL  72          3HG1      VAL  72   2.171   0.031  -8.986
  521   1HG2  VAL  72          1HG2      VAL  72  -1.334  -1.493  -9.118
  522   2HG2  VAL  72          3HG2      VAL  72  -0.494  -2.951  -9.628
  523   3HG2  VAL  72          2HG2      VAL  72  -0.030  -2.151  -8.147
  524    H    ILE  73             H      ILE  73   0.622   1.710 -11.666
  525    HA   ILE  73            HA      ILE  73   3.045   1.071 -13.135
  526    HB   ILE  73            HB      ILE  73   0.848   2.818 -13.999
  527   1HG1  ILE  73          2HG1      ILE  73   2.431   1.779 -16.131
  528   2HG1  ILE  73          1HG1      ILE  73   2.177   0.498 -14.957
  529   1HG2  ILE  73          2HG2      ILE  73   3.711   3.488 -14.397
  530   2HG2  ILE  73          1HG2      ILE  73   2.549   3.872 -15.665
  531   3HG2  ILE  73          3HG2      ILE  73   2.365   4.578 -14.058
  532   1HD1  ILE  73          3HD1      ILE  73  -0.268   2.032 -15.569
  533   2HD1  ILE  73          2HD1      ILE  73   0.399   1.172 -16.965
  534   3HD1  ILE  73          1HD1      ILE  73  -0.022   0.287 -15.505
  535    NH1  ARG  74           NH2      ARG  74   8.771   4.142 -12.632
  536    NH2  ARG  74           NH1      ARG  74   9.696   6.096 -11.968
  537    H    ARG  74             H      ARG  74   3.633   1.326 -10.957
  538    HA   ARG  74            HA      ARG  74   5.293   2.330  -9.602
  539   1HB   ARG  74           2HB      ARG  74   3.961   4.860 -10.515
  540   2HB   ARG  74           1HB      ARG  74   5.025   4.835  -9.136
  541   1HG   ARG  74           2HG      ARG  74   6.722   3.658 -10.645
  542   2HG   ARG  74           1HG      ARG  74   5.689   4.122 -11.998
  543   1HD   ARG  74           2HD      ARG  74   5.841   6.521 -10.989
  544   2HD   ARG  74           1HD      ARG  74   7.242   5.893 -10.118
  545    HE   ARG  74            HE      ARG  74   7.114   6.447 -12.981
  546   1HH1  ARG  74          1HH2      ARG  74   7.962   3.600 -12.859
  547   2HH1  ARG  74          2HH2      ARG  74   9.681   3.727 -12.683
  548   1HH2  ARG  74          2HH1      ARG  74   9.597   7.050 -11.687
  549   2HH2  ARG  74          1HH1      ARG  74  10.603   5.680 -12.013
  550    H    ASP  75             H      ASP  75   4.372   1.058  -8.075
  551    HA   ASP  75            HA      ASP  75   1.977   1.846  -6.723
  552   1HB   ASP  75           2HB      ASP  75   1.979  -0.458  -6.753
  553   2HB   ASP  75           1HB      ASP  75   3.700  -0.525  -6.674
  554    H    SER  76             H      SER  76   1.878   3.380  -5.276
  555    HA   SER  76            HA      SER  76   4.016   3.412  -3.174
  556   1HB   SER  76           2HB      SER  76   3.360   5.697  -5.008
  557   2HB   SER  76           1HB      SER  76   3.693   6.037  -3.325
  558    HG   SER  76            HG      SER  76   5.628   4.750  -3.613
  559    H    LEU  77             H      LEU  77   1.007   2.750  -3.628
  560    HA   LEU  77            HA      LEU  77  -0.843   4.367  -2.306
  561   1HB   LEU  77           2HB      LEU  77  -0.846   1.919  -3.317
  562   2HB   LEU  77           1HB      LEU  77  -0.729   1.449  -1.647
  563    HG   LEU  77            HG      LEU  77  -2.745   2.785  -1.199
  564   1HD1  LEU  77          3HD1      LEU  77  -2.583   3.207  -4.192
  565   2HD1  LEU  77          2HD1      LEU  77  -4.070   3.430  -3.268
  566   3HD1  LEU  77          1HD1      LEU  77  -2.682   4.441  -2.930
  567   1HD2  LEU  77          1HD2      LEU  77  -2.832   0.641  -3.333
  568   2HD2  LEU  77          3HD2      LEU  77  -3.074   0.445  -1.592
  569   3HD2  LEU  77          2HD2      LEU  77  -4.293   1.271  -2.561
  570    H    LEU  78             H      LEU  78   1.841   2.646  -0.860
  571    HA   LEU  78            HA      LEU  78   0.811   3.358   1.762
  572   1HB   LEU  78           2HB      LEU  78   3.012   1.610   1.045
  573   2HB   LEU  78           1HB      LEU  78   2.498   1.872   2.673
  574    HG   LEU  78            HG      LEU  78   0.208   1.204   1.009
  575   1HD1  LEU  78          2HD1      LEU  78   2.021   0.039  -0.340
  576   2HD1  LEU  78          1HD1      LEU  78   2.290  -0.988   1.067
  577   3HD1  LEU  78          3HD1      LEU  78   0.717  -1.000   0.257
  578   1HD2  LEU  78          1HD2      LEU  78   0.462   0.943   3.506
  579   2HD2  LEU  78          3HD2      LEU  78  -0.191  -0.485   2.683
  580   3HD2  LEU  78          2HD2      LEU  78   1.509  -0.445   3.196
  581    H    GLN  79             H      GLN  79   1.489   5.113   2.665
  582    HA   GLN  79            HA      GLN  79   2.750   7.175   1.696
  583   1HB   GLN  79           2HB      GLN  79   2.697   8.168   3.927
  584   2HB   GLN  79           1HB      GLN  79   1.220   7.249   3.643
  585   1HG   GLN  79           2HG      GLN  79   2.735   5.298   4.731
  586   2HG   GLN  79           1HG      GLN  79   3.468   6.699   5.513
  587   1HE2  GLN  79          2HE2      GLN  79  -0.544   6.086   6.218
  588   2HE2  GLN  79          1HE2      GLN  79   0.087   5.708   4.689
  589    H    ASP  80             H      ASP  80   4.498   6.298   0.773
  590    HA   ASP  80            HA      ASP  80   6.973   6.270   2.452
  591   1HB   ASP  80           2HB      ASP  80   6.650   4.396   0.737
  592   2HB   ASP  80           1HB      ASP  80   6.694   5.638  -0.514
  593    H    GLY  81             H      GLY  81   5.097   8.549   1.854
  594   1HA   GLY  81           2HA      GLY  81   5.555  10.864   1.560
  595   2HA   GLY  81           1HA      GLY  81   6.953  10.431   0.569
  596    H    GLU  82             H      GLU  82   3.931   8.653   0.025
  597    HA   GLU  82            HA      GLU  82   3.251  10.286  -2.296
  598   1HB   GLU  82           2HB      GLU  82   4.481   7.637  -2.272
  599   2HB   GLU  82           1HB      GLU  82   3.253   7.954  -3.451
  600   1HG   GLU  82           2HG      GLU  82   5.081   8.613  -4.642
  601   2HG   GLU  82           1HG      GLU  82   4.635  10.149  -3.878
  602    H    PHE  83             H      PHE  83   2.450   7.059  -1.006
  603    HA   PHE  83            HA      PHE  83   0.440   5.890  -0.850
  604   1HB   PHE  83           2HB      PHE  83  -1.623   7.702  -0.835
  605   2HB   PHE  83           1HB      PHE  83  -0.976   6.828   0.489
  606    HD1  PHE  83           HD1      PHE  83   1.022   7.895   1.742
  607    HD2  PHE  83           HD2      PHE  83  -1.521  10.080  -0.918
  608    HE1  PHE  83           HE1      PHE  83   1.785  10.002   2.781
  609    HE2  PHE  83           HE2      PHE  83  -0.761  12.211   0.120
  610    HZ   PHE  83            HZ      PHE  83   0.889  12.165   1.973
  611    H    SER  84             H      SER  84   1.163   7.595  -3.625
  612    HA   SER  84            HA      SER  84  -1.452   7.110  -4.962
  613   1HB   SER  84           2HB      SER  84  -0.389   8.431  -6.814
  614   2HB   SER  84           1HB      SER  84  -0.566   9.324  -5.301
  615    HG   SER  84            HG      SER  84   1.511   9.647  -5.972
  616    H    MET  85             H      MET  85  -1.648   5.895  -6.728
  617    HA   MET  85            HA      MET  85   0.643   4.124  -7.562
  618   1HB   MET  85           2HB      MET  85  -1.054   3.321  -5.733
  619   2HB   MET  85           1HB      MET  85  -2.113   3.143  -7.085
  620   1HG   MET  85           2HG      MET  85  -1.150   1.271  -7.725
  621   2HG   MET  85           1HG      MET  85   0.429   1.996  -7.668
  622   1HE   MET  85           3HE      MET  85  -1.523  -0.480  -6.929
  623   2HE   MET  85           2HE      MET  85   0.034  -1.234  -6.495
  624   3HE   MET  85           1HE      MET  85  -1.253  -1.113  -5.285
  625    H    ASP  86             H      ASP  86   0.711   4.062  -9.894
  626    HA   ASP  86            HA      ASP  86  -1.722   5.180 -11.273
  627   1HB   ASP  86           2HB      ASP  86   1.104   4.704 -11.960
  628   2HB   ASP  86           1HB      ASP  86  -0.067   4.727 -13.254
  629    H    LEU  87             H      LEU  87  -3.024   3.134 -10.797
  630    HA   LEU  87            HA      LEU  87  -2.117   0.852 -12.407
  631   1HB   LEU  87           2HB      LEU  87  -4.319  -0.218 -11.390
  632   2HB   LEU  87           1HB      LEU  87  -2.797  -0.253 -10.569
  633    HG   LEU  87            HG      LEU  87  -4.626   0.295  -9.050
  634   1HD1  LEU  87          2HD1      LEU  87  -2.233   1.722  -9.308
  635   2HD1  LEU  87          1HD1      LEU  87  -3.473   2.898  -8.867
  636   3HD1  LEU  87          3HD1      LEU  87  -3.206   1.477  -7.858
  637   1HD2  LEU  87          1HD2      LEU  87  -5.789   1.573 -11.056
  638   2HD2  LEU  87          3HD2      LEU  87  -6.127   1.996  -9.383
  639   3HD2  LEU  87          2HD2      LEU  87  -4.994   2.961 -10.317
  640    NH1  ARG  88           NH1      ARG  88   0.176   3.586 -17.463
  641    NH2  ARG  88           NH2      ARG  88   1.301   3.091 -19.360
  642    H    ARG  88             H      ARG  88  -2.633   0.682 -14.353
  643    HA   ARG  88            HA      ARG  88  -5.213   2.001 -15.224
  644   1HB   ARG  88           2HB      ARG  88  -4.195   3.035 -17.061
  645   2HB   ARG  88           1HB      ARG  88  -2.849   3.036 -15.942
  646   1HG   ARG  88           2HG      ARG  88  -1.792   1.182 -17.093
  647   2HG   ARG  88           1HG      ARG  88  -3.225   0.807 -18.067
  648   1HD   ARG  88           2HD      ARG  88  -2.807   2.504 -19.511
  649   2HD   ARG  88           1HD      ARG  88  -2.191   3.577 -18.241
  650    HE   ARG  88            HE      ARG  88  -0.592   1.462 -19.606
  651   1HH1  ARG  88          2HH1      ARG  88  -0.637   3.487 -16.891
  652   2HH1  ARG  88          1HH1      ARG  88   0.940   4.151 -17.154
  653   1HH2  ARG  88          1HH2      ARG  88   1.353   2.617 -20.239
  654   2HH2  ARG  88          2HH2      ARG  88   2.066   3.649 -19.048
  655    H    THR  89             H      THR  89  -6.555   0.942 -16.583
  656    HA   THR  89            HA      THR  89  -6.352  -1.890 -16.850
  657    HB   THR  89            HB      THR  89  -8.308  -1.773 -18.083
  658    HG1  THR  89           HG1      THR  89  -8.686  -0.488 -19.708
  659   1HG2  THR  89          1HG2      THR  89  -8.361  -0.236 -15.935
  660   2HG2  THR  89          3HG2      THR  89  -8.688   1.007 -17.142
  661   3HG2  THR  89          2HG2      THR  89  -9.771  -0.377 -16.985
  662    H    LYS  90             H      LYS  90  -4.682  -2.785 -18.008
  663    HA   LYS  90            HA      LYS  90  -3.581  -1.305 -20.216
  664   1HB   LYS  90           2HB      LYS  90  -2.369  -3.903 -19.448
  665   2HB   LYS  90           1HB      LYS  90  -1.658  -2.373 -19.903
  666   1HG   LYS  90           2HG      LYS  90  -2.994  -2.459 -17.261
  667   2HG   LYS  90           1HG      LYS  90  -1.420  -3.222 -17.455
  668   1HD   LYS  90           2HD      LYS  90  -1.809  -0.500 -18.627
  669   2HD   LYS  90           1HD      LYS  90  -1.581  -0.654 -16.885
  670   1HE   LYS  90           2HE      LYS  90   0.648  -0.877 -17.200
  671   2HE   LYS  90           1HE      LYS  90   0.359  -2.349 -18.123
  672   1HZ   LYS  90           2HZ      LYS  90  -0.263  -0.476 -19.926
  673   2HZ   LYS  90           1HZ      LYS  90   0.946   0.334 -19.047
  674   3HZ   LYS  90           3HZ      LYS  90   1.283  -1.163 -19.770
  675    H    SER  91             H      SER  91  -3.497  -2.158 -22.238
  676    HA   SER  91            HA      SER  91  -5.641  -4.094 -22.846
  677   1HB   SER  91           2HB      SER  91  -5.980  -2.297 -24.245
  678   2HB   SER  91           1HB      SER  91  -4.308  -1.893 -24.314
  679    HG   SER  91            HG      SER  91  -4.063  -3.120 -26.026
  680    H    THR  92             H      THR  92  -5.267  -5.653 -24.653
  681    HA   THR  92            HA      THR  92  -2.450  -6.673 -24.755
  682    HB   THR  92            HB      THR  92  -3.235  -8.970 -24.465
  683    HG1  THR  92           HG1      THR  92  -5.268  -9.444 -24.657
  684   1HG2  THR  92          3HG2      THR  92  -4.097  -6.963 -22.395
  685   2HG2  THR  92          2HG2      THR  92  -4.288  -8.693 -22.119
  686   3HG2  THR  92          1HG2      THR  92  -2.682  -8.015 -22.386
  687    H    GLY  93             H      GLY  93  -1.836  -6.850 -26.830
  688   1HA   GLY  93           2HA      GLY  93  -1.948  -7.466 -29.126
  689   2HA   GLY  93           1HA      GLY  93  -3.648  -7.882 -28.903
  690    H    GLY  94             H      GLY  94  -5.240  -6.201 -29.009
  691   1HA   GLY  94           2HA      GLY  94  -4.316  -3.514 -29.924
  692   2HA   GLY  94           1HA      GLY  94  -5.453  -4.407 -30.934
  693    H    ALA  95             H      ALA  95  -5.548  -4.600 -27.426
  694    HA   ALA  95            HA      ALA  95  -8.341  -3.685 -27.392
  695   1HB   ALA  95           1HB      ALA  95  -6.901  -5.390 -25.804
  696   2HB   ALA  95           3HB      ALA  95  -6.914  -3.932 -24.819
  697   3HB   ALA  95           2HB      ALA  95  -8.433  -4.649 -25.338
  698    HA   PRO  96            HA      PRO  96  -7.597   0.466 -26.154
  699   1HB   PRO  96           2HB      PRO  96  -9.906   0.974 -24.827
  700   2HB   PRO  96           1HB      PRO  96  -9.869   0.660 -26.574
  701   1HG   PRO  96           2HG      PRO  96 -10.848  -1.129 -24.396
  702   2HG   PRO  96           1HG      PRO  96 -11.261  -1.138 -26.108
  703   1HD   PRO  96           2HD      PRO  96  -9.403  -2.854 -24.769
  704   2HD   PRO  96           1HD      PRO  96  -9.790  -2.788 -26.503
  705    H    THR  97             H      THR  97  -6.437   1.459 -24.496
  706    HA   THR  97            HA      THR  97  -6.451   0.162 -21.791
  707    HB   THR  97            HB      THR  97  -4.520   1.752 -21.329
  708    HG1  THR  97           HG1      THR  97  -4.224   3.255 -22.753
  709   1HG2  THR  97          2HG2      THR  97  -4.597  -0.640 -22.820
  710   2HG2  THR  97          1HG2      THR  97  -3.461   0.412 -23.666
  711   3HG2  THR  97          3HG2      THR  97  -3.216   0.050 -21.954
  712    H    PHE  98             H      PHE  98  -6.600   1.501 -19.954
  713    HA   PHE  98            HA      PHE  98  -7.817   4.177 -20.084
  714   1HB   PHE  98           2HB      PHE  98  -9.161   1.607 -19.103
  715   2HB   PHE  98           1HB      PHE  98  -9.697   3.176 -18.690
  716    HD1  PHE  98           HD1      PHE  98  -9.500   4.820 -20.994
  717    HD2  PHE  98           HD2      PHE  98 -10.625   0.712 -20.706
  718    HE1  PHE  98           HE1      PHE  98 -10.798   5.092 -23.107
  719    HE2  PHE  98           HE2      PHE  98 -11.924   0.911 -22.819
  720    HZ   PHE  98            HZ      PHE  98 -12.005   3.084 -24.027
  721    H    ASN  99             H      ASN  99  -7.626   5.197 -17.765
  722    HA   ASN  99            HA      ASN  99  -5.763   3.578 -16.116
  723   1HB   ASN  99           2HB      ASN  99  -5.198   6.520 -16.378
  724   2HB   ASN  99           1HB      ASN  99  -4.114   5.221 -15.891
  725   1HD2  ASN  99          2HD2      ASN  99  -2.747   5.567 -19.152
  726   2HD2  ASN  99          1HD2      ASN  99  -2.528   5.878 -17.501
  727    H    VAL 100             H      VAL 100  -5.409   4.441 -13.968
  728    HA   VAL 100            HA      VAL 100  -7.602   5.938 -12.682
  729    HB   VAL 100            HB      VAL 100  -6.738   3.163 -11.754
  730   1HG1  VAL 100          2HG1      VAL 100  -7.863   4.955 -10.288
  731   2HG1  VAL 100          1HG1      VAL 100  -9.323   4.553 -11.176
  732   3HG1  VAL 100          3HG1      VAL 100  -8.495   3.314 -10.252
  733   1HG2  VAL 100          3HG2      VAL 100  -7.799   2.913 -14.000
  734   2HG2  VAL 100          2HG2      VAL 100  -8.851   2.275 -12.737
  735   3HG2  VAL 100          1HG2      VAL 100  -9.191   3.850 -13.452
  736    H    THR 101             H      THR 101  -6.638   6.988 -10.838
  737    HA   THR 101            HA      THR 101  -3.907   6.047 -10.046
  738    HB   THR 101            HB      THR 101  -5.101   8.831  -9.659
  739    HG1  THR 101           HG1      THR 101  -4.375   9.125 -11.600
  740   1HG2  THR 101          1HG2      THR 101  -2.862   7.406  -8.466
  741   2HG2  THR 101          3HG2      THR 101  -2.314   8.831  -9.343
  742   3HG2  THR 101          2HG2      THR 101  -3.515   8.993  -8.070
  743    H    VAL 102             H      VAL 102  -3.863   5.287  -8.008
  744    HA   VAL 102            HA      VAL 102  -6.293   5.686  -6.376
  745    HB   VAL 102            HB      VAL 102  -4.681   3.251  -7.122
  746   1HG1  VAL 102          1HG1      VAL 102  -5.776   3.814  -4.416
  747   2HG1  VAL 102          3HG1      VAL 102  -6.388   2.319  -5.126
  748   3HG1  VAL 102          2HG1      VAL 102  -4.655   2.553  -4.927
  749   1HG2  VAL 102          2HG2      VAL 102  -7.563   4.043  -6.959
  750   2HG2  VAL 102          1HG2      VAL 102  -6.632   3.553  -8.356
  751   3HG2  VAL 102          3HG2      VAL 102  -7.077   2.364  -7.140
  752    H    THR 103             H      THR 103  -5.952   6.696  -4.569
  753    HA   THR 103            HA      THR 103  -3.262   6.812  -3.400
  754    HB   THR 103            HB      THR 103  -4.102   8.909  -2.269
  755    HG1  THR 103           HG1      THR 103  -5.966   9.796  -3.417
  756   1HG2  THR 103          1HG2      THR 103  -3.581   8.530  -5.160
  757   2HG2  THR 103          3HG2      THR 103  -4.321  10.081  -4.732
  758   3HG2  THR 103          2HG2      THR 103  -2.773   9.589  -3.996
  759    H    LYS 104             H      LYS 104  -3.117   6.517  -1.060
  760    HA   LYS 104            HA      LYS 104  -5.611   5.551   0.264
  761   1HB   LYS 104           2HB      LYS 104  -4.389   3.542  -0.401
  762   2HB   LYS 104           1HB      LYS 104  -2.908   4.160   0.323
  763   1HG   LYS 104           2HG      LYS 104  -3.489   3.247   2.313
  764   2HG   LYS 104           1HG      LYS 104  -4.948   4.228   2.338
  765   1HD   LYS 104           2HD      LYS 104  -5.539   1.872   2.507
  766   2HD   LYS 104           1HD      LYS 104  -6.103   2.513   0.974
  767   1HE   LYS 104           2HE      LYS 104  -5.069   0.434   0.442
  768   2HE   LYS 104           1HE      LYS 104  -3.892   1.665  -0.015
  769   1HZ   LYS 104           3HZ      LYS 104  -2.822   1.359   2.145
  770   2HZ   LYS 104           2HZ      LYS 104  -3.927   0.124   2.523
  771   3HZ   LYS 104           1HZ      LYS 104  -2.830  -0.074   1.241
  772    H    THR 105             H      THR 105  -5.796   6.068   2.397
  773    HA   THR 105            HA      THR 105  -3.751   7.924   3.536
  774    HB   THR 105            HB      THR 105  -5.568   8.752   4.948
  775    HG1  THR 105           HG1      THR 105  -7.223   7.555   5.336
  776   1HG2  THR 105          1HG2      THR 105  -5.595   8.845   2.098
  777   2HG2  THR 105          3HG2      THR 105  -7.267   8.732   2.642
  778   3HG2  THR 105          2HG2      THR 105  -6.238  10.035   3.227
  779    H    ASP 106             H      ASP 106  -5.001   7.420   6.293
  780    HA   ASP 106            HA      ASP 106  -3.427   5.002   6.944
  781   1HB   ASP 106           2HB      ASP 106  -3.159   7.136   8.244
  782   2HB   ASP 106           1HB      ASP 106  -4.809   6.926   8.825
  783    H    LYS 107             H      LYS 107  -6.755   6.062   6.653
  784    HA   LYS 107            HA      LYS 107  -7.641   3.344   7.482
  785   1HB   LYS 107           2HB      LYS 107  -9.018   5.864   8.463
  786   2HB   LYS 107           1HB      LYS 107  -9.378   4.200   8.928
  787   1HG   LYS 107           2HG      LYS 107  -7.073   4.012   9.872
  788   2HG   LYS 107           1HG      LYS 107  -6.825   5.719   9.501
  789   1HD   LYS 107           2HD      LYS 107  -9.040   6.058  10.858
  790   2HD   LYS 107           1HD      LYS 107  -8.648   4.478  11.536
  791   1HE   LYS 107           2HE      LYS 107  -6.289   6.173  11.480
  792   2HE   LYS 107           1HE      LYS 107  -7.605   6.963  12.348
  793   1HZ   LYS 107           2HZ      LYS 107  -6.685   4.185  12.843
  794   2HZ   LYS 107           1HZ      LYS 107  -6.237   5.532  13.774
  795   3HZ   LYS 107           3HZ      LYS 107  -7.857   5.037  13.729
  796    H    THR 108             H      THR 108  -7.483   5.080   4.887
  797    HA   THR 108            HA      THR 108 -10.187   4.338   3.958
  798    HB   THR 108            HB      THR 108 -10.747   6.465   3.097
  799    HG1  THR 108           HG1      THR 108  -8.854   7.112   2.199
  800   1HG2  THR 108          3HG2      THR 108 -10.826   6.205   5.642
  801   2HG2  THR 108          2HG2      THR 108  -9.329   7.144   5.691
  802   3HG2  THR 108          1HG2      THR 108 -10.803   7.874   5.049
  803    H    LEU 109             H      LEU 109 -10.236   4.295   1.585
  804    HA   LEU 109            HA      LEU 109  -7.597   3.879   0.269
  805   1HB   LEU 109           2HB      LEU 109  -9.234   1.911   1.041
  806   2HB   LEU 109           1HB      LEU 109  -9.997   2.252  -0.485
  807    HG   LEU 109            HG      LEU 109  -7.437   0.879   0.089
  808   1HD1  LEU 109          3HD1      LEU 109  -9.706   0.175  -1.045
  809   2HD1  LEU 109          2HD1      LEU 109  -8.953   0.848  -2.486
  810   3HD1  LEU 109          1HD1      LEU 109  -8.180  -0.472  -1.624
  811   1HD2  LEU 109          3HD2      LEU 109  -7.703   2.900  -2.120
  812   2HD2  LEU 109          2HD2      LEU 109  -6.436   2.786  -0.913
  813   3HD2  LEU 109          1HD2      LEU 109  -6.561   1.568  -2.170
  814    H    VAL 110             H      VAL 110  -7.826   6.039  -0.873
  815    HA   VAL 110            HA      VAL 110 -10.328   6.514  -2.300
  816    HB   VAL 110            HB      VAL 110  -7.799   8.103  -1.787
  817   1HG1  VAL 110          3HG1      VAL 110  -9.690   8.445  -4.076
  818   2HG1  VAL 110          2HG1      VAL 110  -9.125   9.896  -3.250
  819   3HG1  VAL 110          1HG1      VAL 110  -7.969   8.798  -3.992
  820   1HG2  VAL 110          2HG2      VAL 110 -10.222   7.963  -0.534
  821   2HG2  VAL 110          1HG2      VAL 110  -9.177   9.385  -0.491
  822   3HG2  VAL 110          3HG2      VAL 110 -10.517   9.310  -1.655
  823    H    LEU 111             H      LEU 111 -10.536   6.536  -4.494
  824    HA   LEU 111            HA      LEU 111  -8.263   5.625  -6.137
  825   1HB   LEU 111           2HB      LEU 111 -11.054   4.673  -6.799
  826   2HB   LEU 111           1HB      LEU 111  -9.518   3.992  -7.309
  827    HG   LEU 111            HG      LEU 111 -10.636   3.856  -4.523
  828   1HD1  LEU 111          3HD1      LEU 111 -10.458   1.832  -6.760
  829   2HD1  LEU 111          2HD1      LEU 111 -10.709   1.361  -5.068
  830   3HD1  LEU 111          1HD1      LEU 111 -11.911   2.360  -5.895
  831   1HD2  LEU 111          3HD2      LEU 111  -8.060   3.823  -5.064
  832   2HD2  LEU 111          2HD2      LEU 111  -8.762   2.823  -3.809
  833   3HD2  LEU 111          1HD2      LEU 111  -8.423   2.131  -5.399
  834    H    LEU 112             H      LEU 112  -8.483   6.366  -8.311
  835    HA   LEU 112            HA      LEU 112 -10.434   8.539  -8.771
  836   1HB   LEU 112           2HB      LEU 112  -7.959   9.184  -8.246
  837   2HB   LEU 112           1HB      LEU 112  -7.615   8.547  -9.823
  838    HG   LEU 112            HG      LEU 112  -7.898  10.775 -10.353
  839   1HD1  LEU 112          3HD1      LEU 112  -9.682   9.471 -11.602
  840   2HD1  LEU 112          2HD1      LEU 112 -10.843   9.974 -10.365
  841   3HD1  LEU 112          1HD1      LEU 112 -10.054  11.190 -11.398
  842   1HD2  LEU 112          1HD2      LEU 112  -9.852  10.830  -8.065
  843   2HD2  LEU 112          3HD2      LEU 112  -8.266  11.598  -8.171
  844   3HD2  LEU 112          2HD2      LEU 112  -9.610  12.202  -9.148
  845    H    MET 113             H      MET 113 -11.698   7.486 -10.340
  846    HA   MET 113            HA      MET 113 -10.134   5.826 -12.336
  847   1HB   MET 113           2HB      MET 113 -12.321   4.924 -11.245
  848   2HB   MET 113           1HB      MET 113 -13.129   6.028 -12.333
  849   1HG   MET 113           2HG      MET 113 -11.397   4.873 -14.076
  850   2HG   MET 113           1HG      MET 113 -11.663   3.541 -12.982
  851   1HE   MET 113           3HE      MET 113 -12.731   1.945 -13.888
  852   2HE   MET 113           2HE      MET 113 -14.124   2.181 -12.833
  853   3HE   MET 113           1HE      MET 113 -14.371   1.889 -14.552
  854    H    GLY 114             H      GLY 114 -10.087   6.295 -14.416
  855   1HA   GLY 114           2HA      GLY 114 -11.726   8.247 -15.578
  856   2HA   GLY 114           1HA      GLY 114 -10.268   8.979 -15.041
  857    H    LYS 115             H      LYS 115 -11.651   7.703 -17.754
  858    HA   LYS 115            HA      LYS 115  -9.175   7.616 -18.792
  859   1HB   LYS 115           2HB      LYS 115 -10.656   5.197 -19.321
  860   2HB   LYS 115           1HB      LYS 115  -8.939   5.366 -19.190
  861   1HG   LYS 115           2HG      LYS 115  -9.195   4.162 -17.212
  862   2HG   LYS 115           1HG      LYS 115  -9.818   5.572 -16.513
  863   1HD   LYS 115           2HD      LYS 115 -11.948   4.805 -16.453
  864   2HD   LYS 115           1HD      LYS 115 -11.811   4.148 -18.086
  865   1HE   LYS 115           2HE      LYS 115 -10.116   2.492 -16.716
  866   2HE   LYS 115           1HE      LYS 115 -11.326   2.830 -15.482
  867   1HZ   LYS 115           1HZ      LYS 115 -12.975   2.328 -17.374
  868   2HZ   LYS 115           3HZ      LYS 115 -11.656   1.558 -18.113
  869   3HZ   LYS 115           2HZ      LYS 115 -12.202   1.034 -16.591
  870    H    GLU 116             H      GLU 116  -9.364   8.747 -20.627
  871    HA   GLU 116            HA      GLU 116 -11.156   7.629 -22.698
  872   1HB   GLU 116           2HB      GLU 116 -11.266  10.139 -21.920
  873   2HB   GLU 116           1HB      GLU 116  -9.884  10.259 -22.944
  874   1HG   GLU 116           2HG      GLU 116 -11.194   9.167 -24.787
  875   2HG   GLU 116           1HG      GLU 116 -12.627   9.327 -23.762
  876    H    GLY 117             H      GLY 117  -9.137   5.962 -23.011
  877   1HA   GLY 117           2HA      GLY 117  -6.848   5.544 -23.719
  878   2HA   GLY 117           1HA      GLY 117  -6.992   7.070 -24.604
  879    H    VAL 118             H      VAL 118  -7.651   7.899 -21.362
  880    HA   VAL 118            HA      VAL 118  -6.151   9.839 -20.691
  881    HB   VAL 118            HB      VAL 118  -7.894   8.968 -19.313
  882   1HG1  VAL 118          2HG1      VAL 118  -6.773   6.552 -19.599
  883   2HG1  VAL 118          1HG1      VAL 118  -6.032   7.012 -18.096
  884   3HG1  VAL 118          3HG1      VAL 118  -7.751   6.954 -18.204
  885   1HG2  VAL 118          2HG2      VAL 118  -5.423  10.063 -18.356
  886   2HG2  VAL 118          1HG2      VAL 118  -6.967  10.082 -17.537
  887   3HG2  VAL 118          3HG2      VAL 118  -5.820   8.772 -17.192
  888    H    HIS 119             H      HIS 119  -4.309  10.404 -20.096
  889    HA   HIS 119            HA      HIS 119  -1.917   8.881 -20.570
  890   1HB   HIS 119           2HB      HIS 119  -2.148  11.385 -20.741
  891   2HB   HIS 119           1HB      HIS 119  -2.230  11.453 -18.970
  892    HD1  HIS 119           HD1      HIS 119   0.124  10.570 -21.810
  893    HD2  HIS 119           HD2      HIS 119   0.262  11.160 -17.685
  894    HE1  HIS 119           HE1      HIS 119   2.576  10.605 -21.172
  895    H    GLY 120             H      GLY 120  -3.452  10.086 -17.559
  896   1HA   GLY 120           2HA      GLY 120  -3.619   8.706 -15.544
  897   2HA   GLY 120           1HA      GLY 120  -2.170   7.844 -16.059
  898    H    GLY 121             H      GLY 121  -2.034  11.288 -16.446
  899   1HA   GLY 121           2HA      GLY 121  -0.281  11.493 -14.023
  900   2HA   GLY 121           1HA      GLY 121  -0.055  12.453 -15.489
  901    H    LEU 122             H      LEU 122  -2.879  13.001 -15.867
  902    HA   LEU 122            HA      LEU 122  -3.193  15.309 -14.066
  903   1HB   LEU 122           2HB      LEU 122  -5.443  14.380 -15.869
  904   2HB   LEU 122           1HB      LEU 122  -4.918  16.019 -15.508
  905    HG   LEU 122            HG      LEU 122  -2.780  14.708 -16.888
  906   1HD1  LEU 122          2HD1      LEU 122  -4.679  13.174 -17.623
  907   2HD1  LEU 122          1HD1      LEU 122  -5.348  14.579 -18.459
  908   3HD1  LEU 122          3HD1      LEU 122  -3.761  13.953 -18.917
  909   1HD2  LEU 122          1HD2      LEU 122  -3.353  17.143 -16.869
  910   2HD2  LEU 122          3HD2      LEU 122  -3.107  16.506 -18.494
  911   3HD2  LEU 122          2HD2      LEU 122  -4.743  16.781 -17.894
  912    H    ILE 123             H      ILE 123  -4.634  12.124 -14.592
  913    HA   ILE 123            HA      ILE 123  -6.725  12.398 -12.590
  914    HB   ILE 123            HB      ILE 123  -5.274  10.030 -13.754
  915   1HG1  ILE 123          2HG1      ILE 123  -8.043  11.224 -14.351
  916   2HG1  ILE 123          1HG1      ILE 123  -6.648  11.246 -15.435
  917   1HG2  ILE 123          1HG2      ILE 123  -6.285   9.525 -11.468
  918   2HG2  ILE 123          3HG2      ILE 123  -7.846   9.952 -12.141
  919   3HG2  ILE 123          2HG2      ILE 123  -6.983   8.568 -12.770
  920   1HD1  ILE 123          1HD1      ILE 123  -6.653   8.726 -15.369
  921   2HD1  ILE 123          3HD1      ILE 123  -8.165   8.812 -14.476
  922   3HD1  ILE 123          2HD1      ILE 123  -8.086   9.432 -16.112
  923    H    ASN 124             H      ASN 124  -3.355  11.387 -12.668
  924    HA   ASN 124            HA      ASN 124  -3.160  10.495  -9.977
  925   1HB   ASN 124           2HB      ASN 124  -1.416   9.985 -11.652
  926   2HB   ASN 124           1HB      ASN 124  -1.058  11.708 -11.794
  927   1HD2  ASN 124          2HD2      ASN 124   0.981  11.788  -8.908
  928   2HD2  ASN 124          1HD2      ASN 124   0.297  12.658 -10.193
  929    H    LYS 125             H      LYS 125  -3.250  13.632 -11.516
  930    HA   LYS 125            HA      LYS 125  -2.209  15.068  -9.098
  931   1HB   LYS 125           2HB      LYS 125  -2.221  16.957 -10.476
  932   2HB   LYS 125           1HB      LYS 125  -2.288  15.745 -11.752
  933   1HG   LYS 125           2HG      LYS 125  -3.993  17.112 -12.440
  934   2HG   LYS 125           1HG      LYS 125  -4.876  16.050 -11.386
  935   1HD   LYS 125           2HD      LYS 125  -5.553  18.172 -10.655
  936   2HD   LYS 125           1HD      LYS 125  -4.319  17.666  -9.492
  937   1HE   LYS 125           2HE      LYS 125  -3.189  19.556  -9.982
  938   2HE   LYS 125           1HE      LYS 125  -2.894  18.902 -11.590
  939   1HZ   LYS 125           2HZ      LYS 125  -5.473  20.190 -11.028
  940   2HZ   LYS 125           1HZ      LYS 125  -4.109  21.169 -11.284
  941   3HZ   LYS 125           3HZ      LYS 125  -4.611  20.088 -12.489
  942    H    LYS 126             H      LYS 126  -5.354  14.296 -10.565
  943    HA   LYS 126            HA      LYS 126  -6.994  15.756  -8.637
  944   1HB   LYS 126           2HB      LYS 126  -7.497  13.904 -10.919
  945   2HB   LYS 126           1HB      LYS 126  -8.765  14.042  -9.706
  946   1HG   LYS 126           2HG      LYS 126  -9.424  15.864 -10.902
  947   2HG   LYS 126           1HG      LYS 126  -8.105  16.678 -10.075
  948   1HD   LYS 126           2HD      LYS 126  -8.075  17.055 -12.545
  949   2HD   LYS 126           1HD      LYS 126  -6.624  16.275 -11.966
  950   1HE   LYS 126           2HE      LYS 126  -7.170  14.232 -12.927
  951   2HE   LYS 126           1HE      LYS 126  -8.885  14.576 -12.947
  952   1HZ   LYS 126           3HZ      LYS 126  -7.060  16.246 -14.532
  953   2HZ   LYS 126           2HZ      LYS 126  -7.482  14.710 -15.121
  954   3HZ   LYS 126           1HZ      LYS 126  -8.687  15.870 -14.822
  955    H    CYS 127             H      CYS 127  -5.399  12.711  -8.552
  956    HA   CYS 127            HA      CYS 127  -7.183  11.509  -6.515
  957   1HB   CYS 127           2HB      CYS 127  -5.750  10.225  -8.326
  958   2HB   CYS 127           1HB      CYS 127  -4.464  10.436  -7.168
  959    HG   CYS 127            HG      CYS 127  -7.131   9.095  -6.271
  960    OH   TYR 128            OH      TYR 128   2.595  14.790  -2.822
  961    H    TYR 128             H      TYR 128  -4.130  13.130  -6.909
  962    HA   TYR 128            HA      TYR 128  -3.106  12.814  -4.248
  963   1HB   TYR 128           2HB      TYR 128  -2.113  13.709  -6.569
  964   2HB   TYR 128           1HB      TYR 128  -2.645  15.260  -5.951
  965    HD1  TYR 128           HD1      TYR 128  -1.748  13.418  -3.060
  966    HD2  TYR 128           HD2      TYR 128  -0.046  15.351  -6.519
  967    HE1  TYR 128           HE1      TYR 128   0.394  13.669  -1.850
  968    HE2  TYR 128           HE2      TYR 128   2.112  15.595  -5.290
  969    HH   TYR 128            HH      TYR 128   2.401  15.030  -1.914
  970    H    GLU 129             H      GLU 129  -5.423  14.979  -5.835
  971    HA   GLU 129            HA      GLU 129  -5.592  16.822  -3.506
  972   1HB   GLU 129           2HB      GLU 129  -7.214  16.596  -6.061
  973   2HB   GLU 129           1HB      GLU 129  -7.454  17.851  -4.844
  974   1HG   GLU 129           2HG      GLU 129  -5.048  18.506  -5.122
  975   2HG   GLU 129           1HG      GLU 129  -4.927  17.343  -6.444
  976    H    MET 130             H      MET 130  -7.480  14.199  -4.949
  977    HA   MET 130            HA      MET 130  -9.841  14.326  -3.355
  978   1HB   MET 130           2HB      MET 130  -8.999  12.775  -5.431
  979   2HB   MET 130           1HB      MET 130  -8.672  11.652  -4.117
  980   1HG   MET 130           2HG      MET 130 -11.111  12.041  -3.374
  981   2HG   MET 130           1HG      MET 130 -11.349  12.842  -4.951
  982   1HE   MET 130           3HE      MET 130 -13.124  11.168  -4.359
  983   2HE   MET 130           2HE      MET 130 -13.222  10.596  -6.023
  984   3HE   MET 130           1HE      MET 130 -13.073   9.433  -4.709
  985    H    ALA 131             H      ALA 131  -6.728  12.677  -2.846
  986    HA   ALA 131            HA      ALA 131  -7.341  11.720  -0.140
  987   1HB   ALA 131           3HB      ALA 131  -4.815  11.721  -1.865
  988   2HB   ALA 131           2HB      ALA 131  -4.850  11.135  -0.182
  989   3HB   ALA 131           1HB      ALA 131  -5.837  10.339  -1.408
  990    H    SER 132             H      SER 132  -6.028  14.636  -1.592
  991    HA   SER 132            HA      SER 132  -4.387  15.564   0.560
  992   1HB   SER 132           2HB      SER 132  -5.985  16.970  -1.565
  993   2HB   SER 132           1HB      SER 132  -5.288  17.907  -0.255
  994    HG   SER 132            HG      SER 132  -3.439  17.714  -1.217
  995    H    HIS 133             H      HIS 133  -7.899  15.459   0.049
  996    HA   HIS 133            HA      HIS 133  -8.403  16.943   2.541
  997   1HB   HIS 133           2HB      HIS 133 -10.051  16.922   0.616
  998   2HB   HIS 133           1HB      HIS 133 -10.468  15.254   1.090
  999    HD1  HIS 133           HD1      HIS 133 -10.134  18.694   2.768
 1000    HD2  HIS 133           HD2      HIS 133 -12.331  15.166   3.113
 1001    HE1  HIS 133           HE1      HIS 133 -11.819  19.076   4.623
 1002    H    LEU 134             H      LEU 134  -8.441  13.517   1.407
 1003    HA   LEU 134            HA      LEU 134  -9.385  12.544   3.981
 1004   1HB   LEU 134           2HB      LEU 134  -7.950  11.248   1.682
 1005   2HB   LEU 134           1HB      LEU 134  -8.342  10.359   3.152
 1006    HG   LEU 134            HG      LEU 134 -10.696  11.649   2.623
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.227  11.338   0.108
 1008   2HD1  LEU 134          1HD1      LEU 134 -10.887  10.757   0.088
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.543  12.428   0.516
 1010   1HD2  LEU 134          2HD2      LEU 134  -9.702   8.913   1.895
 1011   2HD2  LEU 134          1HD2      LEU 134 -10.716   9.372   3.259
 1012   3HD2  LEU 134          3HD2      LEU 134 -11.379   9.377   1.627
 1013    NH1  ARG 135           NH2      ARG 135  -3.877   9.950   7.118
 1014    NH2  ARG 135           NH1      ARG 135  -1.666   9.680   6.741
 1015    H    ARG 135             H      ARG 135  -6.432  13.878   3.179
 1016    HA   ARG 135            HA      ARG 135  -4.973  12.509   5.369
 1017   1HB   ARG 135           2HB      ARG 135  -4.159  14.292   3.090
 1018   2HB   ARG 135           1HB      ARG 135  -3.179  14.322   4.557
 1019   1HG   ARG 135           2HG      ARG 135  -3.957  11.716   3.239
 1020   2HG   ARG 135           1HG      ARG 135  -2.522  12.608   2.734
 1021   1HD   ARG 135           2HD      ARG 135  -1.380  11.713   4.460
 1022   2HD   ARG 135           1HD      ARG 135  -2.479  12.505   5.590
 1023    HE   ARG 135            HE      ARG 135  -3.487   9.988   4.442
 1024   1HH1  ARG 135          1HH2      ARG 135  -4.782  10.231   6.799
 1025   2HH1  ARG 135          2HH2      ARG 135  -3.764   9.592   8.047
 1026   1HH2  ARG 135          2HH1      ARG 135  -0.876   9.754   6.133
 1027   2HH2  ARG 135          1HH1      ARG 135  -1.551   9.322   7.667
 1028    NH1  ARG 136           NH1      ARG 136  -5.050  21.135   1.453
 1029    NH2  ARG 136           NH2      ARG 136  -3.929  22.495   2.875
 1030    H    ARG 136             H      ARG 136  -6.349  15.590   4.339
 1031    HA   ARG 136            HA      ARG 136  -5.740  16.897   6.892
 1032   1HB   ARG 136           2HB      ARG 136  -7.331  17.676   4.452
 1033   2HB   ARG 136           1HB      ARG 136  -7.355  18.655   5.919
 1034   1HG   ARG 136           2HG      ARG 136  -5.054  19.170   5.758
 1035   2HG   ARG 136           1HG      ARG 136  -4.745  17.840   4.642
 1036   1HD   ARG 136           2HD      ARG 136  -5.884  18.966   2.850
 1037   2HD   ARG 136           1HD      ARG 136  -6.531  20.186   3.946
 1038    HE   ARG 136            HE      ARG 136  -3.662  20.230   4.044
 1039   1HH1  ARG 136          2HH1      ARG 136  -5.471  20.250   1.252
 1040   2HH1  ARG 136          1HH1      ARG 136  -5.061  21.862   0.765
 1041   1HH2  ARG 136          1HH2      ARG 136  -3.494  22.652   3.762
 1042   2HH2  ARG 136          2HH2      ARG 136  -3.938  23.221   2.186
 1043    H    SER 137             H      SER 137  -7.868  14.524   5.918
 1044    HA   SER 137            HA      SER 137 -10.254  15.353   7.352
 1045   1HB   SER 137           2HB      SER 137 -11.162  13.258   6.583
 1046   2HB   SER 137           1HB      SER 137 -10.173  13.817   5.265
 1047    HG   SER 137            HG      SER 137  -9.802  11.613   5.769
 1048    H    GLN 138             H      GLN 138  -7.220  13.742   8.062
 1049    HA   GLN 138            HA      GLN 138  -6.376  12.996  10.143
 1050   1HB   GLN 138           2HB      GLN 138  -7.972  14.865  11.064
 1051   2HB   GLN 138           1HB      GLN 138  -9.052  13.527  11.463
 1052   1HG   GLN 138           2HG      GLN 138  -6.887  12.479  12.535
 1053   2HG   GLN 138           1HG      GLN 138  -6.328  14.151  12.561
 1054   1HE2  GLN 138          2HE2      GLN 138  -9.617  13.186  14.859
 1055   2HE2  GLN 138          1HE2      GLN 138  -9.315  12.293  13.448
 1056    OH   TYR 139            OH      TYR 139 -14.996   9.273   9.096
 1057    H    TYR 139             H      TYR 139  -7.946  11.369   8.172
 1058    HA   TYR 139            HA      TYR 139  -9.209   9.286   9.853
 1059   1HB   TYR 139           2HB      TYR 139  -9.271  10.041   6.992
 1060   2HB   TYR 139           1HB      TYR 139  -9.218   8.305   7.284
 1061    HD1  TYR 139           HD1      TYR 139 -10.961   7.197   8.683
 1062    HD2  TYR 139           HD2      TYR 139 -11.232  11.335   7.558
 1063    HE1  TYR 139           HE1      TYR 139 -13.369   7.204   9.282
 1064    HE2  TYR 139           HE2      TYR 139 -13.638  11.342   8.160
 1065    HH   TYR 139            HH      TYR 139 -15.093   8.800   9.924
   
  Start of MODEL           8
 Raw file had 1065 H/Q atoms
  Start of MODEL    8
    1   1H    ALA   1            1H      ALA   1 -22.896  14.085   3.016
    2   2H    ALA   1            3H      ALA   1 -23.221  15.532   3.839
    3   3H    ALA   1            2H      ALA   1 -24.289  14.979   2.640
    4    HA   ALA   1            HA      ALA   1 -22.669  15.328   0.934
    5   1HB   ALA   1           2HB      ALA   1 -23.810  17.386   2.584
    6   2HB   ALA   1           1HB      ALA   1 -22.234  17.934   2.013
    7   3HB   ALA   1           3HB      ALA   1 -23.469  17.436   0.855
    8    H    GLY   2             H      GLY   2 -20.549  16.486   0.437
    9   1HA   GLY   2           2HA      GLY   2 -18.338  17.227   1.361
   10   2HA   GLY   2           1HA      GLY   2 -18.513  15.963   2.581
   11    CH2  TRP   3           CH2      TRP   3 -13.328  11.429   3.582
   12    H    TRP   3             H      TRP   3 -18.691  13.667   1.684
   13    HA   TRP   3            HA      TRP   3 -16.491  12.956   0.157
   14   1HB   TRP   3           2HB      TRP   3 -18.956  11.605   0.758
   15   2HB   TRP   3           1HB      TRP   3 -17.888  10.893  -0.403
   16    HD1  TRP   3           HD1      TRP   3 -18.482   9.506   2.186
   17    HE1  TRP   3           HE1      TRP   3 -16.715   8.950   3.945
   18    HE3  TRP   3           HE3      TRP   3 -14.828  12.977   0.960
   19    HZ2  TRP   3           HZ2      TRP   3 -14.147   9.822   4.740
   20    HZ3  TRP   3           HZ3      TRP   3 -12.761  13.027   2.265
   21    HH2  TRP   3           HH2      TRP   3 -12.408  11.466   4.145
   22    H    ASN   4             H      ASN   4 -19.754  13.655  -0.897
   23    HA   ASN   4            HA      ASN   4 -19.611  12.804  -3.587
   24   1HB   ASN   4           2HB      ASN   4 -21.190  15.146  -2.505
   25   2HB   ASN   4           1HB      ASN   4 -21.514  14.301  -4.015
   26   1HD2  ASN   4          2HD2      ASN   4 -23.651  12.913  -1.196
   27   2HD2  ASN   4          1HD2      ASN   4 -23.371  14.498  -1.736
   28    H    ALA   5             H      ALA   5 -18.488  15.742  -2.135
   29    HA   ALA   5            HA      ALA   5 -17.885  17.208  -4.603
   30   1HB   ALA   5           3HB      ALA   5 -17.954  17.895  -1.914
   31   2HB   ALA   5           2HB      ALA   5 -16.218  17.817  -2.219
   32   3HB   ALA   5           1HB      ALA   5 -17.236  18.888  -3.182
   33    OH   TYR   6            OH      TYR   6 -13.737  17.931   1.319
   34    H    TYR   6             H      TYR   6 -16.233  14.881  -2.487
   35    HA   TYR   6            HA      TYR   6 -13.706  15.131  -3.973
   36   1HB   TYR   6           2HB      TYR   6 -14.523  12.937  -2.061
   37   2HB   TYR   6           1HB      TYR   6 -12.880  13.303  -2.615
   38    HD1  TYR   6           HD1      TYR   6 -11.837  15.521  -2.050
   39    HD2  TYR   6           HD2      TYR   6 -15.581  14.290  -0.560
   40    HE1  TYR   6           HE1      TYR   6 -11.829  17.414  -0.442
   41    HE2  TYR   6           HE2      TYR   6 -15.609  16.076   1.078
   42    HH   TYR   6            HH      TYR   6 -14.485  18.491   1.095
   43    H    ILE   7             H      ILE   7 -16.715  13.730  -4.550
   44    HA   ILE   7            HA      ILE   7 -15.735  11.843  -6.592
   45    HB   ILE   7            HB      ILE   7 -18.552  12.605  -6.135
   46   1HG1  ILE   7          2HG1      ILE   7 -17.595  11.553  -4.082
   47   2HG1  ILE   7          1HG1      ILE   7 -18.938  10.661  -4.788
   48   1HG2  ILE   7          3HG2      ILE   7 -17.382  10.359  -7.634
   49   2HG2  ILE   7          2HG2      ILE   7 -19.098  10.578  -7.353
   50   3HG2  ILE   7          1HG2      ILE   7 -18.196  11.771  -8.311
   51   1HD1  ILE   7          1HD1      ILE   7 -16.982   9.449  -6.093
   52   2HD1  ILE   7          3HD1      ILE   7 -16.034   9.988  -4.728
   53   3HD1  ILE   7          2HD1      ILE   7 -17.421   8.957  -4.495
   54    H    ASP   8             H      ASP   8 -16.800  15.083  -6.066
   55    HA   ASP   8            HA      ASP   8 -17.476  15.709  -8.705
   56   1HB   ASP   8           2HB      ASP   8 -16.977  17.230  -6.256
   57   2HB   ASP   8           1HB      ASP   8 -16.827  18.113  -7.708
   58    H    ASN   9             H      ASN   9 -14.527  15.157  -7.028
   59    HA   ASN   9            HA      ASN   9 -12.584  16.404  -8.759
   60   1HB   ASN   9           2HB      ASN   9 -11.675  15.548  -6.758
   61   2HB   ASN   9           1HB      ASN   9 -12.706  14.204  -6.755
   62   1HD2  ASN   9          2HD2      ASN   9 -10.410  11.915  -8.849
   63   2HD2  ASN   9          1HD2      ASN   9 -12.013  12.200  -8.501
   64    H    LEU  10             H      LEU  10 -13.979  13.375  -8.256
   65    HA   LEU  10            HA      LEU  10 -12.939  11.894 -10.272
   66   1HB   LEU  10           2HB      LEU  10 -15.528  11.735  -8.790
   67   2HB   LEU  10           1HB      LEU  10 -14.928  10.504  -9.741
   68    HG   LEU  10            HG      LEU  10 -13.482  11.669  -7.328
   69   1HD1  LEU  10          2HD1      LEU  10 -15.558   9.827  -7.311
   70   2HD1  LEU  10          1HD1      LEU  10 -14.122   8.889  -6.952
   71   3HD1  LEU  10          3HD1      LEU  10 -14.531  10.293  -5.966
   72   1HD2  LEU  10          2HD2      LEU  10 -12.237  10.272  -9.344
   73   2HD2  LEU  10          1HD2      LEU  10 -11.640  10.373  -7.700
   74   3HD2  LEU  10          3HD2      LEU  10 -12.590   8.982  -8.202
   75    H    MET  11             H      MET  11 -15.497  14.189 -10.433
   76    HA   MET  11            HA      MET  11 -16.102  13.343 -13.234
   77   1HB   MET  11           2HB      MET  11 -17.611  15.307 -11.507
   78   2HB   MET  11           1HB      MET  11 -18.128  14.653 -13.065
   79   1HG   MET  11           2HG      MET  11 -17.413  12.695 -10.901
   80   2HG   MET  11           1HG      MET  11 -18.947  13.555 -10.767
   81   1HE   MET  11           2HE      MET  11 -16.657  11.245 -12.467
   82   2HE   MET  11           1HE      MET  11 -17.604  10.232 -13.555
   83   3HE   MET  11           3HE      MET  11 -16.966  11.788 -14.115
   84    H    ALA  12             H      ALA  12 -15.020  16.006 -11.342
   85    HA   ALA  12            HA      ALA  12 -14.752  17.920 -13.479
   86   1HB   ALA  12           1HB      ALA  12 -13.728  17.941 -10.617
   87   2HB   ALA  12           3HB      ALA  12 -13.670  19.320 -11.723
   88   3HB   ALA  12           2HB      ALA  12 -15.229  18.684 -11.193
   89    H    ASP  13             H      ASP  13 -12.964  15.217 -12.710
   90    HA   ASP  13            HA      ASP  13 -10.260  16.265 -12.900
   91   1HB   ASP  13           2HB      ASP  13  -9.769  13.746 -13.493
   92   2HB   ASP  13           1HB      ASP  13 -10.274  14.168 -11.864
   93    H    GLY  14             H      GLY  14 -12.640  16.127 -15.300
   94   1HA   GLY  14           2HA      GLY  14 -12.573  15.771 -17.711
   95   2HA   GLY  14           1HA      GLY  14 -11.466  17.126 -17.511
   96    H    THR  15             H      THR  15 -10.947  13.793 -16.539
   97    HA   THR  15            HA      THR  15  -8.994  13.212 -18.591
   98    HB   THR  15            HB      THR  15  -8.334  13.707 -15.703
   99    HG1  THR  15           HG1      THR  15  -7.463  14.882 -18.128
  100   1HG2  THR  15          2HG2      THR  15  -6.657  12.643 -17.924
  101   2HG2  THR  15          1HG2      THR  15  -6.068  13.104 -16.327
  102   3HG2  THR  15          3HG2      THR  15  -7.202  11.776 -16.499
  103    H    CYS  16             H      CYS  16 -10.871  12.212 -15.796
  104    HA   CYS  16            HA      CYS  16  -9.918   9.444 -15.816
  105   1HB   CYS  16           2HB      CYS  16 -10.914   9.413 -13.682
  106   2HB   CYS  16           1HB      CYS  16 -10.711  11.110 -13.835
  107    HG   CYS  16            HG      CYS  16 -13.422   9.627 -14.092
  108    H    GLN  17             H      GLN  17 -12.136   8.133 -15.152
  109    HA   GLN  17            HA      GLN  17 -14.105   8.189 -17.240
  110   1HB   GLN  17           2HB      GLN  17 -11.859   6.910 -17.692
  111   2HB   GLN  17           1HB      GLN  17 -12.628   5.653 -16.760
  112   1HG   GLN  17           2HG      GLN  17 -14.307   6.851 -18.840
  113   2HG   GLN  17           1HG      GLN  17 -12.837   6.060 -19.459
  114   1HE2  GLN  17          2HE2      GLN  17 -15.644   3.750 -17.473
  115   2HE2  GLN  17          1HE2      GLN  17 -15.545   5.406 -17.118
  116    H    ASP  18             H      ASP  18 -12.639   6.385 -14.510
  117    HA   ASP  18            HA      ASP  18 -15.268   6.160 -13.129
  118   1HB   ASP  18           2HB      ASP  18 -14.045   3.983 -14.025
  119   2HB   ASP  18           1HB      ASP  18 -13.176   4.158 -12.522
  120    H    ALA  19             H      ALA  19 -14.807   5.766 -10.682
  121    HA   ALA  19            HA      ALA  19 -12.523   7.448  -9.571
  122   1HB   ALA  19           1HB      ALA  19 -15.094   8.333 -10.625
  123   2HB   ALA  19           3HB      ALA  19 -14.800   8.822  -8.979
  124   3HB   ALA  19           2HB      ALA  19 -13.624   9.200 -10.239
  125    H    ALA  20             H      ALA  20 -12.350   6.474  -7.299
  126    HA   ALA  20            HA      ALA  20 -14.967   6.406  -5.879
  127   1HB   ALA  20           1HB      ALA  20 -13.598   3.837  -6.448
  128   2HB   ALA  20           3HB      ALA  20 -14.843   4.031  -5.206
  129   3HB   ALA  20           2HB      ALA  20 -15.215   4.341  -6.920
  130    H    ILE  21             H      ILE  21 -14.847   6.950  -3.934
  131    HA   ILE  21            HA      ILE  21 -12.359   6.648  -2.347
  132    HB   ILE  21            HB      ILE  21 -15.083   7.717  -1.552
  133   1HG1  ILE  21          2HG1      ILE  21 -12.523   9.047  -2.473
  134   2HG1  ILE  21          1HG1      ILE  21 -14.097   9.129  -3.251
  135   1HG2  ILE  21          2HG2      ILE  21 -12.368   7.780  -0.163
  136   2HG2  ILE  21          1HG2      ILE  21 -13.796   8.645   0.401
  137   3HG2  ILE  21          3HG2      ILE  21 -13.782   6.882   0.374
  138   1HD1  ILE  21          1HD1      ILE  21 -14.531  10.002  -0.621
  139   2HD1  ILE  21          3HD1      ILE  21 -13.018  10.755  -1.129
  140   3HD1  ILE  21          2HD1      ILE  21 -14.482  10.992  -2.077
  141    H    VAL  22             H      VAL  22 -12.252   4.988  -0.690
  142    HA   VAL  22            HA      VAL  22 -14.686   3.301  -0.418
  143    HB   VAL  22            HB      VAL  22 -11.980   2.217  -1.232
  144   1HG1  VAL  22          1HG1      VAL  22 -13.514   0.762   0.200
  145   2HG1  VAL  22          3HG1      VAL  22 -14.645   0.795  -1.151
  146   3HG1  VAL  22          2HG1      VAL  22 -13.044   0.080  -1.356
  147   1HG2  VAL  22          2HG2      VAL  22 -14.544   2.674  -2.798
  148   2HG2  VAL  22          1HG2      VAL  22 -12.968   3.411  -3.113
  149   3HG2  VAL  22          3HG2      VAL  22 -13.211   1.680  -3.381
  150    H    GLY  23             H      GLY  23 -15.002   3.073   1.814
  151   1HA   GLY  23           2HA      GLY  23 -12.830   3.343   3.762
  152   2HA   GLY  23           1HA      GLY  23 -14.487   2.812   4.123
  153    OH   TYR  24            OH      TYR  24  -5.783   1.016   5.779
  154    H    TYR  24             H      TYR  24 -11.413   1.769   2.908
  155    HA   TYR  24            HA      TYR  24 -11.974  -1.009   2.530
  156   1HB   TYR  24           2HB      TYR  24  -9.788  -1.038   1.597
  157   2HB   TYR  24           1HB      TYR  24 -10.219   0.635   1.473
  158    HD1  TYR  24           HD1      TYR  24  -9.661   2.129   3.660
  159    HD2  TYR  24           HD2      TYR  24  -7.861  -1.609   2.732
  160    HE1  TYR  24           HE1      TYR  24  -7.832   2.604   5.260
  161    HE2  TYR  24           HE2      TYR  24  -6.027  -1.159   4.290
  162    HH   TYR  24            HH      TYR  24  -5.034   1.358   5.285
  163    H    LYS  25             H      LYS  25 -12.162   0.172   5.490
  164    HA   LYS  25            HA      LYS  25 -10.122  -0.760   7.095
  165   1HB   LYS  25           2HB      LYS  25 -12.993  -0.274   7.542
  166   2HB   LYS  25           1HB      LYS  25 -12.023  -0.944   8.818
  167   1HG   LYS  25           2HG      LYS  25 -11.878   1.375   9.194
  168   2HG   LYS  25           1HG      LYS  25 -10.391   1.004   8.326
  169   1HD   LYS  25           2HD      LYS  25 -11.103   1.985   6.394
  170   2HD   LYS  25           1HD      LYS  25 -12.807   1.686   6.741
  171   1HE   LYS  25           2HE      LYS  25 -11.053   3.693   8.185
  172   2HE   LYS  25           1HE      LYS  25 -12.253   4.086   6.960
  173   1HZ   LYS  25           3HZ      LYS  25 -13.827   2.759   8.519
  174   2HZ   LYS  25           2HZ      LYS  25 -12.660   3.110   9.705
  175   3HZ   LYS  25           1HZ      LYS  25 -13.450   4.370   8.884
  176    H    ASP  26             H      ASP  26 -11.121  -2.537   8.886
  177    HA   ASP  26            HA      ASP  26 -10.502  -5.130   8.132
  178   1HB   ASP  26           2HB      ASP  26 -12.473  -5.841   9.704
  179   2HB   ASP  26           1HB      ASP  26 -11.063  -5.063  10.384
  180    H    SER  27             H      SER  27 -13.734  -3.784   7.989
  181    HA   SER  27            HA      SER  27 -14.494  -5.683   5.874
  182   1HB   SER  27           2HB      SER  27 -16.801  -4.845   6.540
  183   2HB   SER  27           1HB      SER  27 -16.028  -5.890   7.699
  184    HG   SER  27            HG      SER  27 -16.525  -3.135   7.769
  185    HA   PRO  28            HA      PRO  28 -13.929  -1.857   3.727
  186   1HB   PRO  28           2HB      PRO  28 -14.159  -2.829   1.180
  187   2HB   PRO  28           1HB      PRO  28 -12.695  -2.935   2.170
  188   1HG   PRO  28           2HG      PRO  28 -14.564  -5.089   1.452
  189   2HG   PRO  28           1HG      PRO  28 -12.927  -5.188   2.055
  190   1HD   PRO  28           2HD      PRO  28 -15.345  -5.579   3.499
  191   2HD   PRO  28           1HD      PRO  28 -13.672  -5.668   4.107
  192    H    SER  29             H      SER  29 -15.094  -0.533   2.092
  193    HA   SER  29            HA      SER  29 -17.766  -1.156   1.348
  194   1HB   SER  29           2HB      SER  29 -18.846   0.578   2.795
  195   2HB   SER  29           1HB      SER  29 -18.248  -0.809   3.703
  196    HG   SER  29            HG      SER  29 -17.656   1.290   4.567
  197    H    VAL  30             H      VAL  30 -18.782   0.787   0.347
  198    HA   VAL  30            HA      VAL  30 -16.697   2.406  -0.917
  199    HB   VAL  30            HB      VAL  30 -19.518   1.620  -1.639
  200   1HG1  VAL  30          1HG1      VAL  30 -19.206   4.023  -2.211
  201   2HG1  VAL  30          3HG1      VAL  30 -17.762   3.596  -3.124
  202   3HG1  VAL  30          2HG1      VAL  30 -19.337   3.010  -3.651
  203   1HG2  VAL  30          2HG2      VAL  30 -16.905   0.608  -2.164
  204   2HG2  VAL  30          1HG2      VAL  30 -18.425   0.056  -2.856
  205   3HG2  VAL  30          3HG2      VAL  30 -17.485   1.299  -3.673
  206    CH2  TRP  31           CH2      TRP  31 -13.413   6.196   6.444
  207    H    TRP  31             H      TRP  31 -16.306   4.149   0.353
  208    HA   TRP  31            HA      TRP  31 -18.260   5.550   1.954
  209   1HB   TRP  31           2HB      TRP  31 -15.414   6.020   1.096
  210   2HB   TRP  31           1HB      TRP  31 -16.305   7.331   1.870
  211    HD1  TRP  31           HD1      TRP  31 -17.489   4.048   3.105
  212    HE1  TRP  31           HE1      TRP  31 -16.558   3.563   5.407
  213    HE3  TRP  31           HE3      TRP  31 -13.847   7.632   3.398
  214    HZ2  TRP  31           HZ2      TRP  31 -14.549   4.530   7.198
  215    HZ3  TRP  31           HZ3      TRP  31 -12.467   7.835   5.428
  216    HH2  TRP  31           HH2      TRP  31 -12.797   6.282   7.328
  217    H    ALA  32             H      ALA  32 -17.183   5.735  -1.320
  218    HA   ALA  32            HA      ALA  32 -19.333   7.337  -2.254
  219   1HB   ALA  32           2HB      ALA  32 -17.774   9.070  -1.050
  220   2HB   ALA  32           1HB      ALA  32 -16.671   8.806  -2.399
  221   3HB   ALA  32           3HB      ALA  32 -18.295   9.466  -2.705
  222    H    ALA  33             H      ALA  33 -19.229   7.381  -4.636
  223    HA   ALA  33            HA      ALA  33 -16.936   6.605  -6.168
  224   1HB   ALA  33           3HB      ALA  33 -18.843   4.334  -5.467
  225   2HB   ALA  33           2HB      ALA  33 -17.606   4.260  -6.728
  226   3HB   ALA  33           1HB      ALA  33 -17.131   4.443  -5.040
  227    H    VAL  34             H      VAL  34 -17.405   7.060  -8.290
  228    HA   VAL  34            HA      VAL  34 -19.853   8.104  -9.215
  229    HB   VAL  34            HB      VAL  34 -17.673   6.654 -10.862
  230   1HG1  VAL  34          2HG1      VAL  34 -19.902   6.896 -12.018
  231   2HG1  VAL  34          1HG1      VAL  34 -19.824   8.641 -11.744
  232   3HG1  VAL  34          3HG1      VAL  34 -18.619   7.854 -12.766
  233   1HG2  VAL  34          3HG2      VAL  34 -18.164   9.610 -10.199
  234   2HG2  VAL  34          2HG2      VAL  34 -16.867   8.599  -9.552
  235   3HG2  VAL  34          1HG2      VAL  34 -16.904   8.977 -11.280
  236    HA   PRO  35            HA      PRO  35 -21.938   4.063  -8.920
  237   1HB   PRO  35           2HB      PRO  35 -24.510   5.040  -9.023
  238   2HB   PRO  35           1HB      PRO  35 -23.532   4.970  -7.542
  239   1HG   PRO  35           2HG      PRO  35 -24.202   7.344  -9.240
  240   2HG   PRO  35           1HG      PRO  35 -23.848   7.270  -7.507
  241   1HD   PRO  35           2HD      PRO  35 -22.046   8.110  -9.502
  242   2HD   PRO  35           1HD      PRO  35 -21.609   7.642  -7.851
  243    H    GLY  36             H      GLY  36 -22.925   2.689 -10.398
  244   1HA   GLY  36           2HA      GLY  36 -24.193   2.184 -12.404
  245   2HA   GLY  36           1HA      GLY  36 -23.814   3.792 -13.012
  246    H    LYS  37             H      LYS  37 -20.907   2.819 -11.780
  247    HA   LYS  37            HA      LYS  37 -20.053   1.786 -14.422
  248   1HB   LYS  37           2HB      LYS  37 -18.750   3.434 -12.310
  249   2HB   LYS  37           1HB      LYS  37 -17.736   2.460 -13.381
  250   1HG   LYS  37           2HG      LYS  37 -17.896   4.274 -14.757
  251   2HG   LYS  37           1HG      LYS  37 -19.440   3.549 -15.191
  252   1HD   LYS  37           2HD      LYS  37 -20.056   4.984 -12.894
  253   2HD   LYS  37           1HD      LYS  37 -18.900   6.028 -13.721
  254   1HE   LYS  37           2HE      LYS  37 -21.170   4.771 -15.251
  255   2HE   LYS  37           1HE      LYS  37 -21.430   6.252 -14.325
  256   1HZ   LYS  37           2HZ      LYS  37 -19.581   7.267 -15.538
  257   2HZ   LYS  37           1HZ      LYS  37 -19.412   5.853 -16.465
  258   3HZ   LYS  37           3HZ      LYS  37 -20.827   6.774 -16.586
  259    H    THR  38             H      THR  38 -18.440   1.398 -11.214
  260    HA   THR  38            HA      THR  38 -18.864  -1.462 -11.077
  261    HB   THR  38            HB      THR  38 -16.640  -0.423 -12.710
  262    HG1  THR  38           HG1      THR  38 -17.907  -2.932 -12.702
  263   1HG2  THR  38          1HG2      THR  38 -16.247  -2.804 -10.898
  264   2HG2  THR  38          3HG2      THR  38 -15.273  -2.534 -12.340
  265   3HG2  THR  38          2HG2      THR  38 -15.219  -1.377 -11.006
  266    H    PHE  39             H      PHE  39 -16.801   1.248 -10.159
  267    HA   PHE  39            HA      PHE  39 -15.294   0.046  -8.078
  268   1HB   PHE  39           2HB      PHE  39 -16.245   2.856  -8.487
  269   2HB   PHE  39           1HB      PHE  39 -15.149   2.367  -7.209
  270    HD1  PHE  39           HD2      PHE  39 -14.708   0.369 -10.196
  271    HD2  PHE  39           HD1      PHE  39 -13.586   4.097  -8.393
  272    HE1  PHE  39           HE2      PHE  39 -12.821   0.548 -11.724
  273    HE2  PHE  39           HE1      PHE  39 -11.676   4.252  -9.927
  274    HZ   PHE  39            HZ      PHE  39 -11.332   2.448 -11.564
  275    H    VAL  40             H      VAL  40 -18.399   1.672  -7.888
  276    HA   VAL  40            HA      VAL  40 -18.697   1.742  -5.096
  277    HB   VAL  40            HB      VAL  40 -20.230   3.042  -6.360
  278   1HG1  VAL  40          3HG1      VAL  40 -20.708   0.471  -7.831
  279   2HG1  VAL  40          2HG1      VAL  40 -21.898   1.774  -7.881
  280   3HG1  VAL  40          1HG1      VAL  40 -20.250   2.059  -8.469
  281   1HG2  VAL  40          1HG2      VAL  40 -21.099   1.335  -4.400
  282   2HG2  VAL  40          3HG2      VAL  40 -22.099   2.597  -5.129
  283   3HG2  VAL  40          2HG2      VAL  40 -22.209   0.937  -5.716
  284    H    ASN  41             H      ASN  41 -18.819  -0.925  -7.311
  285    HA   ASN  41            HA      ASN  41 -20.176  -2.688  -5.418
  286   1HB   ASN  41           2HB      ASN  41 -19.104  -2.955  -8.214
  287   2HB   ASN  41           1HB      ASN  41 -19.580  -4.346  -7.272
  288   1HD2  ASN  41          2HD2      ASN  41 -23.064  -3.674  -7.478
  289   2HD2  ASN  41          1HD2      ASN  41 -21.871  -4.567  -6.668
  290    H    ILE  42             H      ILE  42 -17.512  -1.346  -4.809
  291    HA   ILE  42            HA      ILE  42 -15.485  -3.403  -5.032
  292    HB   ILE  42            HB      ILE  42 -15.662  -0.598  -3.978
  293   1HG1  ILE  42          2HG1      ILE  42 -13.381  -1.952  -5.416
  294   2HG1  ILE  42          1HG1      ILE  42 -14.852  -1.514  -6.283
  295   1HG2  ILE  42          1HG2      ILE  42 -13.801  -2.674  -2.864
  296   2HG2  ILE  42          3HG2      ILE  42 -13.199  -1.038  -3.121
  297   3HG2  ILE  42          2HG2      ILE  42 -14.572  -1.316  -2.055
  298   1HD1  ILE  42          1HD1      ILE  42 -14.552   0.840  -5.355
  299   2HD1  ILE  42          3HD1      ILE  42 -12.949   0.330  -4.822
  300   3HD1  ILE  42          2HD1      ILE  42 -13.345   0.335  -6.547
  301    H    THR  43             H      THR  43 -15.269  -5.023  -3.762
  302    HA   THR  43            HA      THR  43 -16.460  -5.267  -1.029
  303    HB   THR  43            HB      THR  43 -16.054  -7.808  -1.788
  304    HG1  THR  43           HG1      THR  43 -15.399  -8.006  -3.728
  305   1HG2  THR  43          2HG2      THR  43 -18.216  -5.967  -2.726
  306   2HG2  THR  43          1HG2      THR  43 -18.280  -7.706  -3.027
  307   3HG2  THR  43          3HG2      THR  43 -18.267  -7.099  -1.369
  308    HA   PRO  44            HA      PRO  44 -12.335  -6.137   0.521
  309   1HB   PRO  44           2HB      PRO  44 -12.423  -8.528   1.747
  310   2HB   PRO  44           1HB      PRO  44 -13.001  -7.051   2.474
  311   1HG   PRO  44           2HG      PRO  44 -14.567  -9.309   1.311
  312   2HG   PRO  44           1HG      PRO  44 -15.037  -8.152   2.569
  313   1HD   PRO  44           2HD      PRO  44 -15.879  -8.043  -0.076
  314   2HD   PRO  44           1HD      PRO  44 -15.938  -6.683   1.037
  315    H    ALA  45             H      ALA  45 -13.495  -7.947  -1.915
  316    HA   ALA  45            HA      ALA  45 -11.278  -9.762  -2.321
  317   1HB   ALA  45           1HB      ALA  45 -13.647  -8.964  -4.004
  318   2HB   ALA  45           3HB      ALA  45 -12.438 -10.139  -4.532
  319   3HB   ALA  45           2HB      ALA  45 -13.440 -10.482  -3.125
  320    H    GLU  46             H      GLU  46 -12.686  -7.284  -4.332
  321    HA   GLU  46            HA      GLU  46 -10.368  -6.706  -5.885
  322   1HB   GLU  46           2HB      GLU  46 -11.579  -4.334  -6.134
  323   2HB   GLU  46           1HB      GLU  46 -12.213  -5.754  -6.944
  324   1HG   GLU  46           2HG      GLU  46 -13.181  -5.398  -4.184
  325   2HG   GLU  46           1HG      GLU  46 -13.649  -4.108  -5.283
  326    H    VAL  47             H      VAL  47 -11.603  -5.292  -2.911
  327    HA   VAL  47            HA      VAL  47  -9.413  -3.491  -2.596
  328    HB   VAL  47            HB      VAL  47 -11.918  -3.927  -1.225
  329   1HG1  VAL  47          2HG1      VAL  47 -10.235  -4.383   0.609
  330   2HG1  VAL  47          1HG1      VAL  47  -9.685  -2.734   0.322
  331   3HG1  VAL  47          3HG1      VAL  47 -11.317  -3.026   0.858
  332   1HG2  VAL  47          2HG2      VAL  47 -11.165  -1.971  -2.646
  333   2HG2  VAL  47          1HG2      VAL  47 -11.852  -1.544  -1.074
  334   3HG2  VAL  47          3HG2      VAL  47 -10.087  -1.563  -1.280
  335    H    GLY  48             H      GLY  48 -10.025  -6.753  -1.795
  336   1HA   GLY  48           2HA      GLY  48  -8.215  -7.166   0.340
  337   2HA   GLY  48           1HA      GLY  48  -8.629  -8.379  -0.873
  338    H    VAL  49             H      VAL  49  -7.688  -6.686  -3.069
  339    HA   VAL  49            HA      VAL  49  -4.783  -7.209  -2.798
  340    HB   VAL  49            HB      VAL  49  -5.890  -8.255  -4.730
  341   1HG1  VAL  49          1HG1      VAL  49  -6.664  -5.406  -5.297
  342   2HG1  VAL  49          3HG1      VAL  49  -6.520  -6.565  -6.611
  343   3HG1  VAL  49          2HG1      VAL  49  -7.671  -6.842  -5.304
  344   1HG2  VAL  49          1HG2      VAL  49  -3.853  -6.075  -5.273
  345   2HG2  VAL  49          3HG2      VAL  49  -3.577  -7.807  -5.097
  346   3HG2  VAL  49          2HG2      VAL  49  -4.387  -7.186  -6.530
  347    H    LEU  50             H      LEU  50  -6.992  -4.616  -3.424
  348    HA   LEU  50            HA      LEU  50  -5.193  -2.556  -4.169
  349   1HB   LEU  50           2HB      LEU  50  -7.876  -2.784  -3.089
  350   2HB   LEU  50           1HB      LEU  50  -7.145  -1.254  -2.934
  351    HG   LEU  50            HG      LEU  50  -7.106  -2.535  -5.599
  352   1HD1  LEU  50          1HD1      LEU  50  -9.546  -1.219  -4.317
  353   2HD1  LEU  50          3HD1      LEU  50  -9.406  -1.624  -6.034
  354   3HD1  LEU  50          2HD1      LEU  50  -9.432  -2.908  -4.830
  355   1HD2  LEU  50          3HD2      LEU  50  -6.177  -0.200  -4.783
  356   2HD2  LEU  50          2HD2      LEU  50  -7.017  -0.301  -6.330
  357   3HD2  LEU  50          1HD2      LEU  50  -7.869   0.301  -4.900
  358    H    VAL  51             H      VAL  51  -5.894  -4.031  -1.177
  359    HA   VAL  51            HA      VAL  51  -4.197  -2.092   0.295
  360    HB   VAL  51            HB      VAL  51  -5.940  -1.840   1.972
  361   1HG1  VAL  51          2HG1      VAL  51  -6.252  -0.695  -0.309
  362   2HG1  VAL  51          1HG1      VAL  51  -7.546  -1.872  -0.541
  363   3HG1  VAL  51          3HG1      VAL  51  -7.620  -0.728   0.799
  364   1HG2  VAL  51          2HG2      VAL  51  -6.764  -4.449   1.034
  365   2HG2  VAL  51          1HG2      VAL  51  -7.251  -3.606   2.507
  366   3HG2  VAL  51          3HG2      VAL  51  -8.123  -3.348   1.011
  367    H    GLY  52             H      GLY  52  -5.129  -5.382  -0.191
  368   1HA   GLY  52           2HA      GLY  52  -4.608  -6.667   2.175
  369   2HA   GLY  52           1HA      GLY  52  -4.237  -7.360   0.610
  370    H    LYS  53             H      LYS  53  -2.839  -7.599   3.043
  371    HA   LYS  53            HA      LYS  53  -0.487  -6.116   3.248
  372   1HB   LYS  53           2HB      LYS  53   0.451  -8.128   4.419
  373   2HB   LYS  53           1HB      LYS  53  -1.121  -7.619   5.036
  374   1HG   LYS  53           2HG      LYS  53  -1.504  -9.897   4.778
  375   2HG   LYS  53           1HG      LYS  53  -2.015  -9.322   3.193
  376   1HD   LYS  53           2HD      LYS  53  -0.230 -10.252   2.122
  377   2HD   LYS  53           1HD      LYS  53   0.876  -9.900   3.451
  378   1HE   LYS  53           2HE      LYS  53   0.736 -12.066   4.060
  379   2HE   LYS  53           1HE      LYS  53  -0.958 -11.797   4.470
  380   1HZ   LYS  53           3HZ      LYS  53  -0.157 -12.284   1.677
  381   2HZ   LYS  53           2HZ      LYS  53  -0.370 -13.587   2.744
  382   3HZ   LYS  53           1HZ      LYS  53  -1.664 -12.535   2.413
  383    H    ASP  54             H      ASP  54  -1.396  -8.404   0.878
  384    HA   ASP  54            HA      ASP  54   0.764  -9.672  -0.128
  385   1HB   ASP  54           2HB      ASP  54  -1.566  -9.596  -1.100
  386   2HB   ASP  54           1HB      ASP  54  -1.119  -8.070  -1.859
  387    NH1  ARG  55           NH1      ARG  55   6.990  -3.387  -2.989
  388    NH2  ARG  55           NH2      ARG  55   7.472  -2.025  -1.251
  389    H    ARG  55             H      ARG  55   2.679  -9.032  -0.786
  390    HA   ARG  55            HA      ARG  55   3.144  -6.283  -1.569
  391   1HB   ARG  55           2HB      ARG  55   4.042  -7.453   0.743
  392   2HB   ARG  55           1HB      ARG  55   5.429  -7.624  -0.336
  393   1HG   ARG  55           2HG      ARG  55   3.969  -5.002   0.078
  394   2HG   ARG  55           1HG      ARG  55   5.386  -5.476   1.015
  395   1HD   ARG  55           2HD      ARG  55   6.770  -5.538  -0.941
  396   2HD   ARG  55           1HD      ARG  55   5.372  -5.415  -2.012
  397    HE   ARG  55            HE      ARG  55   5.281  -3.102  -0.459
  398   1HH1  ARG  55          2HH1      ARG  55   6.464  -4.144  -3.378
  399   2HH1  ARG  55          1HH1      ARG  55   7.678  -2.919  -3.545
  400   1HH2  ARG  55          1HH2      ARG  55   7.317  -1.740  -0.305
  401   2HH2  ARG  55          2HH2      ARG  55   8.154  -1.556  -1.809
  402    H    SER  56             H      SER  56   2.688  -8.407  -3.521
  403    HA   SER  56            HA      SER  56   5.073  -8.053  -5.107
  404   1HB   SER  56           2HB      SER  56   5.874  -9.829  -3.615
  405   2HB   SER  56           1HB      SER  56   4.537 -10.844  -4.140
  406    HG   SER  56            HG      SER  56   5.799 -11.386  -5.725
  407    H    SER  57             H      SER  57   2.530 -10.442  -4.870
  408    HA   SER  57            HA      SER  57   2.207 -11.151  -7.496
  409   1HB   SER  57           2HB      SER  57  -0.247 -11.519  -7.002
  410   2HB   SER  57           1HB      SER  57   0.894 -12.321  -5.934
  411    HG   SER  57            HG      SER  57  -0.988 -10.962  -5.083
  412    H    PHE  58             H      PHE  58  -0.595  -9.273  -6.737
  413    HA   PHE  58            HA      PHE  58  -1.193  -8.259  -9.184
  414   1HB   PHE  58           2HB      PHE  58  -2.476  -6.491  -8.159
  415   2HB   PHE  58           1HB      PHE  58  -2.570  -7.929  -7.144
  416    HD1  PHE  58           HD2      PHE  58  -1.150  -8.084  -5.078
  417    HD2  PHE  58           HD1      PHE  58  -1.514  -4.461  -7.368
  418    HE1  PHE  58           HE2      PHE  58  -0.304  -6.783  -3.151
  419    HE2  PHE  58           HE1      PHE  58  -0.682  -3.168  -5.429
  420    HZ   PHE  58            HZ      PHE  58  -0.073  -4.319  -3.321
  421    OH   TYR  59            OH      TYR  59   2.120  -3.442  -2.667
  422    H    TYR  59             H      TYR  59   1.634  -6.985  -7.416
  423    HA   TYR  59            HA      TYR  59   1.759  -4.491  -8.751
  424   1HB   TYR  59           2HB      TYR  59   4.058  -6.140  -7.782
  425   2HB   TYR  59           1HB      TYR  59   4.168  -4.458  -8.292
  426    HD1  TYR  59           HD1      TYR  59   1.971  -3.112  -7.205
  427    HD2  TYR  59           HD2      TYR  59   4.224  -6.300  -5.496
  428    HE1  TYR  59           HE1      TYR  59   1.364  -2.319  -4.933
  429    HE2  TYR  59           HE2      TYR  59   3.627  -5.513  -3.248
  430    HH   TYR  59            HH      TYR  59   2.313  -2.506  -2.608
  431    H    VAL  60             H      VAL  60   1.997  -7.416 -10.209
  432    HA   VAL  60            HA      VAL  60   3.505  -6.343 -12.470
  433    HB   VAL  60            HB      VAL  60   3.951  -8.668 -12.986
  434   1HG1  VAL  60          3HG1      VAL  60   4.720  -7.423 -10.432
  435   2HG1  VAL  60          2HG1      VAL  60   5.158  -9.123 -10.644
  436   3HG1  VAL  60          1HG1      VAL  60   5.742  -7.914 -11.788
  437   1HG2  VAL  60          2HG2      VAL  60   2.089  -9.180 -10.777
  438   2HG2  VAL  60          1HG2      VAL  60   2.354 -10.117 -12.224
  439   3HG2  VAL  60          3HG2      VAL  60   3.474 -10.239 -10.875
  440    H    ASN  61             H      ASN  61   0.644  -8.177 -11.532
  441    HA   ASN  61            HA      ASN  61  -0.336  -8.225 -14.252
  442   1HB   ASN  61           2HB      ASN  61  -2.096  -9.653 -13.333
  443   2HB   ASN  61           1HB      ASN  61  -0.532 -10.250 -12.922
  444   1HD2  ASN  61          2HD2      ASN  61  -1.095 -10.163  -9.505
  445   2HD2  ASN  61          1HD2      ASN  61  -0.104 -10.654 -10.790
  446    H    GLY  62             H      GLY  62  -1.403  -6.995 -11.092
  447   1HA   GLY  62           2HA      GLY  62  -2.162  -4.555 -11.265
  448   2HA   GLY  62           1HA      GLY  62  -3.317  -5.183 -12.456
  449    H    LEU  63             H      LEU  63  -3.781  -3.943  -9.748
  450    HA   LEU  63            HA      LEU  63  -4.808  -6.185  -8.164
  451   1HB   LEU  63           2HB      LEU  63  -5.744  -4.262  -6.589
  452   2HB   LEU  63           1HB      LEU  63  -4.020  -4.594  -6.615
  453    HG   LEU  63            HG      LEU  63  -3.790  -2.769  -8.319
  454   1HD1  LEU  63          3HD1      LEU  63  -6.675  -2.412  -7.511
  455   2HD1  LEU  63          2HD1      LEU  63  -5.750  -1.173  -8.342
  456   3HD1  LEU  63          1HD1      LEU  63  -6.059  -2.720  -9.122
  457   1HD2  LEU  63          3HD2      LEU  63  -3.820  -2.687  -5.587
  458   2HD2  LEU  63          2HD2      LEU  63  -3.378  -1.325  -6.603
  459   3HD2  LEU  63          1HD2      LEU  63  -5.011  -1.459  -5.981
  460    H    THR  64             H      THR  64  -7.294  -4.412  -7.490
  461    HA   THR  64            HA      THR  64  -8.784  -4.582  -9.905
  462    HB   THR  64            HB      THR  64 -10.375  -6.253  -8.761
  463    HG1  THR  64           HG1      THR  64  -9.276  -7.642  -7.319
  464   1HG2  THR  64          1HG2      THR  64  -8.822  -6.698 -10.722
  465   2HG2  THR  64          3HG2      THR  64  -7.714  -7.402  -9.552
  466   3HG2  THR  64          2HG2      THR  64  -9.315  -8.102  -9.791
  467    H    LEU  65             H      LEU  65 -10.444  -3.309  -9.765
  468    HA   LEU  65            HA      LEU  65 -11.517  -2.511  -7.154
  469   1HB   LEU  65           2HB      LEU  65 -11.814  -0.183  -8.368
  470   2HB   LEU  65           1HB      LEU  65 -10.408  -0.575  -7.429
  471    HG   LEU  65            HG      LEU  65  -9.207  -1.240  -9.504
  472   1HD1  LEU  65          2HD1      LEU  65 -11.831  -0.761 -10.673
  473   2HD1  LEU  65          1HD1      LEU  65 -10.525  -0.053 -11.574
  474   3HD1  LEU  65          3HD1      LEU  65 -10.541  -1.774 -11.238
  475   1HD2  LEU  65          2HD2      LEU  65 -10.252   1.484  -8.952
  476   2HD2  LEU  65          1HD2      LEU  65  -8.585   0.907  -9.016
  477   3HD2  LEU  65          3HD2      LEU  65  -9.453   1.259 -10.512
  478    H    GLY  66             H      GLY  66 -13.430  -3.515  -7.205
  479   1HA   GLY  66           2HA      GLY  66 -15.704  -3.824  -7.759
  480   2HA   GLY  66           1HA      GLY  66 -15.486  -2.692  -9.097
  481    H    GLY  67             H      GLY  67 -13.251  -5.350  -8.686
  482   1HA   GLY  67           2HA      GLY  67 -13.062  -7.417  -9.812
  483   2HA   GLY  67           1HA      GLY  67 -14.609  -7.100 -10.602
  484    H    GLN  68             H      GLN  68 -12.463  -4.358 -10.733
  485    HA   GLN  68            HA      GLN  68 -11.879  -5.033 -13.593
  486   1HB   GLN  68           2HB      GLN  68 -13.091  -3.024 -13.475
  487   2HB   GLN  68           1HB      GLN  68 -12.100  -2.481 -12.176
  488   1HG   GLN  68           2HG      GLN  68 -11.666  -1.438 -14.530
  489   2HG   GLN  68           1HG      GLN  68 -10.273  -1.901 -13.563
  490   1HE2  GLN  68          2HE2      GLN  68  -9.095  -3.952 -16.191
  491   2HE2  GLN  68          1HE2      GLN  68  -8.745  -2.846 -14.949
  492    H    LYS  69             H      LYS  69  -9.979  -6.024 -13.725
  493    HA   LYS  69            HA      LYS  69  -7.769  -5.706 -11.958
  494   1HB   LYS  69           2HB      LYS  69  -8.497  -7.428 -14.026
  495   2HB   LYS  69           1HB      LYS  69  -7.021  -6.655 -14.603
  496   1HG   LYS  69           2HG      LYS  69  -5.717  -7.674 -13.032
  497   2HG   LYS  69           1HG      LYS  69  -6.951  -7.529 -11.778
  498   1HD   LYS  69           2HD      LYS  69  -7.994  -9.498 -12.372
  499   2HD   LYS  69           1HD      LYS  69  -7.476  -9.388 -14.053
  500   1HE   LYS  69           2HE      LYS  69  -6.236 -11.185 -12.992
  501   2HE   LYS  69           1HE      LYS  69  -5.128  -9.849 -13.301
  502   1HZ   LYS  69           2HZ      LYS  69  -5.578  -9.103 -10.986
  503   2HZ   LYS  69           1HZ      LYS  69  -6.421 -10.555 -10.731
  504   3HZ   LYS  69           3HZ      LYS  69  -4.765 -10.592 -11.094
  505    H    CYS  70             H      CYS  70  -6.733  -3.698 -11.724
  506    HA   CYS  70            HA      CYS  70  -5.871  -2.439 -14.368
  507   1HB   CYS  70           2HB      CYS  70  -5.634  -0.347 -12.941
  508   2HB   CYS  70           1HB      CYS  70  -7.214  -0.889 -13.359
  509    HG   CYS  70            HG      CYS  70  -7.335  -0.351 -10.852
  510    H    SER  71             H      SER  71  -3.859  -2.532 -14.670
  511    HA   SER  71            HA      SER  71  -1.905  -3.754 -13.001
  512   1HB   SER  71           2HB      SER  71  -0.399  -3.292 -14.799
  513   2HB   SER  71           1HB      SER  71  -1.961  -3.891 -15.361
  514    HG   SER  71            HG      SER  71  -0.922  -1.287 -15.408
  515    H    VAL  72             H      VAL  72  -0.725  -2.939 -11.442
  516    HA   VAL  72            HA      VAL  72  -0.566  -0.154 -10.822
  517    HB   VAL  72            HB      VAL  72   1.482  -2.058  -9.869
  518   1HG1  VAL  72          3HG1      VAL  72   1.274   0.460  -9.375
  519   2HG1  VAL  72          2HG1      VAL  72  -0.039  -0.053  -8.333
  520   3HG1  VAL  72          1HG1      VAL  72   1.574  -0.647  -8.054
  521   1HG2  VAL  72          3HG2      VAL  72  -1.394  -1.997  -9.144
  522   2HG2  VAL  72          2HG2      VAL  72  -0.381  -3.386  -9.508
  523   3HG2  VAL  72          1HG2      VAL  72  -0.170  -2.513  -7.991
  524    H    ILE  73             H      ILE  73   0.403   1.173 -12.150
  525    HA   ILE  73            HA      ILE  73   2.952   0.536 -13.226
  526    HB   ILE  73            HB      ILE  73   0.790   2.345 -14.066
  527   1HG1  ILE  73          2HG1      ILE  73   2.396   1.057 -16.137
  528   2HG1  ILE  73          1HG1      ILE  73   1.842  -0.116 -14.947
  529   1HG2  ILE  73          1HG2      ILE  73   3.708   2.806 -14.506
  530   2HG2  ILE  73          3HG2      ILE  73   2.575   3.225 -15.793
  531   3HG2  ILE  73          2HG2      ILE  73   2.440   3.997 -14.213
  532   1HD1  ILE  73          2HD1      ILE  73  -0.512   1.000 -15.306
  533   2HD1  ILE  73          1HD1      ILE  73   0.192   1.625 -16.791
  534   3HD1  ILE  73          3HD1      ILE  73   0.076  -0.135 -16.553
  535    NH1  ARG  74           NH2      ARG  74   6.666   4.610 -12.850
  536    NH2  ARG  74           NH1      ARG  74   7.980   2.875 -12.239
  537    H    ARG  74             H      ARG  74   3.445   0.759 -10.972
  538    HA   ARG  74            HA      ARG  74   5.186   1.819  -9.650
  539   1HB   ARG  74           2HB      ARG  74   4.748   3.990 -11.112
  540   2HB   ARG  74           1HB      ARG  74   3.769   4.452  -9.716
  541   1HG   ARG  74           2HG      ARG  74   5.591   4.577  -8.308
  542   2HG   ARG  74           1HG      ARG  74   6.479   3.325  -9.180
  543   1HD   ARG  74           2HD      ARG  74   5.962   5.800 -10.720
  544   2HD   ARG  74           1HD      ARG  74   7.059   5.981  -9.354
  545    HE   ARG  74            HE      ARG  74   8.649   4.676 -10.520
  546   1HH1  ARG  74          1HH2      ARG  74   6.269   5.506 -12.656
  547   2HH1  ARG  74          2HH2      ARG  74   6.459   4.148 -13.714
  548   1HH2  ARG  74          2HH1      ARG  74   8.589   2.441 -11.576
  549   2HH2  ARG  74          1HH1      ARG  74   7.771   2.415 -13.103
  550    H    ASP  75             H      ASP  75   4.843   1.122  -7.655
  551    HA   ASP  75            HA      ASP  75   2.233   1.680  -6.461
  552   1HB   ASP  75           2HB      ASP  75   2.235  -0.596  -6.338
  553   2HB   ASP  75           1HB      ASP  75   3.942  -0.691  -6.333
  554    H    SER  76             H      SER  76   2.374   3.573  -5.473
  555    HA   SER  76            HA      SER  76   4.284   3.757  -3.179
  556   1HB   SER  76           2HB      SER  76   4.278   5.529  -5.359
  557   2HB   SER  76           1HB      SER  76   3.338   6.357  -4.142
  558    HG   SER  76            HG      SER  76   5.941   5.261  -3.871
  559    H    LEU  77             H      LEU  77   1.499   2.710  -3.507
  560    HA   LEU  77            HA      LEU  77  -0.549   4.500  -2.487
  561   1HB   LEU  77           2HB      LEU  77  -0.871   2.298  -3.670
  562   2HB   LEU  77           1HB      LEU  77  -0.284   1.463  -2.250
  563    HG   LEU  77            HG      LEU  77  -2.545   3.381  -1.922
  564   1HD1  LEU  77          1HD1      LEU  77  -2.801   1.763  -4.029
  565   2HD1  LEU  77          3HD1      LEU  77  -3.083   0.539  -2.785
  566   3HD1  LEU  77          2HD1      LEU  77  -4.142   1.946  -2.884
  567   1HD2  LEU  77          1HD2      LEU  77  -1.436   0.899  -0.674
  568   2HD2  LEU  77          3HD2      LEU  77  -2.010   2.369   0.101
  569   3HD2  LEU  77          2HD2      LEU  77  -3.160   1.189  -0.520
  570    H    LEU  78             H      LEU  78   1.998   2.736  -0.819
  571    HA   LEU  78            HA      LEU  78   0.638   3.426   1.676
  572   1HB   LEU  78           2HB      LEU  78   2.799   1.562   1.158
  573   2HB   LEU  78           1HB      LEU  78   2.314   1.959   2.769
  574    HG   LEU  78            HG      LEU  78   0.450   0.888   0.613
  575   1HD1  LEU  78          3HD1      LEU  78   2.144  -0.807   1.448
  576   2HD1  LEU  78          2HD1      LEU  78   1.429  -0.622   3.048
  577   3HD1  LEU  78          1HD1      LEU  78   0.444  -1.251   1.710
  578   1HD2  LEU  78          2HD2      LEU  78  -0.013   2.186   3.142
  579   2HD2  LEU  78          1HD2      LEU  78  -1.200   1.565   1.992
  580   3HD2  LEU  78          3HD2      LEU  78  -0.566   0.515   3.258
  581    H    GLN  79             H      GLN  79   1.153   5.163   2.618
  582    HA   GLN  79            HA      GLN  79   2.552   7.197   1.796
  583   1HB   GLN  79           2HB      GLN  79   2.306   8.160   4.081
  584   2HB   GLN  79           1HB      GLN  79   0.814   7.449   3.465
  585   1HG   GLN  79           2HG      GLN  79   1.627   5.290   4.648
  586   2HG   GLN  79           1HG      GLN  79   2.712   6.365   5.520
  587   1HE2  GLN  79          2HE2      GLN  79  -0.002   6.566   7.829
  588   2HE2  GLN  79          1HE2      GLN  79   1.501   5.842   7.522
  589    H    ASP  80             H      ASP  80   4.376   6.345   1.121
  590    HA   ASP  80            HA      ASP  80   6.622   6.302   3.091
  591   1HB   ASP  80           2HB      ASP  80   6.629   4.414   1.445
  592   2HB   ASP  80           1HB      ASP  80   6.559   5.580   0.119
  593    H    GLY  81             H      GLY  81   4.802   8.587   2.166
  594   1HA   GLY  81           2HA      GLY  81   5.361  10.915   1.984
  595   2HA   GLY  81           1HA      GLY  81   6.842  10.450   1.129
  596    H    GLU  82             H      GLU  82   3.747   8.852   0.403
  597    HA   GLU  82            HA      GLU  82   3.320  10.406  -2.025
  598   1HB   GLU  82           2HB      GLU  82   4.472   7.702  -1.838
  599   2HB   GLU  82           1HB      GLU  82   3.343   8.024  -3.103
  600   1HG   GLU  82           2HG      GLU  82   5.186   8.647  -4.251
  601   2HG   GLU  82           1HG      GLU  82   4.896  10.187  -3.404
  602    H    PHE  83             H      PHE  83   2.420   7.174  -0.894
  603    HA   PHE  83            HA      PHE  83   0.435   5.988  -0.868
  604   1HB   PHE  83           2HB      PHE  83  -1.702   7.687  -0.947
  605   2HB   PHE  83           1HB      PHE  83  -1.060   6.861   0.405
  606    HD1  PHE  83           HD1      PHE  83   0.934   8.038   1.613
  607    HD2  PHE  83           HD2      PHE  83  -1.873  10.042  -0.885
  608    HE1  PHE  83           HE1      PHE  83   1.542  10.185   2.701
  609    HE2  PHE  83           HE2      PHE  83  -1.299  12.203   0.191
  610    HZ   PHE  83            HZ      PHE  83   0.414  12.279   1.987
  611    H    SER  84             H      SER  84   1.357   7.819  -3.458
  612    HA   SER  84            HA      SER  84  -1.099   7.331  -4.987
  613   1HB   SER  84           2HB      SER  84   0.316   8.541  -6.805
  614   2HB   SER  84           1HB      SER  84  -0.379   9.467  -5.475
  615    HG   SER  84            HG      SER  84   1.623  10.057  -5.169
  616    H    MET  85             H      MET  85  -1.312   5.814  -6.385
  617    HA   MET  85            HA      MET  85   1.070   4.121  -7.202
  618   1HB   MET  85           2HB      MET  85  -0.434   3.257  -5.321
  619   2HB   MET  85           1HB      MET  85  -1.711   3.263  -6.504
  620   1HG   MET  85           2HG      MET  85  -1.063   1.358  -7.396
  621   2HG   MET  85           1HG      MET  85   0.606   1.880  -7.476
  622   1HE   MET  85           1HE      MET  85  -1.232  -0.550  -6.849
  623   2HE   MET  85           3HE      MET  85   0.180  -1.462  -6.260
  624   3HE   MET  85           2HE      MET  85  -1.216  -1.163  -5.201
  625    H    ASP  86             H      ASP  86   1.099   4.067  -9.551
  626    HA   ASP  86            HA      ASP  86  -1.398   5.036 -10.817
  627   1HB   ASP  86           2HB      ASP  86   1.181   4.080 -11.908
  628   2HB   ASP  86           1HB      ASP  86  -0.151   4.486 -12.915
  629    H    LEU  87             H      LEU  87  -2.742   3.730 -11.965
  630    HA   LEU  87            HA      LEU  87  -2.165   0.898 -12.102
  631   1HB   LEU  87           2HB      LEU  87  -4.318   2.228 -10.728
  632   2HB   LEU  87           1HB      LEU  87  -4.496   0.663 -11.348
  633    HG   LEU  87            HG      LEU  87  -2.037   0.851  -9.912
  634   1HD1  LEU  87          2HD1      LEU  87  -4.549   1.780  -8.521
  635   2HD1  LEU  87          1HD1      LEU  87  -3.188   1.081  -7.638
  636   3HD1  LEU  87          3HD1      LEU  87  -2.965   2.570  -8.562
  637   1HD2  LEU  87          3HD2      LEU  87  -4.520  -0.772  -9.828
  638   2HD2  LEU  87          2HD2      LEU  87  -2.886  -1.278 -10.217
  639   3HD2  LEU  87          1HD2      LEU  87  -3.329  -0.919  -8.558
  640    NH1  ARG  88           NH2      ARG  88   0.383   2.709 -20.030
  641    NH2  ARG  88           NH1      ARG  88   0.129   0.687 -21.009
  642    H    ARG  88             H      ARG  88  -3.148  -0.023 -14.065
  643    HA   ARG  88            HA      ARG  88  -5.207   1.628 -15.298
  644   1HB   ARG  88           2HB      ARG  88  -4.113   2.332 -17.192
  645   2HB   ARG  88           1HB      ARG  88  -2.766   2.296 -16.083
  646   1HG   ARG  88           2HG      ARG  88  -2.000   0.160 -17.032
  647   2HG   ARG  88           1HG      ARG  88  -3.464   0.046 -18.058
  648   1HD   ARG  88           2HD      ARG  88  -2.702   1.531 -19.552
  649   2HD   ARG  88           1HD      ARG  88  -2.023   2.635 -18.293
  650    HE   ARG  88            HE      ARG  88  -0.325   0.370 -18.389
  651   1HH1  ARG  88          1HH2      ARG  88   0.238   3.317 -19.250
  652   2HH1  ARG  88          2HH2      ARG  88   0.871   3.039 -20.837
  653   1HH2  ARG  88          2HH1      ARG  88  -0.217  -0.251 -20.981
  654   2HH2  ARG  88          1HH1      ARG  88   0.635   1.008 -21.810
  655    H    THR  89             H      THR  89  -6.713   0.514 -16.147
  656    HA   THR  89            HA      THR  89  -6.851  -2.304 -16.342
  657    HB   THR  89            HB      THR  89  -8.983  -1.950 -17.233
  658    HG1  THR  89           HG1      THR  89  -9.536  -0.559 -18.805
  659   1HG2  THR  89          2HG2      THR  89  -8.605  -0.340 -15.283
  660   2HG2  THR  89          1HG2      THR  89  -8.616   0.925 -16.535
  661   3HG2  THR  89          3HG2      THR  89 -10.041  -0.101 -16.271
  662    H    LYS  90             H      LYS  90  -4.964  -3.051 -17.494
  663    HA   LYS  90            HA      LYS  90  -4.347  -1.958 -20.059
  664   1HB   LYS  90           2HB      LYS  90  -3.052  -4.501 -19.222
  665   2HB   LYS  90           1HB      LYS  90  -2.373  -3.047 -19.919
  666   1HG   LYS  90           2HG      LYS  90  -2.681  -1.911 -17.737
  667   2HG   LYS  90           1HG      LYS  90  -2.978  -3.518 -17.034
  668   1HD   LYS  90           2HD      LYS  90  -0.612  -3.186 -18.881
  669   2HD   LYS  90           1HD      LYS  90  -0.465  -2.516 -17.267
  670   1HE   LYS  90           2HE      LYS  90   0.060  -4.594 -16.537
  671   2HE   LYS  90           1HE      LYS  90  -1.592  -5.083 -16.903
  672   1HZ   LYS  90           2HZ      LYS  90   0.609  -5.065 -18.897
  673   2HZ   LYS  90           1HZ      LYS  90   0.145  -6.439 -18.011
  674   3HZ   LYS  90           3HZ      LYS  90  -0.948  -5.719 -19.089
  675    H    SER  91             H      SER  91  -4.875  -2.927 -21.961
  676    HA   SER  91            HA      SER  91  -6.428  -5.457 -21.926
  677   1HB   SER  91           2HB      SER  91  -7.744  -3.236 -22.130
  678   2HB   SER  91           1HB      SER  91  -7.219  -3.272 -23.785
  679    HG   SER  91            HG      SER  91  -9.258  -4.477 -22.887
  680    H    THR  92             H      THR  92  -7.000  -5.522 -24.670
  681    HA   THR  92            HA      THR  92  -4.280  -6.265 -25.698
  682    HB   THR  92            HB      THR  92  -5.422  -7.795 -27.193
  683    HG1  THR  92           HG1      THR  92  -7.375  -7.381 -27.788
  684   1HG2  THR  92          1HG2      THR  92  -6.368  -7.761 -24.330
  685   2HG2  THR  92          3HG2      THR  92  -6.875  -9.037 -25.439
  686   3HG2  THR  92          2HG2      THR  92  -5.164  -8.806 -25.088
  687    H    GLY  93             H      GLY  93  -4.198  -6.232 -28.252
  688   1HA   GLY  93           2HA      GLY  93  -4.341  -3.453 -29.096
  689   2HA   GLY  93           1HA      GLY  93  -3.861  -4.817 -30.111
  690    H    GLY  94             H      GLY  94  -6.559  -2.946 -28.920
  691   1HA   GLY  94           2HA      GLY  94  -8.223  -2.704 -30.999
  692   2HA   GLY  94           1HA      GLY  94  -8.515  -4.404 -30.600
  693    H    ALA  95             H      ALA  95  -8.058  -4.036 -27.734
  694    HA   ALA  95            HA      ALA  95 -10.737  -3.091 -26.997
  695   1HB   ALA  95           2HB      ALA  95  -8.855  -4.894 -25.869
  696   2HB   ALA  95           1HB      ALA  95  -9.048  -3.570 -24.702
  697   3HB   ALA  95           3HB      ALA  95 -10.459  -4.486 -25.254
  698    HA   PRO  96            HA      PRO  96  -9.392   0.782 -25.401
  699   1HB   PRO  96           2HB      PRO  96 -11.404   1.261 -23.672
  700   2HB   PRO  96           1HB      PRO  96 -11.688   1.161 -25.420
  701   1HG   PRO  96           2HG      PRO  96 -12.488  -0.773 -23.319
  702   2HG   PRO  96           1HG      PRO  96 -13.094  -0.618 -24.970
  703   1HD   PRO  96           2HD      PRO  96 -11.081  -2.497 -23.977
  704   2HD   PRO  96           1HD      PRO  96 -11.812  -2.386 -25.594
  705    H    THR  97             H      THR  97  -7.815   1.220 -23.898
  706    HA   THR  97            HA      THR  97  -7.764  -0.290 -21.316
  707    HB   THR  97            HB      THR  97  -5.570   1.088 -20.978
  708    HG1  THR  97           HG1      THR  97  -5.852   1.338 -23.820
  709   1HG2  THR  97          3HG2      THR  97  -6.068  -1.356 -22.114
  710   2HG2  THR  97          2HG2      THR  97  -5.100  -0.564 -23.361
  711   3HG2  THR  97          1HG2      THR  97  -4.465  -0.708 -21.709
  712    H    PHE  98             H      PHE  98  -7.337   1.049 -19.407
  713    HA   PHE  98            HA      PHE  98  -8.315   3.842 -19.402
  714   1HB   PHE  98           2HB      PHE  98  -9.702   1.492 -18.059
  715   2HB   PHE  98           1HB      PHE  98  -9.886   3.178 -17.508
  716    HD1  PHE  98           HD1      PHE  98 -10.184   4.906 -19.632
  717    HD2  PHE  98           HD2      PHE  98 -11.364   0.808 -19.605
  718    HE1  PHE  98           HE1      PHE  98 -11.799   5.484 -21.489
  719    HE2  PHE  98           HE2      PHE  98 -12.969   1.268 -21.447
  720    HZ   PHE  98            HZ      PHE  98 -13.186   3.545 -22.387
  721    H    ASN  99             H      ASN  99  -7.290   4.938 -17.571
  722    HA   ASN  99            HA      ASN  99  -5.336   3.236 -16.183
  723   1HB   ASN  99           2HB      ASN  99  -4.858   6.150 -16.687
  724   2HB   ASN  99           1HB      ASN  99  -3.716   4.958 -16.062
  725   1HD2  ASN  99          2HD2      ASN  99  -2.780   5.346 -19.542
  726   2HD2  ASN  99          1HD2      ASN  99  -2.764   6.288 -18.134
  727    H    VAL 100             H      VAL 100  -4.549   4.955 -14.275
  728    HA   VAL 100            HA      VAL 100  -6.830   5.748 -12.765
  729    HB   VAL 100            HB      VAL 100  -5.225   3.453 -11.640
  730   1HG1  VAL 100          3HG1      VAL 100  -7.679   4.885 -10.984
  731   2HG1  VAL 100          2HG1      VAL 100  -7.763   3.146 -10.716
  732   3HG1  VAL 100          1HG1      VAL 100  -6.508   4.100  -9.933
  733   1HG2  VAL 100          3HG2      VAL 100  -6.206   2.504 -13.764
  734   2HG2  VAL 100          2HG2      VAL 100  -6.801   1.736 -12.318
  735   3HG2  VAL 100          1HG2      VAL 100  -7.766   2.907 -13.146
  736    H    THR 101             H      THR 101  -6.152   6.118 -10.549
  737    HA   THR 101            HA      THR 101  -3.326   6.212  -9.901
  738    HB   THR 101            HB      THR 101  -5.115   8.710  -9.898
  739    HG1  THR 101           HG1      THR 101  -2.436   8.339 -10.710
  740   1HG2  THR 101          1HG2      THR 101  -3.988   8.314  -7.642
  741   2HG2  THR 101          3HG2      THR 101  -2.452   8.484  -8.484
  742   3HG2  THR 101          2HG2      THR 101  -3.594   9.821  -8.432
  743    H    VAL 102             H      VAL 102  -3.251   5.801  -7.624
  744    HA   VAL 102            HA      VAL 102  -5.842   5.699  -6.217
  745    HB   VAL 102            HB      VAL 102  -3.914   3.454  -6.781
  746   1HG1  VAL 102          1HG1      VAL 102  -4.155   3.615  -4.243
  747   2HG1  VAL 102          3HG1      VAL 102  -5.909   3.488  -4.452
  748   3HG1  VAL 102          2HG1      VAL 102  -4.854   2.143  -4.918
  749   1HG2  VAL 102          3HG2      VAL 102  -6.877   3.959  -6.791
  750   2HG2  VAL 102          2HG2      VAL 102  -5.825   3.538  -8.142
  751   3HG2  VAL 102          1HG2      VAL 102  -6.213   2.327  -6.918
  752    H    THR 103             H      THR 103  -5.727   6.946  -4.593
  753    HA   THR 103            HA      THR 103  -3.144   7.420  -3.193
  754    HB   THR 103            HB      THR 103  -4.386   9.437  -2.289
  755    HG1  THR 103           HG1      THR 103  -6.328   9.816  -3.019
  756   1HG2  THR 103          3HG2      THR 103  -3.034   8.931  -4.734
  757   2HG2  THR 103          2HG2      THR 103  -4.361  10.041  -5.093
  758   3HG2  THR 103          1HG2      THR 103  -3.168  10.450  -3.860
  759    H    LYS 104             H      LYS 104  -3.045   6.013  -1.473
  760    HA   LYS 104            HA      LYS 104  -5.522   5.414   0.052
  761   1HB   LYS 104           2HB      LYS 104  -4.163   3.533  -0.775
  762   2HB   LYS 104           1HB      LYS 104  -2.794   4.151   0.123
  763   1HG   LYS 104           2HG      LYS 104  -3.476   2.891   1.865
  764   2HG   LYS 104           1HG      LYS 104  -4.823   4.016   2.036
  765   1HD   LYS 104           2HD      LYS 104  -6.248   2.673   0.722
  766   2HD   LYS 104           1HD      LYS 104  -4.918   1.690   0.128
  767   1HE   LYS 104           2HE      LYS 104  -5.791   1.856   2.995
  768   2HE   LYS 104           1HE      LYS 104  -6.206   0.544   1.902
  769   1HZ   LYS 104           2HZ      LYS 104  -3.658   0.440   1.563
  770   2HZ   LYS 104           1HZ      LYS 104  -3.596   1.253   3.054
  771   3HZ   LYS 104           3HZ      LYS 104  -4.347  -0.264   2.947
  772    H    THR 105             H      THR 105  -5.905   6.539   1.867
  773    HA   THR 105            HA      THR 105  -3.788   8.108   3.209
  774    HB   THR 105            HB      THR 105  -5.577   8.860   4.698
  775    HG1  THR 105           HG1      THR 105  -7.411   7.817   4.897
  776   1HG2  THR 105          2HG2      THR 105  -5.845   8.919   1.791
  777   2HG2  THR 105          1HG2      THR 105  -7.385   9.134   2.610
  778   3HG2  THR 105          3HG2      THR 105  -6.048  10.223   2.961
  779    H    ASP 106             H      ASP 106  -4.984   7.514   5.982
  780    HA   ASP 106            HA      ASP 106  -3.363   5.109   6.544
  781   1HB   ASP 106           2HB      ASP 106  -3.109   7.224   7.885
  782   2HB   ASP 106           1HB      ASP 106  -4.745   6.970   8.494
  783    H    LYS 107             H      LYS 107  -6.722   6.173   6.463
  784    HA   LYS 107            HA      LYS 107  -7.570   3.385   7.061
  785   1HB   LYS 107           2HB      LYS 107  -8.998   5.675   8.434
  786   2HB   LYS 107           1HB      LYS 107  -9.106   3.956   8.785
  787   1HG   LYS 107           2HG      LYS 107  -6.847   3.924   9.665
  788   2HG   LYS 107           1HG      LYS 107  -6.584   5.590   9.161
  789   1HD   LYS 107           2HD      LYS 107  -8.687   6.085  10.649
  790   2HD   LYS 107           1HD      LYS 107  -8.272   4.545  11.405
  791   1HE   LYS 107           2HE      LYS 107  -5.864   5.506  11.542
  792   2HE   LYS 107           1HE      LYS 107  -6.635   7.070  11.274
  793   1HZ   LYS 107           1HZ      LYS 107  -7.711   5.270  13.331
  794   2HZ   LYS 107           3HZ      LYS 107  -6.314   6.169  13.674
  795   3HZ   LYS 107           2HZ      LYS 107  -7.753   6.967  13.256
  796    H    THR 108             H      THR 108  -7.512   5.170   4.652
  797    HA   THR 108            HA      THR 108 -10.299   4.678   3.789
  798    HB   THR 108            HB      THR 108 -10.829   6.876   3.141
  799    HG1  THR 108           HG1      THR 108  -8.884   7.374   2.112
  800   1HG2  THR 108          3HG2      THR 108 -10.797   6.596   5.623
  801   2HG2  THR 108          2HG2      THR 108  -9.159   7.255   5.652
  802   3HG2  THR 108          1HG2      THR 108 -10.505   8.271   5.130
  803    H    LEU 109             H      LEU 109 -10.372   4.481   1.481
  804    HA   LEU 109            HA      LEU 109  -7.732   4.151   0.108
  805   1HB   LEU 109           2HB      LEU 109  -9.385   2.208   0.917
  806   2HB   LEU 109           1HB      LEU 109 -10.126   2.527  -0.625
  807    HG   LEU 109            HG      LEU 109  -7.446   1.357  -0.020
  808   1HD1  LEU 109          2HD1      LEU 109  -9.555   0.152  -0.641
  809   2HD1  LEU 109          1HD1      LEU 109  -9.401   0.875  -2.237
  810   3HD1  LEU 109          3HD1      LEU 109  -8.151  -0.200  -1.633
  811   1HD2  LEU 109          3HD2      LEU 109  -8.177   2.984  -2.430
  812   2HD2  LEU 109          2HD2      LEU 109  -6.782   3.188  -1.373
  813   3HD2  LEU 109          1HD2      LEU 109  -6.898   1.781  -2.431
  814    H    VAL 110             H      VAL 110  -7.890   6.209  -1.189
  815    HA   VAL 110            HA      VAL 110 -10.440   6.707  -2.580
  816    HB   VAL 110            HB      VAL 110  -7.892   8.291  -2.125
  817   1HG1  VAL 110          3HG1      VAL 110  -9.819   8.609  -4.309
  818   2HG1  VAL 110          2HG1      VAL 110  -9.652  10.055  -3.328
  819   3HG1  VAL 110          1HG1      VAL 110  -8.237   9.348  -4.096
  820   1HG2  VAL 110          3HG2      VAL 110  -9.627   8.166  -0.357
  821   2HG2  VAL 110          2HG2      VAL 110  -9.428   9.804  -0.972
  822   3HG2  VAL 110          1HG2      VAL 110 -10.811   8.828  -1.486
  823    H    LEU 111             H      LEU 111 -10.628   6.727  -4.837
  824    HA   LEU 111            HA      LEU 111  -8.299   5.854  -6.422
  825   1HB   LEU 111           2HB      LEU 111 -11.105   4.905  -7.096
  826   2HB   LEU 111           1HB      LEU 111  -9.570   4.265  -7.673
  827    HG   LEU 111            HG      LEU 111 -10.035   4.160  -4.770
  828   1HD1  LEU 111          2HD1      LEU 111 -11.859   2.935  -6.696
  829   2HD1  LEU 111          1HD1      LEU 111 -11.183   1.783  -5.539
  830   3HD1  LEU 111          3HD1      LEU 111 -12.070   3.198  -4.970
  831   1HD2  LEU 111          1HD2      LEU 111  -8.536   2.705  -6.858
  832   2HD2  LEU 111          3HD2      LEU 111  -8.119   2.956  -5.164
  833   3HD2  LEU 111          2HD2      LEU 111  -9.224   1.650  -5.615
  834    H    LEU 112             H      LEU 112  -8.243   6.689  -8.411
  835    HA   LEU 112            HA      LEU 112 -10.338   8.564  -9.371
  836   1HB   LEU 112           2HB      LEU 112  -8.459   9.888  -8.295
  837   2HB   LEU 112           1HB      LEU 112  -7.350   9.042  -9.327
  838    HG   LEU 112            HG      LEU 112  -7.823  10.328 -11.170
  839   1HD1  LEU 112          3HD1      LEU 112 -10.616  10.081 -10.387
  840   2HD1  LEU 112          2HD1      LEU 112 -10.229  11.672 -11.007
  841   3HD1  LEU 112          1HD1      LEU 112  -9.908  10.247 -11.991
  842   1HD2  LEU 112          3HD2      LEU 112  -7.989  11.806  -8.692
  843   2HD2  LEU 112          2HD2      LEU 112  -7.140  12.207 -10.190
  844   3HD2  LEU 112          1HD2      LEU 112  -8.834  12.639 -10.004
  845    H    MET 113             H      MET 113 -10.906   7.097 -10.899
  846    HA   MET 113            HA      MET 113  -8.635   5.809 -12.468
  847   1HB   MET 113           2HB      MET 113 -10.102   4.306 -11.162
  848   2HB   MET 113           1HB      MET 113 -11.458   4.859 -12.122
  849   1HG   MET 113           2HG      MET 113  -9.210   3.918 -13.716
  850   2HG   MET 113           1HG      MET 113  -9.888   2.670 -12.747
  851   1HE   MET 113           3HE      MET 113 -11.314   1.366 -13.231
  852   2HE   MET 113           2HE      MET 113 -12.757   1.476 -14.237
  853   3HE   MET 113           1HE      MET 113 -11.194   1.143 -14.982
  854    H    GLY 114             H      GLY 114  -8.971   5.359 -14.686
  855   1HA   GLY 114           2HA      GLY 114 -10.642   5.557 -16.508
  856   2HA   GLY 114           1HA      GLY 114 -10.675   7.193 -16.022
  857    H    LYS 115             H      LYS 115 -10.306   6.432 -18.559
  858    HA   LYS 115            HA      LYS 115  -8.152   7.912 -19.328
  859   1HB   LYS 115           2HB      LYS 115  -8.422   5.250 -20.570
  860   2HB   LYS 115           1HB      LYS 115  -7.498   6.498 -21.323
  861   1HG   LYS 115           2HG      LYS 115  -6.123   6.069 -18.964
  862   2HG   LYS 115           1HG      LYS 115  -6.701   4.569 -19.361
  863   1HD   LYS 115           2HD      LYS 115  -5.689   5.904 -21.690
  864   2HD   LYS 115           1HD      LYS 115  -4.482   5.531 -20.480
  865   1HE   LYS 115           2HE      LYS 115  -5.788   3.174 -20.425
  866   2HE   LYS 115           1HE      LYS 115  -6.167   3.682 -22.084
  867   1HZ   LYS 115           2HZ      LYS 115  -3.379   3.983 -21.257
  868   2HZ   LYS 115           1HZ      LYS 115  -3.936   2.394 -21.478
  869   3HZ   LYS 115           3HZ      LYS 115  -4.023   3.504 -22.757
  870    H    GLU 116             H      GLU 116  -9.004   9.260 -20.730
  871    HA   GLU 116            HA      GLU 116 -10.621   8.044 -22.875
  872   1HB   GLU 116           2HB      GLU 116 -11.476   9.930 -21.303
  873   2HB   GLU 116           1HB      GLU 116 -10.581  10.862 -22.371
  874   1HG   GLU 116           2HG      GLU 116 -12.070  10.716 -24.056
  875   2HG   GLU 116           1HG      GLU 116 -12.160   8.965 -23.842
  876    H    GLY 117             H      GLY 117  -8.428   7.491 -23.962
  877   1HA   GLY 117           2HA      GLY 117  -6.368   8.123 -25.060
  878   2HA   GLY 117           1HA      GLY 117  -7.131   9.697 -25.318
  879    H    VAL 118             H      VAL 118  -7.186   9.274 -21.928
  880    HA   VAL 118            HA      VAL 118  -5.898  11.346 -20.966
  881    HB   VAL 118            HB      VAL 118  -7.369   9.763 -19.716
  882   1HG1  VAL 118          2HG1      VAL 118  -6.196   7.810 -20.613
  883   2HG1  VAL 118          1HG1      VAL 118  -4.841   8.136 -19.539
  884   3HG1  VAL 118          3HG1      VAL 118  -6.429   7.769 -18.857
  885   1HG2  VAL 118          2HG2      VAL 118  -5.157  11.125 -18.501
  886   2HG2  VAL 118          1HG2      VAL 118  -6.549  10.445 -17.700
  887   3HG2  VAL 118          3HG2      VAL 118  -5.069   9.469 -17.813
  888    H    HIS 119             H      HIS 119  -4.101  11.777 -19.907
  889    HA   HIS 119            HA      HIS 119  -1.564  10.759 -20.993
  890   1HB   HIS 119           2HB      HIS 119  -1.962  13.206 -20.709
  891   2HB   HIS 119           1HB      HIS 119  -2.168  12.964 -18.976
  892    HD1  HIS 119           HD1      HIS 119   0.482  11.882 -21.505
  893    HD2  HIS 119           HD2      HIS 119   0.187  13.625 -17.735
  894    HE1  HIS 119           HE1      HIS 119   2.853  12.320 -20.734
  895    H    GLY 120             H      GLY 120  -3.003  11.338 -17.740
  896   1HA   GLY 120           2HA      GLY 120  -3.113   9.505 -16.081
  897   2HA   GLY 120           1HA      GLY 120  -1.576   8.906 -16.728
  898    H    GLY 121             H      GLY 121  -1.365  12.288 -16.547
  899   1HA   GLY 121           2HA      GLY 121   0.134  12.102 -13.958
  900   2HA   GLY 121           1HA      GLY 121   0.417  13.321 -15.199
  901    H    LEU 122             H      LEU 122  -2.541  13.697 -15.524
  902    HA   LEU 122            HA      LEU 122  -2.918  15.757 -13.511
  903   1HB   LEU 122           2HB      LEU 122  -5.135  14.869 -15.367
  904   2HB   LEU 122           1HB      LEU 122  -4.803  16.474 -14.740
  905    HG   LEU 122            HG      LEU 122  -4.129  16.759 -16.943
  906   1HD1  LEU 122          1HD1      LEU 122  -2.060  16.787 -15.222
  907   2HD1  LEU 122          3HD1      LEU 122  -1.487  15.531 -16.322
  908   3HD1  LEU 122          2HD1      LEU 122  -1.869  17.138 -16.938
  909   1HD2  LEU 122          1HD2      LEU 122  -4.349  14.007 -17.076
  910   2HD2  LEU 122          3HD2      LEU 122  -3.902  15.062 -18.417
  911   3HD2  LEU 122          2HD2      LEU 122  -2.647  14.276 -17.460
  912    H    ILE 123             H      ILE 123  -4.222  12.553 -14.268
  913    HA   ILE 123            HA      ILE 123  -6.251  12.522 -12.195
  914    HB   ILE 123            HB      ILE 123  -4.816  10.512 -13.883
  915   1HG1  ILE 123          2HG1      ILE 123  -7.793  10.903 -13.441
  916   2HG1  ILE 123          1HG1      ILE 123  -6.880  11.835 -14.623
  917   1HG2  ILE 123          2HG2      ILE 123  -5.932   9.819 -11.264
  918   2HG2  ILE 123          1HG2      ILE 123  -6.766   8.956 -12.546
  919   3HG2  ILE 123          3HG2      ILE 123  -5.017   8.804 -12.370
  920   1HD1  ILE 123          1HD1      ILE 123  -7.103   8.800 -14.556
  921   2HD1  ILE 123          3HD1      ILE 123  -7.960   9.863 -15.680
  922   3HD1  ILE 123          2HD1      ILE 123  -6.192   9.733 -15.750
  923    H    ASN 124             H      ASN 124  -2.830  11.688 -12.395
  924    HA   ASN 124            HA      ASN 124  -2.558  10.566  -9.799
  925   1HB   ASN 124           2HB      ASN 124  -0.835  10.468 -11.631
  926   2HB   ASN 124           1HB      ASN 124  -0.481  12.163 -11.288
  927   1HD2  ASN 124          2HD2      ASN 124   1.030  11.444  -8.098
  928   2HD2  ASN 124          1HD2      ASN 124   0.143  12.632  -8.923
  929    H    LYS 125             H      LYS 125  -2.757  13.817 -11.081
  930    HA   LYS 125            HA      LYS 125  -1.888  15.111  -8.475
  931   1HB   LYS 125           2HB      LYS 125  -2.904  16.130 -11.161
  932   2HB   LYS 125           1HB      LYS 125  -2.676  17.215  -9.781
  933   1HG   LYS 125           2HG      LYS 125  -0.504  15.379 -10.836
  934   2HG   LYS 125           1HG      LYS 125  -0.683  17.057 -11.337
  935   1HD   LYS 125           2HD      LYS 125  -0.761  17.323  -8.615
  936   2HD   LYS 125           1HD      LYS 125   0.337  15.953  -8.790
  937   1HE   LYS 125           2HE      LYS 125   1.756  17.231 -10.312
  938   2HE   LYS 125           1HE      LYS 125   0.630  18.588 -10.258
  939   1HZ   LYS 125           1HZ      LYS 125   1.751  17.538  -7.752
  940   2HZ   LYS 125           3HZ      LYS 125   2.699  18.559  -8.718
  941   3HZ   LYS 125           2HZ      LYS 125   1.208  19.106  -8.115
  942    H    LYS 126             H      LYS 126  -4.977  14.376 -10.090
  943    HA   LYS 126            HA      LYS 126  -6.567  16.007  -8.262
  944   1HB   LYS 126           2HB      LYS 126  -7.080  14.273 -10.632
  945   2HB   LYS 126           1HB      LYS 126  -8.399  14.517  -9.512
  946   1HG   LYS 126           2HG      LYS 126  -8.781  16.413 -10.708
  947   2HG   LYS 126           1HG      LYS 126  -7.478  17.069  -9.722
  948   1HD   LYS 126           2HD      LYS 126  -6.979  17.542 -12.039
  949   2HD   LYS 126           1HD      LYS 126  -5.859  16.312 -11.472
  950   1HE   LYS 126           2HE      LYS 126  -6.662  14.749 -12.920
  951   2HE   LYS 126           1HE      LYS 126  -8.336  15.181 -12.569
  952   1HZ   LYS 126           1HZ      LYS 126  -6.630  16.971 -14.166
  953   2HZ   LYS 126           3HZ      LYS 126  -7.411  15.656 -14.893
  954   3HZ   LYS 126           2HZ      LYS 126  -8.324  16.868 -14.125
  955    H    CYS 127             H      CYS 127  -5.391  12.758  -8.327
  956    HA   CYS 127            HA      CYS 127  -7.333  11.744  -6.388
  957   1HB   CYS 127           2HB      CYS 127  -5.994  10.407  -8.255
  958   2HB   CYS 127           1HB      CYS 127  -4.772  10.332  -7.005
  959    HG   CYS 127            HG      CYS 127  -7.673   9.334  -6.429
  960    OH   TYR 128            OH      TYR 128   1.307  16.201  -1.438
  961    H    TYR 128             H      TYR 128  -3.994  12.849  -6.624
  962    HA   TYR 128            HA      TYR 128  -3.200  12.366  -3.907
  963   1HB   TYR 128           2HB      TYR 128  -1.594  12.895  -5.683
  964   2HB   TYR 128           1HB      TYR 128  -2.377  14.440  -5.980
  965    HD1  TYR 128           HD1      TYR 128  -1.239  12.687  -2.851
  966    HD2  TYR 128           HD2      TYR 128  -1.028  16.153  -5.388
  967    HE1  TYR 128           HE1      TYR 128   0.276  13.767  -1.208
  968    HE2  TYR 128           HE2      TYR 128   0.480  17.260  -3.723
  969    HH   TYR 128            HH      TYR 128   2.214  16.020  -1.693
  970    H    GLU 129             H      GLU 129  -5.114  14.891  -5.517
  971    HA   GLU 129            HA      GLU 129  -5.201  16.658  -3.124
  972   1HB   GLU 129           2HB      GLU 129  -6.648  16.615  -5.784
  973   2HB   GLU 129           1HB      GLU 129  -7.104  17.742  -4.505
  974   1HG   GLU 129           2HG      GLU 129  -4.748  18.558  -4.429
  975   2HG   GLU 129           1HG      GLU 129  -4.358  17.487  -5.774
  976    H    MET 130             H      MET 130  -7.241  14.155  -4.597
  977    HA   MET 130            HA      MET 130  -9.614  14.454  -3.055
  978   1HB   MET 130           2HB      MET 130  -8.886  12.762  -5.007
  979   2HB   MET 130           1HB      MET 130  -8.601  11.702  -3.629
  980   1HG   MET 130           2HG      MET 130 -10.841  11.606  -3.074
  981   2HG   MET 130           1HG      MET 130 -11.169  13.216  -3.691
  982   1HE   MET 130           1HE      MET 130 -11.567   9.644  -4.071
  983   2HE   MET 130           3HE      MET 130 -12.987  10.697  -4.070
  984   3HE   MET 130           2HE      MET 130 -12.639   9.670  -5.455
  985    H    ALA 131             H      ALA 131  -6.702  12.512  -2.432
  986    HA   ALA 131            HA      ALA 131  -7.451  11.627   0.213
  987   1HB   ALA 131           1HB      ALA 131  -4.921  11.598  -1.451
  988   2HB   ALA 131           3HB      ALA 131  -4.826  11.272   0.291
  989   3HB   ALA 131           2HB      ALA 131  -5.821  10.244  -0.737
  990    H    SER 132             H      SER 132  -5.977  14.550  -1.096
  991    HA   SER 132            HA      SER 132  -4.675  15.481   1.283
  992   1HB   SER 132           2HB      SER 132  -6.101  17.109  -0.851
  993   2HB   SER 132           1HB      SER 132  -5.046  17.780   0.375
  994    HG   SER 132            HG      SER 132  -3.682  17.423  -1.252
  995    H    HIS 133             H      HIS 133  -8.100  15.355   0.308
  996    HA   HIS 133            HA      HIS 133  -8.959  16.881   2.697
  997   1HB   HIS 133           2HB      HIS 133 -10.324  16.701   0.535
  998   2HB   HIS 133           1HB      HIS 133 -10.836  15.093   1.120
  999    HD1  HIS 133           HD1      HIS 133 -12.722  15.097   2.750
 1000    HD2  HIS 133           HD2      HIS 133 -10.823  18.811   2.649
 1001    HE1  HIS 133           HE1      HIS 133 -14.015  16.608   4.326
 1002    H    LEU 134             H      LEU 134  -8.740  13.478   1.664
 1003    HA   LEU 134            HA      LEU 134  -9.940  12.430   4.077
 1004   1HB   LEU 134           2HB      LEU 134  -8.215  11.240   1.934
 1005   2HB   LEU 134           1HB      LEU 134  -8.780  10.303   3.301
 1006    HG   LEU 134            HG      LEU 134 -11.078  11.458   2.599
 1007   1HD1  LEU 134          1HD1      LEU 134  -9.380  11.481   0.172
 1008   2HD1  LEU 134          3HD1      LEU 134 -11.098  11.138   0.013
 1009   3HD1  LEU 134          2HD1      LEU 134 -10.559  12.663   0.715
 1010   1HD2  LEU 134          1HD2      LEU 134  -9.816   8.974   1.515
 1011   2HD2  LEU 134          3HD2      LEU 134 -10.941   9.105   2.860
 1012   3HD2  LEU 134          2HD2      LEU 134 -11.502   9.365   1.206
 1013    NH1  ARG 135           NH1      ARG 135  -2.839  12.640   7.283
 1014    NH2  ARG 135           NH2      ARG 135  -0.602  12.320   7.251
 1015    H    ARG 135             H      ARG 135  -7.020  13.942   3.601
 1016    HA   ARG 135            HA      ARG 135  -5.667  12.597   5.855
 1017   1HB   ARG 135           2HB      ARG 135  -4.855  14.580   3.736
 1018   2HB   ARG 135           1HB      ARG 135  -3.968  14.564   5.266
 1019   1HG   ARG 135           2HG      ARG 135  -4.118  11.872   4.671
 1020   2HG   ARG 135           1HG      ARG 135  -3.961  12.593   3.069
 1021   1HD   ARG 135           2HD      ARG 135  -1.753  12.815   3.439
 1022   2HD   ARG 135           1HD      ARG 135  -2.119  13.964   4.726
 1023    HE   ARG 135            HE      ARG 135  -1.545  11.077   5.099
 1024   1HH1  ARG 135          2HH1      ARG 135  -3.722  12.628   6.814
 1025   2HH1  ARG 135          1HH1      ARG 135  -2.788  12.908   8.246
 1026   1HH2  ARG 135          1HH2      ARG 135   0.229  12.069   6.757
 1027   2HH2  ARG 135          2HH2      ARG 135  -0.551  12.572   8.219
 1028    NH1  ARG 136           NH2      ARG 136  -3.298  19.275   6.858
 1029    NH2  ARG 136           NH1      ARG 136  -4.291  20.888   8.094
 1030    H    ARG 136             H      ARG 136  -7.154  15.623   4.775
 1031    HA   ARG 136            HA      ARG 136  -6.947  16.901   7.405
 1032   1HB   ARG 136           2HB      ARG 136  -8.685  17.667   5.050
 1033   2HB   ARG 136           1HB      ARG 136  -8.250  18.702   6.410
 1034   1HG   ARG 136           2HG      ARG 136  -5.884  17.585   5.105
 1035   2HG   ARG 136           1HG      ARG 136  -6.879  18.505   3.979
 1036   1HD   ARG 136           2HD      ARG 136  -5.342  20.055   4.986
 1037   2HD   ARG 136           1HD      ARG 136  -6.926  20.367   5.699
 1038    HE   ARG 136            HE      ARG 136  -6.079  18.864   7.624
 1039   1HH1  ARG 136          1HH2      ARG 136  -3.367  18.480   6.254
 1040   2HH1  ARG 136          2HH2      ARG 136  -2.398  19.627   7.119
 1041   1HH2  ARG 136          2HH1      ARG 136  -5.118  21.325   8.442
 1042   2HH2  ARG 136          1HH1      ARG 136  -3.392  21.249   8.344
 1043    H    SER 137             H      SER 137  -8.784  14.411   6.175
 1044    HA   SER 137            HA      SER 137 -11.339  15.035   7.418
 1045   1HB   SER 137           2HB      SER 137 -12.059  12.966   6.444
 1046   2HB   SER 137           1HB      SER 137 -10.950  13.622   5.271
 1047    HG   SER 137            HG      SER 137  -9.453  12.210   6.851
 1048    H    GLN 138             H      GLN 138  -8.282  13.572   8.303
 1049    HA   GLN 138            HA      GLN 138  -7.543  12.870  10.438
 1050   1HB   GLN 138           2HB      GLN 138  -9.932  14.199  11.107
 1051   2HB   GLN 138           1HB      GLN 138 -10.112  12.598  11.826
 1052   1HG   GLN 138           2HG      GLN 138  -8.455  12.953  13.350
 1053   2HG   GLN 138           1HG      GLN 138  -7.438  13.814  12.191
 1054   1HE2  GLN 138          2HE2      GLN 138 -10.435  16.120  13.824
 1055   2HE2  GLN 138          1HE2      GLN 138 -10.807  14.574  13.231
 1056    OH   TYR 139            OH      TYR 139 -14.877  11.536   9.477
 1057    H    TYR 139             H      TYR 139  -8.486  11.195   8.232
 1058    HA   TYR 139            HA      TYR 139  -9.182   8.698   9.736
 1059   1HB   TYR 139           2HB      TYR 139  -9.785   9.311   6.818
 1060   2HB   TYR 139           1HB      TYR 139 -10.262   7.862   7.702
 1061    HD1  TYR 139           HD2      TYR 139 -11.113   9.099  10.327
 1062    HD2  TYR 139           HD1      TYR 139 -11.879  10.300   6.266
 1063    HE1  TYR 139           HE2      TYR 139 -13.198  10.234  11.053
 1064    HE2  TYR 139           HE1      TYR 139 -13.965  11.432   6.996
 1065    HH   TYR 139            HH      TYR 139 -14.957  12.356   8.984
   
  Start of MODEL           9
 Raw file had 1065 H/Q atoms
  Start of MODEL    9
    1   1H    ALA   1            3H      ALA   1 -18.030  27.798
   58    H    ASN   9             H      ASN   9 -14.779  15.617  -7.594
   59    HA   ASN   9            HA      ASN   9 -13.143  17.125  -9.291
   60   1HB   ASN   9           2HB      ASN   9 -11.907  16.092  -7.652
   61   2HB   ASN   9           1HB      ASN   9 -13.003  14.863  -7.435
   62   1HD2  ASN   9          2HD2      ASN   9 -10.860  12.228  -8.959
   63   2HD2  ASN   9          1HD2      ASN   9 -11.922  12.650  -7.674
   64    H    LEU  10             H      LEU  10 -14.531  14.090  -9.563
   65    HA   LEU  10            HA      LEU  10 -13.265  13.316 -12.053
   66   1HB   LEU  10           2HB      LEU  10 -15.439  11.915 -10.557
   67   2HB   LEU  10           1HB      LEU  10 -14.249  11.213 -11.671
   68    HG   LEU  10            HG      LEU  10 -12.852  12.793  -9.883
   69   1HD1  LEU  10          3HD1      LEU  10 -15.047  11.437  -8.532
   70   2HD1  LEU  10          2HD1      LEU  10 -13.472  11.442  -7.748
   71   3HD1  LEU  10          1HD1      LEU  10 -14.239  12.941  -8.164
   72   1HD2  LEU  10          2HD2      LEU  10 -12.954   9.958 -10.421
   73   2HD2  LEU  10          1HD2      LEU  10 -11.735  11.139 -10.763
   74   3HD2  LEU  10          3HD2      LEU  10 -11.949  10.573  -9.106
   75    H    MET  11             H      MET  11 -16.090  14.893 -11.144
   76    HA   MET  11            HA      MET  11 -17.451  14.213 -13.691
   77   1HB   MET  11           2HB      MET  11 -18.302  15.992 -11.366
   78   2HB   MET  11           1HB      MET  11 -19.342  15.373 -12.652
   79   1HG   MET  11           2HG      MET  11 -17.778  13.269 -11.082
   80   2HG   MET  11           1HG      MET  11 -19.114  14.089 -10.239
   81   1HE   MET  11           1HE      MET  11 -17.728  12.062 -12.706
   82   2HE   MET  11           3HE      MET  11 -18.960  10.845 -13.089
   83   3HE   MET  11           2HE      MET  11 -18.767  12.265 -14.114
   84    H    ALA  12             H      ALA  12 -15.741  16.774 -12.044
   85    HA   ALA  12            HA      ALA  12 -16.030  18.903 -13.996
   86   1HB   ALA  12           1HB      ALA  12 -14.430  18.505 -11.419
   87   2HB   ALA  12           3HB      ALA  12 -14.288  19.975 -12.432
   88   3HB   ALA  12           2HB      ALA  12 -15.839  19.576 -11.701
   89    H    ASP  13             H      ASP  13 -13.701  16.548 -13.163
   90    HA   ASP  13            HA      ASP  13 -11.178  17.324 -14.103
   91   1HB   ASP  13           2HB      ASP  13 -10.832  14.830 -14.296
   92   2HB   ASP  13           1HB      ASP  13 -11.655  15.321 -12.846
   93    H    GLY  14             H      GLY  14 -13.757  16.575 -16.337
   94   1HA   GLY  14           2HA      GLY  14 -13.681  15.592 -18.525
   95   2HA   GLY  14           1HA      GLY  14 -12.584  16.923 -18.781
   96    H    THR  15             H      THR  15 -11.850  14.077 -16.753
   97    HA   THR  15            HA      THR  15 -10.142  12.768 -18.713
   98    HB   THR  15            HB      THR  15  -9.096  14.116 -16.249
   99    HG1  THR  15           HG1      THR  15  -8.923  15.444 -17.971
  100   1HG2  THR  15          3HG2      THR  15  -7.981  11.904 -17.970
  101   2HG2  THR  15          2HG2      THR  15  -6.951  12.940 -16.943
  102   3HG2  THR  15          1HG2      THR  15  -8.222  11.946 -16.220
  103    H    CYS  16             H      CYS  16 -11.052  12.994 -15.311
  104    HA   CYS  16            HA      CYS  16 -10.893  10.078 -15.180
  105   1HB   CYS  16           2HB      CYS  16 -11.746  10.624 -12.667
  106   2HB   CYS  16           1HB      CYS  16 -10.082  10.473 -13.138
  107    HG   CYS  16            HG      CYS  16  -9.836  12.972 -12.923
  108    H    GLN  17             H      GLN  17 -12.359   8.706 -15.546
  109    HA   GLN  17            HA      GLN  17 -15.041   9.588 -16.230
  110   1HB   GLN  17           2HB      GLN  17 -13.417   7.902 -17.348
  111   2HB   GLN  17           1HB      GLN  17 -14.215   6.757 -16.293
  112   1HG   GLN  17           2HG      GLN  17 -15.742   8.668 -18.063
  113   2HG   GLN  17           1HG      GLN  17 -15.248   7.063 -18.612
  114   1HE2  GLN  17          2HE2      GLN  17 -17.340   5.468 -16.019
  115   2HE2  GLN  17          1HE2      GLN  17 -15.727   5.390 -16.535
  116    H    ASP  18             H      ASP  18 -13.466   7.537 -13.902
  117    HA   ASP  18            HA      ASP  18 -15.935   7.469 -12.287
  118   1HB   ASP  18           2HB      ASP  18 -15.468   5.236 -13.470
  119   2HB   ASP  18           1HB      ASP  18 -14.158   5.064 -12.355
  120    H    ALA  19             H      ALA  19 -15.374   6.849  -9.975
  121    HA   ALA  19            HA      ALA  19 -12.685   7.837  -9.005
  122   1HB   ALA  19           3HB      ALA  19 -14.587   9.646  -9.503
  123   2HB   ALA  19           2HB      ALA  19 -15.148   9.091  -7.904
  124   3HB   ALA  19           1HB      ALA  19 -13.489   9.646  -8.116
  125    H    ALA  20             H      ALA  20 -12.350   6.532  -7.016
  126    HA   ALA  20            HA      ALA  20 -14.902   5.890  -5.584
  127   1HB   ALA  20           1HB      ALA  20 -12.962   3.823  -6.435
  128   2HB   ALA  20           3HB      ALA  20 -14.215   3.567  -5.215
  129   3HB   ALA  20           2HB      ALA  20 -14.652   3.997  -6.877
  130    H    ILE  21             H      ILE  21 -14.661   6.834  -3.771
  131    HA   ILE  21            HA      ILE  21 -12.197   6.539  -2.174
  132    HB   ILE  21            HB      ILE  21 -14.881   7.737  -1.403
  133   1HG1  ILE  21          2HG1      ILE  21 -12.382   8.951  -2.647
  134   2HG1  ILE  21          1HG1      ILE  21 -14.023   8.998  -3.280
  135   1HG2  ILE  21          2HG2      ILE  21 -12.328   7.243   0.007
  136   2HG2  ILE  21          1HG2      ILE  21 -12.850   8.918   0.127
  137   3HG2  ILE  21          3HG2      ILE  21 -13.914   7.624   0.672
  138   1HD1  ILE  21          3HD1      ILE  21 -14.483  10.198  -0.953
  139   2HD1  ILE  21          2HD1      ILE  21 -12.772  10.587  -1.110
  140   3HD1  ILE  21          1HD1      ILE  21 -13.909  11.104  -2.358
  141    H    VAL  22             H      VAL  22 -12.061   4.679  -0.823
  142    HA   VAL  22            HA      VAL  22 -14.633   3.201  -0.447
  143    HB   VAL  22            HB      VAL  22 -11.890   1.995  -1.023
  144   1HG1  VAL  22          1HG1      VAL  22 -13.739   0.705   0.303
  145   2HG1  VAL  22          3HG1      VAL  22 -14.538   0.585  -1.264
  146   3HG1  VAL  22          2HG1      VAL  22 -12.927  -0.109  -1.038
  147   1HG2  VAL  22          2HG2      VAL  22 -12.901   3.290  -2.956
  148   2HG2  VAL  22          1HG2      VAL  22 -12.685   1.560  -3.276
  149   3HG2  VAL  22          3HG2      VAL  22 -14.288   2.196  -2.880
  150    H    GLY  23             H      GLY  23 -15.016   3.242   1.829
  151   1HA   GLY  23           2HA      GLY  23 -12.917   3.426   3.831
  152   2HA   GLY  23           1HA      GLY  23 -14.594   2.959   4.151
  153    OH   TYR  24            OH      TYR  24  -5.529   1.021   5.318
  154    H    TYR  24             H      TYR  24 -11.472   1.766   3.210
  155    HA   TYR  24            HA      TYR  24 -12.229  -1.001   2.949
  156   1HB   TYR  24           2HB      TYR  24 -10.082  -1.311   2.027
  157   2HB   TYR  24           1HB      TYR  24 -10.416   0.353   1.646
  158    HD1  TYR  24           HD1      TYR  24  -9.915   1.678   4.322
  159    HD2  TYR  24           HD2      TYR  24  -7.815  -1.425   2.268
  160    HE1  TYR  24           HE1      TYR  24  -7.859   2.238   5.572
  161    HE2  TYR  24           HE2      TYR  24  -5.765  -0.869   3.480
  162    HH   TYR  24            HH      TYR  24  -5.328   0.276   5.892
  163    H    LYS  25             H      LYS  25 -12.616   0.124   5.692
  164    HA   LYS  25            HA      LYS  25 -10.581  -0.706   7.473
  165   1HB   LYS  25           2HB      LYS  25 -13.475  -0.178   7.742
  166   2HB   LYS  25           1HB      LYS  25 -12.557  -0.752   9.102
  167   1HG   LYS  25           2HG      LYS  25 -12.433   1.577   9.324
  168   2HG   LYS  25           1HG      LYS  25 -10.916   1.157   8.532
  169   1HD   LYS  25           2HD      LYS  25 -11.705   1.818   6.422
  170   2HD   LYS  25           1HD      LYS  25 -13.379   1.878   6.980
  171   1HE   LYS  25           2HE      LYS  25 -11.163   3.657   8.009
  172   2HE   LYS  25           1HE      LYS  25 -12.358   4.137   6.811
  173   1HZ   LYS  25           1HZ      LYS  25 -14.028   3.340   8.594
  174   2HZ   LYS  25           3HZ      LYS  25 -12.731   3.546   9.665
  175   3HZ   LYS  25           2HZ      LYS  25 -13.300   4.863   8.765
  176    H    ASP  26             H      ASP  26 -12.062  -2.457   9.206
  177    HA   ASP  26            HA      ASP  26 -11.326  -5.058   8.530
  178   1HB   ASP  26           2HB      ASP  26 -13.540  -5.751   9.758
  179   2HB   ASP  26           1HB      ASP  26 -12.218  -5.054  10.659
  180    H    SER  27             H      SER  27 -14.523  -3.710   7.944
  181    HA   SER  27            HA      SER  27 -14.925  -5.550   5.683
  182   1HB   SER  27           2HB      SER  27 -17.316  -4.724   6.002
  183   2HB   SER  27           1HB      SER  27 -16.717  -5.809   7.223
  184    HG   SER  27            HG      SER  27 -17.054  -4.267   8.595
  185    HA   PRO  28            HA      PRO  28 -14.124  -1.726   3.595
  186   1HB   PRO  28           2HB      PRO  28 -14.075  -2.720   1.049
  187   2HB   PRO  28           1HB      PRO  28 -12.716  -2.811   2.181
  188   1HG   PRO  28           2HG      PRO  28 -14.516  -4.962   1.301
  189   2HG   PRO  28           1HG      PRO  28 -12.934  -5.060   2.036
  190   1HD   PRO  28           2HD      PRO  28 -15.439  -5.488   3.283
  191   2HD   PRO  28           1HD      PRO  28 -13.828  -5.499   4.039
  192    H    SER  29             H      SER  29 -15.184  -0.325   2.033
  193    HA   SER  29            HA      SER  29 -17.700  -1.000   0.898
  194   1HB   SER  29           2HB      SER  29 -18.969   0.708   2.268
  195   2HB   SER  29           1HB      SER  29 -18.590  -0.796   3.099
  196    HG   SER  29            HG      SER  29 -17.597   0.420   4.492
  197    H    VAL  30             H      VAL  30 -18.658   0.899  -0.139
  198    HA   VAL  30            HA      VAL  30 -16.547   2.585  -1.199
  199    HB   VAL  30            HB      VAL  30 -19.393   1.995  -1.968
  200   1HG1  VAL  30          1HG1      VAL  30 -18.769   4.341  -2.592
  201   2HG1  VAL  30          3HG1      VAL  30 -17.354   3.698  -3.426
  202   3HG1  VAL  30          2HG1      VAL  30 -18.966   3.294  -4.010
  203   1HG2  VAL  30          1HG2      VAL  30 -16.971   0.614  -2.284
  204   2HG2  VAL  30          3HG2      VAL  30 -18.459   0.332  -3.178
  205   3HG2  VAL  30          2HG2      VAL  30 -17.232   1.400  -3.834
  206    CH2  TRP  31           CH2      TRP  31 -13.622   6.238   6.573
  207    H    TRP  31             H      TRP  31 -16.160   4.254   0.173
  208    HA   TRP  31            HA      TRP  31 -18.121   5.578   1.782
  209   1HB   TRP  31           2HB      TRP  31 -15.237   5.978   1.102
  210   2HB   TRP  31           1HB      TRP  31 -16.110   7.345   1.798
  211    HD1  TRP  31           HD1      TRP  31 -17.490   4.103   2.983
  212    HE1  TRP  31           HE1      TRP  31 -16.745   3.648   5.359
  213    HE3  TRP  31           HE3      TRP  31 -13.791   7.601   3.468
  214    HZ2  TRP  31           HZ2      TRP  31 -14.855   4.618   7.283
  215    HZ3  TRP  31           HZ3      TRP  31 -12.558   7.824   5.592
  216    HH2  TRP  31           HH2      TRP  31 -13.070   6.333   7.493
  217    H    ALA  32             H      ALA  32 -16.888   6.064  -1.432
  218    HA   ALA  32            HA      ALA  32 -19.093   7.648  -2.248
  219   1HB   ALA  32           2HB      ALA  32 -16.611   9.267  -1.583
  220   2HB   ALA  32           1HB      ALA  32 -17.969   9.884  -2.558
  221   3HB   ALA  32           3HB      ALA  32 -18.213   9.431  -0.860
  222    H    ALA  33             H      ALA  33 -18.811   6.090  -3.928
  223    HA   ALA  33            HA      ALA  33 -16.752   6.883  -5.909
  224   1HB   ALA  33           3HB      ALA  33 -16.357   4.562  -5.011
  225   2HB   ALA  33           2HB      ALA  33 -17.953   4.110  -5.622
  226   3HB   ALA  33           1HB      ALA  33 -16.684   4.595  -6.746
  227    H    VAL  34             H      VAL  34 -17.561   7.468  -7.859
  228    HA   VAL  34            HA      VAL  34 -20.243   8.144  -8.303
  229    HB   VAL  34            HB      VAL  34 -18.303   7.194 -10.428
  230   1HG1  VAL  34          3HG1      VAL  34 -20.794   7.566 -10.988
  231   2HG1  VAL  34          2HG1      VAL  34 -20.457   9.276 -10.706
  232   3HG1  VAL  34          1HG1      VAL  34 -19.600   8.407 -11.978
  233   1HG2  VAL  34          2HG2      VAL  34 -18.579   9.757  -8.884
  234   2HG2  VAL  34          1HG2      VAL  34 -17.113   8.887  -9.338
  235   3HG2  VAL  34          3HG2      VAL  34 -18.004   9.806 -10.551
  236    HA   PRO  35            HA      PRO  35 -21.770   3.869  -8.260
  237   1HB   PRO  35           2HB      PRO  35 -24.448   4.504  -8.121
  238   2HB   PRO  35           1HB      PRO  35 -23.368   4.425  -6.720
  239   1HG   PRO  35           2HG      PRO  35 -24.408   6.846  -8.161
  240   2HG   PRO  35           1HG      PRO  35 -23.988   6.652  -6.448
  241   1HD   PRO  35           2HD      PRO  35 -22.359   7.917  -8.335
  242   2HD   PRO  35           1HD      PRO  35 -21.784   7.235  -6.798
  243    H    GLY  36             H      GLY  36 -22.744   2.490  -9.772
  244   1HA   GLY  36           2HA      GLY  36 -24.011   2.001 -11.778
  245   2HA   GLY  36           1HA      GLY  36 -23.851   3.691 -12.256
  246    H    LYS  37             H      LYS  37 -20.834   3.339 -11.346
  247    HA   LYS  37            HA      LYS  37 -19.907   2.583 -14.036
  248   1HB   LYS  37           2HB      LYS  37 -18.364   3.704 -11.669
  249   2HB   LYS  37           1HB      LYS  37 -17.752   3.540 -13.315
  250   1HG   LYS  37           2HG      LYS  37 -20.103   5.268 -12.436
  251   2HG   LYS  37           1HG      LYS  37 -18.530   5.851 -12.973
  252   1HD   LYS  37           2HD      LYS  37 -19.047   4.471 -15.139
  253   2HD   LYS  37           1HD      LYS  37 -20.718   4.580 -14.586
  254   1HE   LYS  37           2HE      LYS  37 -18.889   6.972 -14.938
  255   2HE   LYS  37           1HE      LYS  37 -20.055   6.433 -16.146
  256   1HZ   LYS  37           2HZ      LYS  37 -21.746   6.589 -14.286
  257   2HZ   LYS  37           1HZ      LYS  37 -20.577   7.479 -13.438
  258   3HZ   LYS  37           3HZ      LYS  37 -21.165   8.053 -14.918
  259    H    THR  38             H      THR  38 -17.350   1.884 -11.823
  260    HA   THR  38            HA      THR  38 -18.033  -1.006 -11.747
  261    HB   THR  38            HB      THR  38 -15.842   0.300 -13.219
  262    HG1  THR  38           HG1      THR  38 -16.854  -0.770 -14.657
  263   1HG2  THR  38          3HG2      THR  38 -14.534  -0.961 -11.480
  264   2HG2  THR  38          2HG2      THR  38 -15.366  -2.437 -11.975
  265   3HG2  THR  38          1HG2      THR  38 -14.296  -1.607 -13.104
  266    H    PHE  39             H      PHE  39 -15.794   1.497 -10.567
  267    HA   PHE  39            HA      PHE  39 -14.475  -0.005  -8.555
  268   1HB   PHE  39           2HB      PHE  39 -15.217   2.903  -8.597
  269   2HB   PHE  39           1HB      PHE  39 -14.149   2.155  -7.430
  270    HD1  PHE  39           HD2      PHE  39 -13.774   0.648 -10.688
  271    HD2  PHE  39           HD1      PHE  39 -12.566   4.013  -8.322
  272    HE1  PHE  39           HE2      PHE  39 -11.859   1.017 -12.181
  273    HE2  PHE  39           HE1      PHE  39 -10.632   4.353  -9.821
  274    HZ   PHE  39            HZ      PHE  39 -10.301   2.839 -11.740
  275    H    VAL  40             H      VAL  40 -17.434   1.882  -8.315
  276    HA   VAL  40            HA      VAL  40 -17.925   1.813  -5.577
  277    HB   VAL  40            HB      VAL  40 -19.319   3.250  -6.857
  278   1HG1  VAL  40          2HG1      VAL  40 -19.775   0.786  -8.486
  279   2HG1  VAL  40          1HG1      VAL  40 -20.913   2.127  -8.558
  280   3HG1  VAL  40          3HG1      VAL  40 -19.223   2.389  -8.994
  281   1HG2  VAL  40          1HG2      VAL  40 -20.446   1.516  -5.063
  282   2HG2  VAL  40          3HG2      VAL  40 -21.335   2.831  -5.836
  283   3HG2  VAL  40          2HG2      VAL  40 -21.435   1.194  -6.487
  284    H    ASN  41             H      ASN  41 -18.075  -0.795  -7.865
  285    HA   ASN  41            HA      ASN  41 -19.696  -2.480  -6.125
  286   1HB   ASN  41           2HB      ASN  41 -18.324  -2.849  -8.784
  287   2HB   ASN  41           1HB      ASN  41 -19.032  -4.179  -7.907
  288   1HD2  ASN  41          2HD2      ASN  41 -21.507  -2.311 -10.233
  289   2HD2  ASN  41          1HD2      ASN  41 -19.860  -2.631 -10.490
  290    H    ILE  42             H      ILE  42 -17.016  -1.291  -5.230
  291    HA   ILE  42            HA      ILE  42 -15.149  -3.466  -5.278
  292    HB   ILE  42            HB      ILE  42 -15.182  -0.643  -4.271
  293   1HG1  ILE  42          2HG1      ILE  42 -12.866  -2.105  -5.504
  294   2HG1  ILE  42          1HG1      ILE  42 -14.267  -1.718  -6.501
  295   1HG2  ILE  42          3HG2      ILE  42 -13.447  -2.808  -3.058
  296   2HG2  ILE  42          2HG2      ILE  42 -12.853  -1.157  -3.197
  297   3HG2  ILE  42          1HG2      ILE  42 -14.298  -1.495  -2.254
  298   1HD1  ILE  42          2HD1      ILE  42 -13.966   0.686  -5.418
  299   2HD1  ILE  42          1HD1      ILE  42 -12.308   0.130  -5.182
  300   3HD1  ILE  42          3HD1      ILE  42 -12.991   0.202  -6.812
  301    H    THR  43             H      THR  43 -14.987  -5.017  -3.908
  302    HA   THR  43            HA      THR  43 -16.357  -5.163  -1.261
  303    HB   THR  43            HB      THR  43 -16.012  -7.726  -1.892
  304    HG1  THR  43           HG1      THR  43 -15.462  -8.164  -3.845
  305   1HG2  THR  43          3HG2      THR  43 -18.002  -5.821  -3.020
  306   2HG2  THR  43          2HG2      THR  43 -18.079  -7.536  -3.447
  307   3HG2  THR  43          1HG2      THR  43 -18.226  -7.038  -1.762
  308    HA   PRO  44            HA      PRO  44 -12.301  -6.057   0.525
  309   1HB   PRO  44           2HB      PRO  44 -12.476  -8.426   1.785
  310   2HB   PRO  44           1HB      PRO  44 -13.082  -6.933   2.456
  311   1HG   PRO  44           2HG      PRO  44 -14.602  -9.188   1.218
  312   2HG   PRO  44           1HG      PRO  44 -15.121  -8.042   2.469
  313   1HD   PRO  44           2HD      PRO  44 -15.875  -7.884  -0.182
  314   2HD   PRO  44           1HD      PRO  44 -15.904  -6.517   0.921
  315    H    ALA  45             H      ALA  45 -13.374  -7.926  -1.920
  316    HA   ALA  45            HA      ALA  45 -11.148  -9.761  -2.182
  317   1HB   ALA  45           2HB      ALA  45 -13.691  -9.857  -3.071
  318   2HB   ALA  45           1HB      ALA  45 -12.896  -9.171  -4.487
  319   3HB   ALA  45           3HB      ALA  45 -12.375 -10.730  -3.856
  320    H    GLU  46             H      GLU  46 -12.483  -7.268  -4.204
  321    HA   GLU  46            HA      GLU  46 -10.115  -6.793  -5.748
  322   1HB   GLU  46           2HB      GLU  46 -11.310  -4.417  -6.074
  323   2HB   GLU  46           1HB      GLU  46 -11.872  -5.843  -6.918
  324   1HG   GLU  46           2HG      GLU  46 -13.009  -5.419  -4.232
  325   2HG   GLU  46           1HG      GLU  46 -13.404  -4.189  -5.419
  326    H    VAL  47             H      VAL  47 -11.308  -5.480  -2.760
  327    HA   VAL  47            HA      VAL  47  -9.147  -3.591  -2.491
  328    HB   VAL  47            HB      VAL  47 -11.646  -4.092  -1.108
  329   1HG1  VAL  47          1HG1      VAL  47 -10.038  -4.529   0.718
  330   2HG1  VAL  47          3HG1      VAL  47  -9.346  -2.951   0.365
  331   3HG1  VAL  47          2HG1      VAL  47 -11.002  -3.061   0.942
  332   1HG2  VAL  47          3HG2      VAL  47 -10.805  -2.103  -2.553
  333   2HG2  VAL  47          2HG2      VAL  47 -11.744  -1.747  -1.100
  334   3HG2  VAL  47          1HG2      VAL  47  -9.958  -1.612  -1.057
  335    H    GLY  48             H      GLY  48  -9.754  -6.873  -1.718
  336   1HA   GLY  48           2HA      GLY  48  -7.890  -7.274   0.389
  337   2HA   GLY  48           1HA      GLY  48  -8.399  -8.503  -0.761
  338    H    VAL  49             H      VAL  49  -7.526  -6.853  -3.043
  339    HA   VAL  49            HA      VAL  49  -4.645  -7.499  -2.925
  340    HB   VAL  49            HB      VAL  49  -5.911  -8.466  -4.811
  341   1HG1  VAL  49          2HG1      VAL  49  -6.331  -5.559  -5.532
  342   2HG1  VAL  49          1HG1      VAL  49  -6.632  -6.907  -6.617
  343   3HG1  VAL  49          3HG1      VAL  49  -7.576  -6.745  -5.141
  344   1HG2  VAL  49          3HG2      VAL  49  -3.781  -6.404  -5.427
  345   2HG2  VAL  49          2HG2      VAL  49  -3.584  -8.145  -5.231
  346   3HG2  VAL  49          1HG2      VAL  49  -4.410  -7.508  -6.650
  347    H    LEU  50             H      LEU  50  -6.779  -4.815  -3.542
  348    HA   LEU  50            HA      LEU  50  -4.832  -2.843  -4.226
  349   1HB   LEU  50           2HB      LEU  50  -7.603  -2.938  -3.347
  350   2HB   LEU  50           1HB      LEU  50  -6.809  -1.452  -3.092
  351    HG   LEU  50            HG      LEU  50  -6.645  -2.680  -5.786
  352   1HD1  LEU  50          3HD1      LEU  50  -9.092  -1.313  -4.557
  353   2HD1  LEU  50          2HD1      LEU  50  -8.852  -1.503  -6.306
  354   3HD1  LEU  50          1HD1      LEU  50  -9.029  -2.928  -5.285
  355   1HD2  LEU  50          3HD2      LEU  50  -5.525  -0.511  -5.097
  356   2HD2  LEU  50          2HD2      LEU  50  -6.649  -0.332  -6.444
  357   3HD2  LEU  50          1HD2      LEU  50  -7.137   0.164  -4.815
  358    H    VAL  51             H      VAL  51  -5.620  -4.389  -1.295
  359    HA   VAL  51            HA      VAL  51  -3.959  -2.497   0.268
  360    HB   VAL  51            HB      VAL  51  -5.733  -1.890   1.746
  361   1HG1  VAL  51          3HG1      VAL  51  -7.119  -2.463  -0.873
  362   2HG1  VAL  51          2HG1      VAL  51  -7.845  -1.546   0.421
  363   3HG1  VAL  51          1HG1      VAL  51  -6.391  -0.946  -0.359
  364   1HG2  VAL  51          2HG2      VAL  51  -6.737  -4.634   1.205
  365   2HG2  VAL  51          1HG2      VAL  51  -6.718  -3.728   2.715
  366   3HG2  VAL  51          3HG2      VAL  51  -7.980  -3.421   1.520
  367    H    GLY  52             H      GLY  52  -4.678  -5.737  -0.424
  368   1HA   GLY  52           2HA      GLY  52  -4.481  -7.108   1.984
  369   2HA   GLY  52           1HA      GLY  52  -3.911  -7.735   0.444
  370    H    LYS  53             H      LYS  53  -2.735  -8.020   3.010
  371    HA   LYS  53            HA      LYS  53  -0.481  -6.426   3.461
  372   1HB   LYS  53           2HB      LYS  53   0.422  -8.339   4.758
  373   2HB   LYS  53           1HB      LYS  53  -1.270  -8.024   5.142
  374   1HG   LYS  53           2HG      LYS  53  -1.494 -10.263   4.764
  375   2HG   LYS  53           1HG      LYS  53  -1.571  -9.758   3.074
  376   1HD   LYS  53           2HD      LYS  53   0.469 -10.650   2.583
  377   2HD   LYS  53           1HD      LYS  53   1.182 -10.072   4.092
  378   1HE   LYS  53           2HE      LYS  53   1.057 -12.585   3.931
  379   2HE   LYS  53           1HE      LYS  53   0.224 -11.918   5.334
  380   1HZ   LYS  53           2HZ      LYS  53  -1.237 -12.355   2.812
  381   2HZ   LYS  53           1HZ      LYS  53  -0.969 -13.653   3.876
  382   3HZ   LYS  53           3HZ      LYS  53  -1.837 -12.294   4.401
  383    H    ASP  54             H      ASP  54  -1.068  -8.675   0.967
  384    HA   ASP  54            HA      ASP  54   1.359  -9.712   0.275
  385   1HB   ASP  54           2HB      ASP  54  -0.926 -10.107  -0.801
  386   2HB   ASP  54           1HB      ASP  54  -0.585  -8.683  -1.767
  387    NH1  ARG  55           NH2      ARG  55   8.531  -4.087   1.708
  388    NH2  ARG  55           NH1      ARG  55   7.512  -4.299   3.716
  389    H    ARG  55             H      ARG  55   3.119  -8.845  -0.581
  390    HA   ARG  55            HA      ARG  55   3.152  -6.079  -1.450
  391   1HB   ARG  55           2HB      ARG  55   3.974  -6.634   0.990
  392   2HB   ARG  55           1HB      ARG  55   5.437  -7.149   0.147
  393   1HG   ARG  55           2HG      ARG  55   5.874  -5.000  -0.681
  394   2HG   ARG  55           1HG      ARG  55   4.208  -4.470  -0.453
  395   1HD   ARG  55           2HD      ARG  55   5.581  -3.449   1.273
  396   2HD   ARG  55           1HD      ARG  55   4.543  -4.659   2.024
  397    HE   ARG  55            HE      ARG  55   6.641  -6.186   1.798
  398   1HH1  ARG  55          1HH2      ARG  55   8.554  -4.268   0.725
  399   2HH1  ARG  55          2HH2      ARG  55   9.268  -3.563   2.137
  400   1HH2  ARG  55          2HH1      ARG  55   6.752  -4.640   4.270
  401   2HH2  ARG  55          1HH1      ARG  55   8.251  -3.779   4.145
  402    H    SER  56             H      SER  56   3.130  -8.211  -3.310
  403    HA   SER  56            HA      SER  56   5.509  -7.627  -4.816
  404   1HB   SER  56           2HB      SER  56   6.264  -9.297  -3.043
  405   2HB   SER  56           1HB      SER  56   5.397 -10.482  -4.007
  406    HG   SER  56            HG      SER  56   7.808  -9.769  -4.400
  407    H    SER  57             H      SER  57   3.193 -10.228  -4.492
  408    HA   SER  57            HA      SER  57   3.106 -11.052  -7.154
  409   1HB   SER  57           2HB      SER  57   0.745 -11.832  -6.634
  410   2HB   SER  57           1HB      SER  57   2.048 -12.474  -5.646
  411    HG   SER  57            HG      SER  57   0.115 -11.598  -4.545
  412    H    PHE  58             H      PHE  58   0.107  -9.586  -6.171
  413    HA   PHE  58            HA      PHE  58  -0.836  -8.753  -8.549
  414   1HB   PHE  58           2HB      PHE  58  -2.228  -7.101  -7.509
  415   2HB   PHE  58           1HB      PHE  58  -2.101  -8.510  -6.488
  416    HD1  PHE  58           HD2      PHE  58  -0.912  -5.073  -6.995
  417    HD2  PHE  58           HD1      PHE  58  -1.178  -8.382  -4.290
  418    HE1  PHE  58           HE2      PHE  58  -0.203  -3.611  -5.146
  419    HE2  PHE  58           HE1      PHE  58  -0.458  -6.903  -2.428
  420    HZ   PHE  58            HZ      PHE  58   0.033  -4.524  -2.855
  421    OH   TYR  59            OH      TYR  59   2.869  -3.458  -2.520
  422    H    TYR  59             H      TYR  59   1.957  -7.079  -7.178
  423    HA   TYR  59            HA      TYR  59   1.601  -4.673  -8.589
  424   1HB   TYR  59           2HB      TYR  59   4.231  -5.939  -7.954
  425   2HB   TYR  59           1HB      TYR  59   3.987  -4.264  -8.431
  426    HD1  TYR  59           HD1      TYR  59   1.771  -3.350  -6.948
  427    HD2  TYR  59           HD2      TYR  59   4.892  -5.995  -5.717
  428    HE1  TYR  59           HE1      TYR  59   1.474  -2.599  -4.591
  429    HE2  TYR  59           HE2      TYR  59   4.607  -5.226  -3.379
  430    HH   TYR  59            HH      TYR  59   3.510  -2.764  -2.344
  431    H    VAL  60             H      VAL  60   2.008  -7.608  -9.984
  432    HA   VAL  60            HA      VAL  60   3.050  -6.401 -12.446
  433    HB   VAL  60            HB      VAL  60   3.675  -8.872 -12.892
  434   1HG1  VAL  60          3HG1      VAL  60   5.044  -6.965 -11.020
  435   2HG1  VAL  60          2HG1      VAL  60   5.829  -8.454 -11.566
  436   3HG1  VAL  60          1HG1      VAL  60   5.363  -7.221 -12.740
  437   1HG2  VAL  60          2HG2      VAL  60   2.475  -9.653 -10.764
  438   2HG2  VAL  60          1HG2      VAL  60   4.118 -10.255 -10.994
  439   3HG2  VAL  60          3HG2      VAL  60   3.816  -8.919  -9.880
  440    H    ASN  61             H      ASN  61   0.615  -8.656 -11.097
  441    HA   ASN  61            HA      ASN  61  -0.392  -9.194 -13.761
  442   1HB   ASN  61           2HB      ASN  61  -1.980 -10.620 -12.670
  443   2HB   ASN  61           1HB      ASN  61  -0.407 -10.942 -12.021
  444   1HD2  ASN  61          2HD2      ASN  61  -1.603 -10.518  -8.797
  445   2HD2  ASN  61          1HD2      ASN  61  -0.588 -11.339  -9.873
  446    H    GLY  62             H      GLY  62  -1.131  -7.113 -11.080
  447   1HA   GLY  62           2HA      GLY  62  -2.150  -4.967 -11.563
  448   2HA   GLY  62           1HA      GLY  62  -3.217  -5.789 -12.711
  449    H    LEU  63             H      LEU  63  -3.809  -4.107 -10.241
  450    HA   LEU  63            HA      LEU  63  -4.888  -5.849  -8.180
  451   1HB   LEU  63           2HB      LEU  63  -5.888  -3.030  -8.680
  452   2HB   LEU  63           1HB      LEU  63  -5.839  -3.892  -7.143
  453    HG   LEU  63            HG      LEU  63  -3.426  -2.941  -8.704
  454   1HD1  LEU  63          2HD1      LEU  63  -5.184  -1.346  -7.456
  455   2HD1  LEU  63          1HD1      LEU  63  -4.277  -1.888  -6.038
  456   3HD1  LEU  63          3HD1      LEU  63  -3.452  -1.066  -7.359
  457   1HD2  LEU  63          3HD2      LEU  63  -3.849  -4.266  -6.018
  458   2HD2  LEU  63          2HD2      LEU  63  -2.917  -4.889  -7.383
  459   3HD2  LEU  63          1HD2      LEU  63  -2.339  -3.483  -6.490
  460    H    THR  64             H      THR  64  -7.532  -4.517  -7.974
  461    HA   THR  64            HA      THR  64  -8.981  -5.077 -10.398
  462    HB   THR  64            HB      THR  64 -10.422  -6.835  -9.322
  463    HG1  THR  64           HG1      THR  64  -8.337  -6.732  -7.434
  464   1HG2  THR  64          3HG2      THR  64  -8.556  -7.308 -10.924
  465   2HG2  THR  64          2HG2      THR  64  -7.541  -7.685  -9.524
  466   3HG2  THR  64          1HG2      THR  64  -8.985  -8.651  -9.865
  467    H    LEU  65             H      LEU  65 -10.660  -3.812 -10.292
  468    HA   LEU  65            HA      LEU  65 -11.669  -2.909  -7.670
  469   1HB   LEU  65           2HB      LEU  65 -11.986  -0.628  -8.952
  470   2HB   LEU  65           1HB      LEU  65 -10.533  -0.998  -8.072
  471    HG   LEU  65            HG      LEU  65  -9.542  -1.869 -10.242
  472   1HD1  LEU  65          1HD1      LEU  65 -12.166  -0.822 -11.191
  473   2HD1  LEU  65          3HD1      LEU  65 -10.759  -0.639 -12.235
  474   3HD1  LEU  65          2HD1      LEU  65 -11.264  -2.237 -11.710
  475   1HD2  LEU  65          2HD2      LEU  65 -10.116   0.933  -9.465
  476   2HD2  LEU  65          1HD2      LEU  65  -8.576   0.161  -9.879
  477   3HD2  LEU  65          3HD2      LEU  65  -9.647   0.723 -11.163
  478    H    GLY  66             H      GLY  66 -13.522  -3.930  -7.666
  479   1HA   GLY  66           2HA      GLY  66 -15.805  -4.249  -8.120
  480   2HA   GLY  66           1HA      GLY  66 -15.647  -3.122  -9.468
  481    H    GLY  67             H      GLY  67 -13.448  -5.812  -9.067
  482   1HA   GLY  67           2HA      GLY  67 -13.272  -7.862 -10.214
  483   2HA   GLY  67           1HA      GLY  67 -14.832  -7.534 -10.979
  484    H    GLN  68             H      GLN  68 -12.713  -4.792 -11.201
  485    HA   GLN  68            HA      GLN  68 -12.087  -5.580 -14.029
  486   1HB   GLN  68           2HB      GLN  68 -13.442  -3.699 -14.149
  487   2HB   GLN  68           1HB      GLN  68 -12.654  -3.001 -12.794
  488   1HG   GLN  68           2HG      GLN  68 -12.100  -1.921 -15.054
  489   2HG   GLN  68           1HG      GLN  68 -10.720  -2.342 -14.044
  490   1HE2  GLN  68          2HE2      GLN  68  -9.363  -4.179 -16.750
  491   2HE2  GLN  68          1HE2      GLN  68  -9.124  -2.989 -15.557
  492    H    LYS  69             H      LYS  69 -10.151  -6.503 -13.930
  493    HA   LYS  69            HA      LYS  69  -7.990  -5.974 -12.261
  494   1HB   LYS  69           2HB      LYS  69  -8.548  -7.814 -14.128
  495   2HB   LYS  69           1HB      LYS  69  -7.435  -6.807 -15.055
  496   1HG   LYS  69           2HG      LYS  69  -5.645  -7.455 -13.835
  497   2HG   LYS  69           1HG      LYS  69  -6.532  -7.351 -12.318
  498   1HD   LYS  69           2HD      LYS  69  -7.656  -9.487 -12.831
  499   2HD   LYS  69           1HD      LYS  69  -6.715  -9.608 -14.318
  500   1HE   LYS  69           2HE      LYS  69  -4.650  -9.794 -13.120
  501   2HE   LYS  69           1HE      LYS  69  -5.412  -9.314 -11.604
  502   1HZ   LYS  69           1HZ      LYS  69  -6.855 -11.378 -11.965
  503   2HZ   LYS  69           3HZ      LYS  69  -5.662 -11.866 -13.068
  504   3HZ   LYS  69           2HZ      LYS  69  -5.254 -11.605 -11.438
  505    H    CYS  70             H      CYS  70  -6.881  -4.093 -12.040
  506    HA   CYS  70            HA      CYS  70  -6.206  -2.526 -14.523
  507   1HB   CYS  70           2HB      CYS  70  -5.791  -0.668 -12.859
  508   2HB   CYS  70           1HB      CYS  70  -7.465  -1.128 -13.032
  509    HG   CYS  70            HG      CYS  70  -5.740  -2.040 -10.598
  510    H    SER  71             H      SER  71  -3.943  -1.804 -14.371
  511    HA   SER  71            HA      SER  71  -2.221  -3.784 -13.028
  512   1HB   SER  71           2HB      SER  71  -0.707  -3.563 -14.839
  513   2HB   SER  71           1HB      SER  71  -2.339  -3.817 -15.449
  514    HG   SER  71            HG      SER  71  -2.426  -1.423 -15.562
  515    H    VAL  72             H      VAL  72  -1.199  -3.028 -11.352
  516    HA   VAL  72            HA      VAL  72  -0.662  -0.458 -10.572
  517    HB   VAL  72            HB      VAL  72   1.270  -2.640 -10.087
  518   1HG1  VAL  72          2HG1      VAL  72   1.664  -0.217  -9.347
  519   2HG1  VAL  72          1HG1      VAL  72   0.353  -0.496  -8.199
  520   3HG1  VAL  72          3HG1      VAL  72   1.819  -1.473  -8.124
  521   1HG2  VAL  72          2HG2      VAL  72  -1.496  -2.279  -9.132
  522   2HG2  VAL  72          1HG2      VAL  72  -0.599  -3.766  -9.412
  523   3HG2  VAL  72          3HG2      VAL  72  -0.302  -2.820  -7.955
  524    H    ILE  73             H      ILE  73   0.442   1.076 -11.576
  525    HA   ILE  73            HA      ILE  73   2.867   0.512 -12.913
  526    HB   ILE  73            HB      ILE  73   0.677   2.350 -13.655
  527   1HG1  ILE  73          2HG1      ILE  73   2.032   0.752 -15.724
  528   2HG1  ILE  73          1HG1      ILE  73   1.301  -0.229 -14.455
  529   1HG2  ILE  73          3HG2      ILE  73   3.426   2.981 -13.910
  530   2HG2  ILE  73          2HG2      ILE  73   2.847   2.556 -15.518
  531   3HG2  ILE  73          1HG2      ILE  73   2.063   3.853 -14.615
  532   1HD1  ILE  73          1HD1      ILE  73  -0.868   1.067 -14.851
  533   2HD1  ILE  73          3HD1      ILE  73  -0.099   1.779 -16.269
  534   3HD1  ILE  73          2HD1      ILE  73  -0.386   0.023 -16.211
  535    NH1  ARG  74           NH2      ARG  74   5.919   6.069 -13.374
  536    NH2  ARG  74           NH1      ARG  74   7.809   4.974 -13.943
  537    H    ARG  74             H      ARG  74   3.611   0.818 -10.799
  538    HA   ARG  74            HA      ARG  74   5.251   1.953  -9.484
  539   1HB   ARG  74           2HB      ARG  74   4.544   4.081 -11.106
  540   2HB   ARG  74           1HB      ARG  74   3.974   4.618  -9.520
  541   1HG   ARG  74           2HG      ARG  74   6.094   4.787  -8.681
  542   2HG   ARG  74           1HG      ARG  74   6.660   3.362  -9.552
  543   1HD   ARG  74           2HD      ARG  74   6.178   6.094 -10.778
  544   2HD   ARG  74           1HD      ARG  74   7.754   5.404 -10.396
  545    HE   ARG  74            HE      ARG  74   6.710   3.499 -12.043
  546   1HH1  ARG  74          1HH2      ARG  74   5.169   6.225 -12.732
  547   2HH1  ARG  74          2HH2      ARG  74   5.975   6.604 -14.216
  548   1HH2  ARG  74          2HH1      ARG  74   8.508   4.291 -13.738
  549   2HH2  ARG  74          1HH1      ARG  74   7.859   5.504 -14.790
  550    H    ASP  75             H      ASP  75   4.507   0.824  -7.748
  551    HA   ASP  75            HA      ASP  75   2.086   1.775  -6.442
  552   1HB   ASP  75           2HB      ASP  75   1.910  -0.498  -6.459
  553   2HB   ASP  75           1HB      ASP  75   3.624  -0.725  -6.341
  554    H    SER  76             H      SER  76   2.414   3.547  -5.314
  555    HA   SER  76            HA      SER  76   4.478   3.527  -3.166
  556   1HB   SER  76           2HB      SER  76   4.273   5.481  -5.105
  557   2HB   SER  76           1HB      SER  76   3.230   6.124  -3.848
  558    HG   SER  76            HG      SER  76   5.960   5.388  -3.699
  559    H    LEU  77             H      LEU  77   1.332   2.836  -3.754
  560    HA   LEU  77            HA      LEU  77  -0.559   4.166  -2.280
  561   1HB   LEU  77           2HB      LEU  77  -0.702   1.888  -3.500
  562   2HB   LEU  77           1HB      LEU  77  -0.126   1.170  -2.001
  563    HG   LEU  77            HG      LEU  77  -2.053   2.245  -0.816
  564   1HD1  LEU  77          1HD1      LEU  77  -2.722   2.991  -3.669
  565   2HD1  LEU  77          3HD1      LEU  77  -3.944   2.934  -2.394
  566   3HD1  LEU  77          2HD1      LEU  77  -2.592   4.063  -2.272
  567   1HD2  LEU  77          3HD2      LEU  77  -2.354   0.233  -3.048
  568   2HD2  LEU  77          2HD2      LEU  77  -2.405  -0.025  -1.296
  569   3HD2  LEU  77          1HD2      LEU  77  -3.777   0.725  -2.114
  570    H    LEU  78             H      LEU  78   2.081   2.257  -0.883
  571    HA   LEU  78            HA      LEU  78   0.968   2.903   1.717
  572   1HB   LEU  78           2HB      LEU  78   3.164   1.130   1.036
  573   2HB   LEU  78           1HB      LEU  78   2.585   1.345   2.649
  574    HG   LEU  78            HG      LEU  78   0.899   0.387   0.293
  575   1HD1  LEU  78          3HD1      LEU  78   2.048  -1.162   2.627
  576   2HD1  LEU  78          2HD1      LEU  78   0.760  -1.772   1.567
  577   3HD1  LEU  78          1HD1      LEU  78   2.374  -1.422   0.911
  578   1HD2  LEU  78          1HD2      LEU  78   0.321   0.866   3.213
  579   2HD2  LEU  78          3HD2      LEU  78  -0.531   1.506   1.808
  580   3HD2  LEU  78          2HD2      LEU  78  -0.684  -0.200   2.232
  581    H    GLN  79             H      GLN  79   1.525   4.556   2.728
  582    HA   GLN  79            HA      GLN  79   2.842   6.672   1.999
  583   1HB   GLN  79           2HB      GLN  79   2.772   7.382   4.426
  584   2HB   GLN  79           1HB      GLN  79   1.233   6.876   3.749
  585   1HG   GLN  79           2HG      GLN  79   2.594   4.558   4.800
  586   2HG   GLN  79           1HG      GLN  79   2.554   5.814   6.039
  587   1HE2  GLN  79          2HE2      GLN  79  -0.764   4.860   6.794
  588   2HE2  GLN  79          1HE2      GLN  79   0.801   5.170   7.370
  589    H    ASP  80             H      ASP  80   4.652   5.880   1.165
  590    HA   ASP  80            HA      ASP  80   6.977   5.704   3.030
  591   1HB   ASP  80           2HB      ASP  80   6.651   4.034   1.024
  592   2HB   ASP  80           1HB      ASP  80   7.095   5.410   0.018
  593    H    GLY  81             H      GLY  81   5.129   8.042   2.363
  594   1HA   GLY  81           2HA      GLY  81   5.659  10.373   2.313
  595   2HA   GLY  81           1HA      GLY  81   7.127   9.979   1.408
  596    H    GLU  82             H      GLU  82   4.075   8.358   0.568
  597    HA   GLU  82            HA      GLU  82   3.600  10.102  -1.727
  598   1HB   GLU  82           2HB      GLU  82   4.764   7.404  -1.748
  599   2HB   GLU  82           1HB      GLU  82   3.628   7.818  -2.981
  600   1HG   GLU  82           2HG      GLU  82   5.540   8.470  -4.039
  601   2HG   GLU  82           1HG      GLU  82   5.108   9.979  -3.213
  602    H    PHE  83             H      PHE  83   2.710   6.808  -0.712
  603    HA   PHE  83            HA      PHE  83   0.712   5.633  -0.738
  604   1HB   PHE  83           2HB      PHE  83  -1.399   7.363  -0.651
  605   2HB   PHE  83           1HB      PHE  83  -0.723   6.463   0.637
  606    HD1  PHE  83           HD1      PHE  83   1.217   7.532   1.935
  607    HD2  PHE  83           HD2      PHE  83  -1.435   9.726  -0.600
  608    HE1  PHE  83           HE1      PHE  83   1.861   9.635   3.101
  609    HE2  PHE  83           HE2      PHE  83  -0.804  11.838   0.550
  610    HZ   PHE  83            HZ      PHE  83   0.845  11.791   2.404
  611    H    SER  84             H      SER  84   1.575   7.562  -3.288
  612    HA   SER  84            HA      SER  84  -0.954   7.239  -4.755
  613   1HB   SER  84           2HB      SER  84   0.459   8.361  -6.601
  614   2HB   SER  84           1HB      SER  84  -0.051   9.323  -5.215
  615    HG   SER  84            HG      SER  84   2.389   8.978  -6.070
  616    H    MET  85             H      MET  85  -1.294   5.687  -6.103
  617    HA   MET  85            HA      MET  85   0.950   3.915  -6.982
  618   1HB   MET  85           2HB      MET  85  -0.261   3.112  -4.949
  619   2HB   MET  85           1HB      MET  85  -1.716   3.165  -5.891
  620   1HG   MET  85           2HG      MET  85  -0.221   1.632  -7.506
  621   2HG   MET  85           1HG      MET  85   0.427   1.181  -5.927
  622   1HE   MET  85           1HE      MET  85  -0.043  -0.856  -6.295
  623   2HE   MET  85           3HE      MET  85  -1.364  -1.536  -5.329
  624   3HE   MET  85           2HE      MET  85  -1.501  -1.470  -7.091
  625    H    ASP  86             H      ASP  86   0.777   3.639  -9.267
  626    HA   ASP  86            HA      ASP  86  -1.868   4.447 -10.377
  627   1HB   ASP  86           2HB      ASP  86   0.620   3.545 -11.754
  628   2HB   ASP  86           1HB      ASP  86  -0.795   4.186 -12.528
  629    H    LEU  87             H      LEU  87  -3.074   3.020 -11.569
  630    HA   LEU  87            HA      LEU  87  -2.259   0.446 -12.157
  631   1HB   LEU  87           2HB      LEU  87  -4.247  -0.624 -10.929
  632   2HB   LEU  87           1HB      LEU  87  -2.740  -0.366 -10.161
  633    HG   LEU  87            HG      LEU  87  -4.650   0.113  -8.709
  634   1HD1  LEU  87          2HD1      LEU  87  -2.329   1.311  -8.703
  635   2HD1  LEU  87          1HD1      LEU  87  -3.310   2.717  -9.128
  636   3HD1  LEU  87          3HD1      LEU  87  -3.635   1.831  -7.648
  637   1HD2  LEU  87          2HD2      LEU  87  -5.897   1.117 -10.746
  638   2HD2  LEU  87          1HD2      LEU  87  -6.143   1.816  -9.150
  639   3HD2  LEU  87          3HD2      LEU  87  -5.058   2.603 -10.291
  640    NH1  ARG  88           NH2      ARG  88  -0.069   2.584 -19.945
  641    NH2  ARG  88           NH1      ARG  88   1.359   1.787 -18.382
  642    H    ARG  88             H      ARG  88  -2.867   0.278 -14.134
  643    HA   ARG  88            HA      ARG  88  -5.422   1.675 -14.930
  644   1HB   ARG  88           2HB      ARG  88  -4.391   2.444 -16.893
  645   2HB   ARG  88           1HB      ARG  88  -3.034   2.445 -15.782
  646   1HG   ARG  88           2HG      ARG  88  -2.315   0.223 -16.693
  647   2HG   ARG  88           1HG      ARG  88  -3.686   0.248 -17.814
  648   1HD   ARG  88           2HD      ARG  88  -2.653   1.654 -19.212
  649   2HD   ARG  88           1HD      ARG  88  -2.086   2.706 -17.909
  650    HE   ARG  88            HE      ARG  88  -0.619   0.173 -18.142
  651   1HH1  ARG  88          1HH2      ARG  88  -0.986   2.609 -20.348
  652   2HH1  ARG  88          2HH2      ARG  88   0.663   3.138 -20.337
  653   1HH2  ARG  88          1HH1      ARG  88   2.093   2.346 -18.765
  654   2HH2  ARG  88          2HH1      ARG  88   1.536   1.205 -17.591
  655    H    THR  89             H      THR  89  -6.986   0.645 -15.992
  656    HA   THR  89            HA      THR  89  -7.047  -2.194 -16.416
  657    HB   THR  89            HB      THR  89  -9.165  -1.825 -17.408
  658    HG1  THR  89           HG1      THR  89  -9.519  -0.426 -18.856
  659   1HG2  THR  89          1HG2      THR  89  -8.652  -0.444 -15.111
  660   2HG2  THR  89          3HG2      THR  89  -9.396   0.783 -16.142
  661   3HG2  THR  89          2HG2      THR  89 -10.261  -0.719 -15.779
  662    H    LYS  90             H      LYS  90  -5.158  -2.709 -17.613
  663    HA   LYS  90            HA      LYS  90  -4.348  -1.213 -19.865
  664   1HB   LYS  90           2HB      LYS  90  -3.360  -4.000 -19.602
  665   2HB   LYS  90           1HB      LYS  90  -2.505  -2.507 -19.932
  666   1HG   LYS  90           2HG      LYS  90  -2.788  -1.861 -17.544
  667   2HG   LYS  90           1HG      LYS  90  -3.364  -3.515 -17.235
  668   1HD   LYS  90           2HD      LYS  90  -0.897  -3.363 -18.901
  669   2HD   LYS  90           1HD      LYS  90  -0.681  -2.784 -17.266
  670   1HE   LYS  90           2HE      LYS  90  -0.754  -4.893 -16.425
  671   2HE   LYS  90           1HE      LYS  90  -2.245  -5.246 -17.294
  672   1HZ   LYS  90           2HZ      LYS  90  -0.930  -5.669 -19.286
  673   2HZ   LYS  90           1HZ      LYS  90   0.501  -5.358 -18.425
  674   3HZ   LYS  90           3HZ      LYS  90  -0.461  -6.692 -18.012
  675    H    SER  91             H      SER  91  -3.943  -2.389 -21.921
  676    HA   SER  91            HA      SER  91  -6.298  -4.033 -22.720
  677   1HB   SER  91           2HB      SER  91  -6.817  -2.090 -23.844
  678   2HB   SER  91           1HB      SER  91  -5.185  -1.555 -23.901
  679    HG   SER  91            HG      SER  91  -5.009  -2.390 -25.822
  680    H    THR  92             H      THR  92  -5.883  -5.358 -24.693
  681    HA   THR  92            HA      THR  92  -3.053  -6.360 -24.656
  682    HB   THR  92            HB      THR  92  -3.931  -8.541 -25.260
  683    HG1  THR  92           HG1      THR  92  -6.442  -7.227 -25.391
  684   1HG2  THR  92          1HG2      THR  92  -4.072  -7.858 -22.867
  685   2HG2  THR  92          3HG2      THR  92  -5.724  -7.306 -23.150
  686   3HG2  THR  92          2HG2      THR  92  -5.323  -9.016 -23.314
  687    H    GLY  93             H      GLY  93  -2.629  -4.555 -26.207
  688   1HA   GLY  93           2HA      GLY  93  -2.304  -3.687 -28.373
  689   2HA   GLY  93           1HA      GLY  93  -2.228  -5.381 -28.851
  690    H    GLY  94             H      GLY  94  -4.195  -2.504 -28.797
  691   1HA   GLY  94           2HA      GLY  94  -5.826  -2.187 -30.622
  692   2HA   GLY  94           1HA      GLY  94  -6.217  -3.899 -30.508
  693    H    ALA  95             H      ALA  95  -6.342  -3.957 -27.588
  694    HA   ALA  95            HA      ALA  95  -9.106  -3.152 -27.273
  695   1HB   ALA  95           3HB      ALA  95  -7.400  -4.890 -25.916
  696   2HB   ALA  95           2HB      ALA  95  -7.714  -3.610 -24.744
  697   3HB   ALA  95           1HB      ALA  95  -9.058  -4.493 -25.467
  698    HA   PRO  96            HA      PRO  96  -8.651   0.830 -25.511
  699   1HB   PRO  96           2HB      PRO  96 -10.969   0.952 -24.107
  700   2HB   PRO  96           1HB      PRO  96 -10.943   0.886 -25.881
  701   1HG   PRO  96           2HG      PRO  96 -11.723  -1.266 -23.954
  702   2HG   PRO  96           1HG      PRO  96 -12.174  -1.075 -25.651
  703   1HD   PRO  96           2HD      PRO  96 -10.149  -2.784 -24.579
  704   2HD   PRO  96           1HD      PRO  96 -10.578  -2.515 -26.279
  705    H    THR  97             H      THR  97  -7.537   1.669 -23.744
  706    HA   THR  97            HA      THR  97  -7.517   0.083 -21.190
  707    HB   THR  97            HB      THR  97  -5.532   1.487 -20.586
  708    HG1  THR  97           HG1      THR  97  -5.794   2.492 -23.235
  709   1HG2  THR  97          3HG2      THR  97  -5.567  -0.639 -22.181
  710   2HG2  THR  97          2HG2      THR  97  -4.932   0.526 -23.342
  711   3HG2  THR  97          1HG2      THR  97  -4.077   0.231 -21.829
  712    H    PHE  98             H      PHE  98  -7.601   1.383 -19.213
  713    HA   PHE  98            HA      PHE  98  -8.901   4.024 -19.289
  714   1HB   PHE  98           2HB      PHE  98 -10.063   1.645 -17.764
  715   2HB   PHE  98           1HB      PHE  98 -10.698   3.299 -17.775
  716    HD1  PHE  98           HD1      PHE  98 -10.784   4.222 -20.397
  717    HD2  PHE  98           HD2      PHE  98 -11.369   0.193 -19.074
  718    HE1  PHE  98           HE1      PHE  98 -12.067   3.743 -22.459
  719    HE2  PHE  98           HE2      PHE  98 -12.649  -0.303 -21.144
  720    HZ   PHE  98            HZ      PHE  98 -12.998   1.477 -22.830
  721    H    ASN  99             H      ASN  99  -7.307   5.080 -18.177
  722    HA   ASN  99            HA      ASN  99  -5.772   3.545 -16.222
  723   1HB   ASN  99           2HB      ASN  99  -5.128   6.414 -16.844
  724   2HB   ASN  99           1HB      ASN  99  -4.033   5.089 -16.429
  725   1HD2  ASN  99          2HD2      ASN  99  -3.992   5.828 -20.181
  726   2HD2  ASN  99          1HD2      ASN  99  -3.917   6.868 -18.844
  727    H    VAL 100             H      VAL 100  -5.711   3.709 -14.192
  728    HA   VAL 100            HA      VAL 100  -7.371   5.696 -12.752
  729    HB   VAL 100            HB      VAL 100  -6.498   3.050 -11.527
  730   1HG1  VAL 100          3HG1      VAL 100  -7.683   4.905 -10.281
  731   2HG1  VAL 100          2HG1      VAL 100  -9.103   4.538 -11.238
  732   3HG1  VAL 100          1HG1      VAL 100  -8.424   3.316 -10.181
  733   1HG2  VAL 100          1HG2      VAL 100  -8.886   3.390 -13.406
  734   2HG2  VAL 100          3HG2      VAL 100  -7.487   2.354 -13.683
  735   3HG2  VAL 100          2HG2      VAL 100  -8.613   1.988 -12.374
  736    H    THR 101             H      THR 101  -6.476   6.346 -10.771
  737    HA   THR 101            HA      THR 101  -3.667   5.728 -10.196
  738    HB   THR 101            HB      THR 101  -4.987   8.432  -9.692
  739    HG1  THR 101           HG1      THR 101  -3.070   7.766 -11.668
  740   1HG2  THR 101          2HG2      THR 101  -2.520   7.135  -8.852
  741   2HG2  THR 101          1HG2      THR 101  -2.172   8.602  -9.761
  742   3HG2  THR 101          3HG2      THR 101  -3.199   8.677  -8.328
  743    H    VAL 102             H      VAL 102  -3.451   5.809  -7.723
  744    HA   VAL 102            HA      VAL 102  -6.030   5.806  -6.305
  745    HB   VAL 102            HB      VAL 102  -4.329   3.402  -6.889
  746   1HG1  VAL 102          3HG1      VAL 102  -6.187   3.775  -4.502
  747   2HG1  VAL 102          2HG1      VAL 102  -5.718   2.189  -5.125
  748   3HG1  VAL 102          1HG1      VAL 102  -4.496   3.271  -4.470
  749   1HG2  VAL 102          1HG2      VAL 102  -7.226   4.101  -6.980
  750   2HG2  VAL 102          3HG2      VAL 102  -6.150   3.697  -8.307
  751   3HG2  VAL 102          2HG2      VAL 102  -6.635   2.453  -7.161
  752    H    THR 103             H      THR 103  -5.772   6.851  -4.513
  753    HA   THR 103            HA      THR 103  -3.040   7.025  -3.284
  754    HB   THR 103            HB      THR 103  -4.095   9.072  -2.123
  755    HG1  THR 103           HG1      THR 103  -6.197   8.765  -2.757
  756   1HG2  THR 103          3HG2      THR 103  -2.551   8.722  -4.374
  757   2HG2  THR 103          2HG2      THR 103  -3.867   9.753  -4.978
  758   3HG2  THR 103          1HG2      THR 103  -2.881  10.272  -3.600
  759    H    LYS 104             H      LYS 104  -2.816   6.208  -1.281
  760    HA   LYS 104            HA      LYS 104  -5.222   5.265   0.161
  761   1HB   LYS 104           2HB      LYS 104  -3.946   3.369  -0.387
  762   2HB   LYS 104           1HB      LYS 104  -2.428   4.208  -0.167
  763   1HG   LYS 104           2HG      LYS 104  -2.795   2.587   1.667
  764   2HG   LYS 104           1HG      LYS 104  -2.797   4.235   2.292
  765   1HD   LYS 104           2HD      LYS 104  -4.825   3.820   3.175
  766   2HD   LYS 104           1HD      LYS 104  -5.462   3.759   1.536
  767   1HE   LYS 104           2HE      LYS 104  -4.643   1.494   3.329
  768   2HE   LYS 104           1HE      LYS 104  -6.120   1.702   2.404
  769   1HZ   LYS 104           1HZ      LYS 104  -4.332   1.621   0.444
  770   2HZ   LYS 104           3HZ      LYS 104  -3.548   0.635   1.573
  771   3HZ   LYS 104           2HZ      LYS 104  -5.111   0.240   1.043
  772    H    THR 105             H      THR 105  -5.674   6.224   2.081
  773    HA   THR 105            HA      THR 105  -3.698   8.061   3.318
  774    HB   THR 105            HB      THR 105  -5.589   8.837   4.672
  775    HG1  THR 105           HG1      THR 105  -7.395   7.743   4.824
  776   1HG2  THR 105          1HG2      THR 105  -5.588   8.830   1.776
  777   2HG2  THR 105          3HG2      THR 105  -7.243   8.886   2.385
  778   3HG2  THR 105          2HG2      THR 105  -6.081  10.117   2.880
  779    H    ASP 106             H      ASP 106  -5.081   7.505   6.040
  780    HA   ASP 106            HA      ASP 106  -3.441   5.132   6.721
  781   1HB   ASP 106           2HB      ASP 106  -3.234   7.357   7.949
  782   2HB   ASP 106           1HB      ASP 106  -4.806   6.994   8.657
  783    H    LYS 107             H      LYS 107  -6.757   6.078   6.271
  784    HA   LYS 107            HA      LYS 107  -7.670   3.406   7.180
  785   1HB   LYS 107           2HB      LYS 107  -9.032   5.910   8.230
  786   2HB   LYS 107           1HB      LYS 107  -9.344   4.240   8.703
  787   1HG   LYS 107    D2      LEU 112  -8.926  12.024  -8.202
  844   3HD2  LEU 112          1HD2      LEU 112 -10.018  10.636  -8.128
  845    H    MET 113             H      MET 113 -11.366   7.583 -10.640
  846    HA   MET 113            HA      MET 113  -9.837   5.752 -12.485
  847   1HB   MET 113           2HB      MET 113 -12.196   5.294 -11.489
  848   2HB   MET 113           1HB      MET 113 -12.710   6.242 -12.849
  849   1HG   MET 113           2HG      MET 113 -10.717   4.156 -13.446
  850   2HG   MET 113           1HG      MET 113 -12.340   3.600 -13.044
  851   1HE   MET 113           1HE      MET 113 -12.292   2.475 -15.299
  852   2HE   MET 113           3HE      MET 113 -13.915   3.076 -14.919
  853   3HE   MET 113           2HE      MET 113 -13.272   3.231 -16.551
  854    H    GLY 114             H      GLY 114  -9.537   5.978 -14.578
  855   1HA   GLY 114           2HA      GLY 114 -10.439   8.454 -15.862
  856   2HA   GLY 114           1HA      GLY 114  -8.791   7.957 -15.939
  857    H    LYS 115             H      LYS 115 -11.190   8.264 -17.813
  858    HA   LYS 115            HA      LYS 115 -10.753   5.833 -19.391
  859   1HB   LYS 115           2HB      LYS 115 -13.230   7.509 -19.144
  860   2HB   LYS 115           1HB      LYS 115 -12.913   6.552 -20.586
  861   1HG   LYS 115           2HG      LYS 115 -12.367   4.697 -18.671
  862   2HG   LYS 115           1HG      LYS 115 -13.619   5.620 -17.860
  863   1HD   LYS 115           2HD      LYS 115 -15.237   5.078 -19.426
  864   2HD   LYS 115           1HD      LYS 115 -14.051   4.833 -20.707
  865   1HE   LYS 115           2HE      LYS 115 -14.029   2.622 -20.272
  866   2HE   LYS 115           1HE      LYS 115 -13.507   2.934 -18.616
  867   1HZ   LYS 115           2HZ      LYS 115 -16.328   3.095 -19.526
  868   2HZ   LYS 115           1HZ      LYS 115 -15.641   1.710 -18.821
  869   3HZ   LYS 115           3HZ      LYS 115 -15.755   3.146 -17.928
  870    H    GLU 116             H      GLU 116 -10.647   6.266 -21.665
  871    HA   GLU 116            HA      GLU 116  -8.721   7.496 -22.825
  872   1HB   GLU 116           2HB      GLU 116 -10.533   6.570 -23.733
  873   2HB   GLU 116           1HB      GLU 116 -11.390   8.034 -23.657
  874   1HG   GLU 116           2HG      GLU 116 -10.494   7.712 -25.948
  875   2HG   GLU 116           1HG      GLU 116  -9.706   9.075 -25.166
  876    H    GLY 117             H      GLY 117  -7.959   9.249 -23.857
  877   1HA   GLY 117           2HA      GLY 117  -7.333  11.514 -24.042
  878   2HA   GLY 117           1HA      GLY 117  -8.882  11.970 -23.280
  879    H    VAL 118             H      VAL 118  -7.390   9.217 -21.909
  880    HA   VAL 118            HA      VAL 118  -6.831  10.603 -19.444
  881    HB   VAL 118            HB      VAL 118  -8.574   8.767 -19.992
  882   1HG1  VAL 118          3HG1      VAL 118  -6.980   7.187 -20.992
  883   2HG1  VAL 118          2HG1      VAL 118  -6.295   6.928 -19.385
  884   3HG1  VAL 118          1HG1      VAL 118  -8.006   6.545 -19.694
  885   1HG2  VAL 118          1HG2      VAL 118  -6.923   9.315 -17.617
  886   2HG2  VAL 118          3HG2      VAL 118  -8.662   9.029 -17.713
  887   3HG2  VAL 118          2HG2      VAL 118  -7.544   7.644 -17.566
  888    H    HIS 119             H      HIS 119  -4.730  11.225 -19.396
  889    HA   HIS 119            HA      HIS 119  -2.566   9.476 -20.385
  890   1HB   HIS 119           2HB      HIS 119  -2.275  11.885 -20.699
  891   2HB   HIS 119           1HB      HIS 119  -2.559  12.186 -18.991
  892    HD1  HIS 119           HD1      HIS 119  -0.387  12.755 -17.884
  893    HD2  HIS 119           HD2      HIS 119   0.103   9.792 -20.777
  894    HE1  HIS 119           HE1      HIS 119   2.050  12.056 -17.793
  895    H    GLY 120             H      GLY 120  -4.022  10.544 -17.353
  896   1HA   GLY 120           2HA      GLY 120  -4.092   9.171 -15.369
  897   2HA   GLY 120           1HA      GLY 120  -2.632   8.349 -15.916
  898    H    GLY 121             H      GLY 121  -1.836  11.465 -16.533
  899   1HA   GLY 121           2HA      GLY 121  -0.267  11.739 -14.055
  900   2HA   GLY 121           1HA      GLY 121  -0.151  12.778 -15.475
  901    H    LEU 122             H      LEU 122  -2.900  13.432 -15.684
  902    HA   LEU 122            HA      LEU 122  -3.159  15.563 -13.725
  903   1HB   LEU 122           2HB      LEU 122  -5.435  14.701 -15.534
  904   2HB   LEU 122           1HB      LEU 122  -5.051  16.313 -14.952
  905    HG   LEU 122            HG      LEU 122  -4.362  16.524 -17.159
  906   1HD1  LEU 122          3HD1      LEU 122  -2.297  16.545 -15.456
  907   2HD1  LEU 122          2HD1      LEU 122  -1.781  15.185 -16.454
  908   3HD1  LEU 122          1HD1      LEU 122  -2.065  16.760 -17.192
  909   1HD2  LEU 122          1HD2      LEU 122  -4.674  13.762 -17.212
  910   2HD2  LEU 122          3HD2      LEU 122  -4.234  14.778 -18.590
  911   3HD2  LEU 122          2HD2      LEU 122  -2.975  13.986 -17.642
  912    H    ILE 123             H      ILE 123  -4.554  12.408 -14.350
  913    HA   ILE 123            HA      ILE 123  -6.572  12.469 -12.280
  914    HB   ILE 123            HB      ILE 123  -5.080  10.269 -13.694
  915   1HG1  ILE 123          2HG1      ILE 123  -7.939  11.300 -14.020
  916   2HG1  ILE 123          1HG1      ILE 123  -6.598  11.664 -15.113
  917   1HG2  ILE 123          2HG2      ILE 123  -6.690  10.051 -11.298
  918   2HG2  ILE 123          1HG2      ILE 123  -7.561   9.283 -12.624
  919   3HG2  ILE 123          3HG2      ILE 123  -5.929   8.748 -12.214
  920   1HD1  ILE 123          3HD1      ILE 123  -7.509   8.867 -14.465
  921   2HD1  ILE 123          2HD1      ILE 123  -8.073   9.799 -15.844
  922   3HD1  ILE 123          1HD1      ILE 123  -6.370   9.369 -15.712
  923    H    ASN 124             H      ASN 124  -3.173  11.517 -12.534
  924    HA   ASN 124            HA      ASN 124  -2.887  10.414  -9.907
  925   1HB   ASN 124           2HB      ASN 124  -1.232  10.073 -11.745
  926   2HB   ASN 124           1HB      ASN 124  -0.787  11.771 -11.615
  927   1HD2  ASN 124          2HD2      ASN 124   1.013  11.327  -8.557
  928   2HD2  ASN 124          1HD2      ASN 124   0.196  12.467  -9.511
  929    H    LYS 125             H      LYS 125  -2.914  13.631 -11.260
  930    HA   LYS 125            HA      LYS 125  -1.933  14.936  -8.726
  931   1HB   LYS 125           2HB      LYS 125  -3.053  15.940 -11.390
  932   2HB   LYS 125           1HB      LYS 125  -2.730  17.028 -10.033
  933   1HG   LYS 125           2HG      LYS 125  -0.577  15.112 -10.830
  934   2HG   LYS 125           1HG      LYS 125  -0.865  16.511 -11.864
  935   1HD   LYS 125           2HD      LYS 125  -0.507  18.038 -10.037
  936   2HD   LYS 125           1HD      LYS 125  -0.465  16.713  -8.873
  937   1HE   LYS 125           2HE      LYS 125   1.498  15.858 -10.458
  938   2HE   LYS 125           1HE      LYS 125   1.613  17.577 -10.840
  939   1HZ   LYS 125           3HZ      LYS 125   1.428  16.740  -8.031
  940   2HZ   LYS 125           2HZ      LYS 125   2.915  16.595  -8.836
  941   3HZ   LYS 125           1HZ      LYS 125   2.167  18.113  -8.697
  942    H    LYS 126             H      LYS 126  -4.970  13.950 -10.223
  943    HA   LYS 126            HA      LYS 126  -6.648  15.521  -8.388
  944   1HB   LYS 126           2HB      LYS 126  -7.140  13.758 -10.754
  945   2HB   LYS 126           1HB      LYS 126  -8.453  14.027  -9.604
  946   1HG   LYS 126           2HG      LYS 126  -8.256  16.440  -9.864
  947   2HG   LYS 126           1HG      LYS 126  -6.844  16.247 -10.900
  948   1HD   LYS 126           2HD      LYS 126  -9.424  14.908 -11.651
  949   2HD   LYS 126           1HD      LYS 126  -9.203  16.624 -11.986
  950   1HE   LYS 126           2HE      LYS 126  -6.813  15.487 -12.850
  951   2HE   LYS 126           1HE      LYS 126  -8.026  14.310 -13.338
  952   1HZ   LYS 126           2HZ      LYS 126  -8.205  17.218 -13.900
  953   2HZ   LYS 126           1HZ      LYS 126  -7.606  16.069 -15.000
  954   3HZ   LYS 126           3HZ      LYS 126  -9.222  15.995 -14.496
  955    H    CYS 127             H      CYS 127  -5.026  12.524  -8.368
  956    HA   CYS 127            HA      CYS 127  -6.860  11.159  -6.491
  957   1HB   CYS 127           2HB      CYS 127  -5.363  10.016  -8.331
  958   2HB   CYS 127           1HB      CYS 127  -4.097  10.192  -7.156
  959    HG   CYS 127            HG      CYS 127  -6.727   8.669  -6.463
  960    OH   TYR 128            OH      TYR 128   2.272  15.465  -2.124
  961    H    TYR 128             H      TYR 128  -3.884  12.895  -6.720
  962    HA   TYR 128            HA      TYR 128  -2.949  12.532  -4.019
  963   1HB   TYR 128           2HB      TYR 128  -1.684  13.216  -6.172
  964   2HB   TYR 128           1HB      TYR 128  -2.404  14.799  -5.974
  965    HD1  TYR 128           HD1      TYR 128  -1.351  12.847  -2.987
  966    HD2  TYR 128           HD2      TYR 128  -0.288  15.835  -5.899
  967    HE1  TYR 128           HE1      TYR 128   0.556  13.530  -1.563
  968    HE2  TYR 128           HE2      TYR 128   1.622  16.533  -4.450
  969    HH   TYR 128            HH      TYR 128   3.036  15.587  -2.693
  970    H    GLU 129             H      GLU 129  -5.097  14.757  -5.776
  971    HA   GLU 129            HA      GLU 129  -5.428  16.644  -3.536
  972   1HB   GLU 129           2HB      GLU 129  -6.663  16.315  -6.262
  973   2HB   GLU 129           1HB      GLU 129  -7.400  17.395  -5.079
  974   1HG   GLU 129           2HG      GLU 129  -4.985  18.347  -4.809
  975   2HG   GLU 129           1HG      GLU 129  -4.696  17.582  -6.372
  976    H    MET 130             H      MET 130  -7.215  13.934  -4.960
  977    HA   MET 130            HA      MET 130  -9.660  14.126  -3.479
  978   1HB   MET 130           2HB      MET 130  -8.794  12.519  -5.482
  979   2HB   MET 130           1HB      MET 130  -8.499  11.430  -4.148
  980   1HG   MET 130           2HG      MET 130 -10.919  11.774  -3.458
  981   2HG   MET 130           1HG      MET 130 -11.149  12.670  -4.967
  982   1HE   MET 130           2HE      MET 130 -12.852  10.676  -4.156
  983   2HE   MET 130           1HE      MET 130 -13.141  10.629  -5.892
  984   3HE   MET 130           3HE      MET 130 -12.850   9.128  -4.996
  985    H    ALA 131             H      ALA 131  -6.621  12.396  -2.867
  986    HA   ALA 131            HA      ALA 131  -7.340  11.519  -0.166
  987   1HB   ALA 131           3HB      ALA 131  -4.790  11.408  -1.830
  988   2HB   ALA 131           2HB      ALA 131  -4.842  10.897  -0.131
  989   3HB   ALA 131           1HB      ALA 131  -5.836  10.072  -1.325
  990    H    SER 132             H      SER 132  -6.030  14.411  -1.589
  991    HA   SER 132            HA      SER 132  -4.399  15.312   0.601
  992   1HB   SER 132           2HB      SER 132  -5.853  16.722  -1.616
  993   2HB   SER 132           1HB      SER 132  -5.160  17.657  -0.305
  994    HG   SER 132            HG      SER 132  -3.155  16.706  -0.782
  995    H    HIS 133             H      HIS 133  -7.885  15.315  -0.103
  996    HA   HIS 133            HA      HIS 133  -8.452  16.895   2.297
  997   1HB   HIS 133           2HB      HIS 133  -9.957  16.681   0.169
  998   2HB   HIS 133           1HB      HIS 133 -10.625  15.251   1.012
  999    HD1  HIS 133           HD1      HIS 133 -10.543  18.986   1.099
 1000    HD2  HIS 133           HD2      HIS 133 -11.708  15.880   3.627
 1001    HE1  HIS 133           HE1      HIS 133 -11.883  20.049   2.976
 1002    H    LEU 134             H      LEU 134  -8.467  13.439   1.291
 1003    HA   LEU 134            HA      LEU 134  -9.493  12.526   3.865
 1004   1HB   LEU 134           2HB      LEU 134  -8.019  11.170   1.632
 1005   2HB   LEU 134           1HB      LEU 134  -8.456  10.322   3.106
 1006    HG   LEU 134            HG      LEU 134 -10.795  11.590   2.497
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.259  11.223   0.012
 1008   2HD1  LEU 134          2HD1      LEU 134 -10.954  10.751  -0.030
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.506  12.399   0.399
 1010   1HD2  LEU 134          1HD2      LEU 134  -9.847   8.873   1.615
 1011   2HD2  LEU 134          3HD2      LEU 134 -10.632   9.259   3.142
 1012   3HD2  LEU 134          2HD2      LEU 134 -11.535   9.362   1.630
 1013    NH1  ARG 135           NH1      ARG 135   0.844  12.910   4.925
 1014    NH2  ARG 135           NH2      ARG 135  -0.050  11.086   5.915
 1015    H    ARG 135             H      ARG 135  -6.555  13.896   3.031
 1016    HA   ARG 135            HA      ARG 135  -4.989  12.604   5.178
 1017   1HB   ARG 135           2HB      ARG 135  -4.382  14.572   2.979
 1018   2HB   ARG 135           1HB      ARG 135  -3.383  14.615   4.432
 1019   1HG   ARG 135           2HG      ARG 135  -3.547  11.890   3.827
 1020   2HG   ARG 135           1HG      ARG 135  -3.393  12.662   2.248
 1021   1HD   ARG 135           2HD      ARG 135  -1.148  12.400   2.882
 1022   2HD   ARG 135           1HD      ARG 135  -1.487  14.050   3.405
 1023    HE   ARG 135            HE      ARG 135  -2.086  12.699   5.663
 1024   1HH1  ARG 135          2HH1      ARG 135   0.728  13.772   4.430
 1025   2HH1  ARG 135          1HH1      ARG 135   1.760  12.588   5.157
 1026   1HH2  ARG 135          1HH2      ARG 135  -0.852  10.549   6.179
 1027   2HH2  ARG 135          2HH2      ARG 135   0.867  10.761   6.145
 1028    NH1  ARG 136           NH2      ARG 136  -3.533  18.489   7.306
 1029    NH2  ARG 136           NH1      ARG 136  -3.448  20.732   7.058
 1030    H    ARG 136             H      ARG 136  -6.549  15.614   4.228
 1031    HA   ARG 136            HA      ARG 136  -6.080  16.969   6.751
 1032   1HB   ARG 136           2HB      ARG 136  -7.581  17.521   4.238
 1033   2HB   ARG 136           1HB      ARG 136  -8.071  18.394   5.690
 1034   1HG   ARG 136           2HG      ARG 136  -5.150  18.296   5.227
 1035   2HG   ARG 136           1HG      ARG 136  -6.062  19.201   4.020
 1036   1HD   ARG 136           2HD      ARG 136  -5.816  20.892   5.549
 1037   2HD   ARG 136           1HD      ARG 136  -7.249  20.141   6.252
 1038    HE   ARG 136            HE      ARG 136  -5.916  19.534   8.088
 1039   1HH1  ARG 136          1HH2      ARG 136  -4.066  17.651   7.414
 1040   2HH1  ARG 136          2HH2      ARG 136  -2.534  18.446   7.278
 1041   1HH2  ARG 136          2HH1      ARG 136  -3.913  21.610   6.973
 1042   2HH2  ARG 136          1HH1      ARG 136  -2.449  20.691   7.034
 1043    H    SER 137             H      SER 137  -8.066  14.454   5.787
 1044    HA   SER 137            HA      SER 137 -10.408  15.077   7.380
 1045   1HB   SER 137           2HB      SER 137 -11.265  13.018   6.517
 1046   2HB   SER 137           1HB      SER 137 -10.313  13.661   5.206
 1047    HG   SER 137            HG      SER 137  -9.998  11.377   5.792
 1048    H    GLN 138             H      GLN 138  -7.251  13.663   7.880
 1049    HA   GLN 138            HA      GLN 138  -6.230  12.850   9.830
 1050   1HB   GLN 138           2HB      GLN 138  -8.341  14.504  10.782
 1051   2HB   GLN 138           1HB      GLN 138  -8.425  13.020  11.729
 1052   1HG   GLN 138           2HG      GLN 138  -5.669  13.988  11.361
 1053   2HG   GLN 138           1HG      GLN 138  -6.694  15.139  12.216
 1054   1HE2  GLN 138          2HE2      GLN 138  -5.587  11.677  14.045
 1055   2HE2  GLN 138          1HE2      GLN 138  -5.151  11.992  12.437
 1056    OH   TYR 139            OH      TYR 139 -14.581  10.428   9.224
 1057    H    TYR 139             H      TYR 139  -7.755  11.136   8.003
 1058    HA   TYR 139            HA      TYR 139  -8.860   9.037   9.798
 1059   1HB   TYR 139           2HB      TYR 139  -8.999   9.563   6.833
 1060   2HB   TYR 139           1HB      TYR 139  -9.273   7.924   7.442
 1061    HD1  TYR 139           HD2      TYR 139 -10.258  11.451   8.236
 1062    HD2  TYR 139           HD1      TYR 139 -11.449   7.332   8.046
 1063    HE1  TYR 139           HE2      TYR 139 -12.557  12.087   8.904
 1064    HE2  TYR 139           HE1      TYR 139 -13.752   7.972   8.712
 1065    HH   TYR 139            HH      TYR 139 -14.951  10.974   8.523
   
  Start of MODEL          10
 Raw file had 1065 H/Q atoms
  Start of MODEL   10
    1   1H    ALA   1            3H      ALA   1 -20.709  18.584   0.312
    2   2H    ALA   1            2H      ALA   1 -22.326  18.996   0.636
    3   3H    ALA   1            1H      ALA   1 -21.094  19.473   1.702
    4    HA   ALA   1            HA      ALA   1 -22.266  17.620   2.649
    5   1HB   ALA   1           1HB      ALA   1 -21.581  16.333  -0.007
    6   2HB   ALA   1           3HB      ALA   1 -22.124  15.416   1.399
    7   3HB   ALA   1           2HB      ALA   1 -23.189  16.617   0.660
    8    H    GLY   2             H      GLY   2 -19.527  16.677   0.526
    9   1HA   GLY   2           2HA      GLY   2 -17.289  17.039   1.991
   10   2HA   GLY   2           1HA      GLY   2 -18.028  15.711   2.890
   11    CH2  TRP   3           CH2      TRP   3 -12.812  11.502   3.753
   12    H    TRP   3             H      TRP   3 -17.966  13.648   2.044
   13    HA   TRP   3            HA      TRP   3 -16.004  12.836   0.286
   14   1HB   TRP   3           2HB      TRP   3 -18.478  11.647   1.138
   15   2HB   TRP   3           1HB      TRP   3 -17.544  10.853  -0.090
   16    HD1  TRP   3           HD1      TRP   3 -17.868   9.341   2.343
   17    HE1  TRP   3           HE1      TRP   3 -16.015   8.779   4.008
   18    HE3  TRP   3           HE3      TRP   3 -14.486  13.134   1.284
   19    HZ2  TRP   3           HZ2      TRP   3 -13.484   9.761   4.802
   20    HZ3  TRP   3           HZ3      TRP   3 -12.391  13.220   2.550
   21    HH2  TRP   3           HH2      TRP   3 -11.881  11.561   4.296
   22    H    ASN   4             H      ASN   4 -19.394  13.532  -0.503
   23    HA   ASN   4            HA      ASN   4 -19.369  12.734  -3.236
   24   1HB   ASN   4           2HB      ASN   4 -21.083  14.553  -1.600
   25   2HB   ASN   4           1HB      ASN   4 -21.221  14.667  -3.353
   26   1HD2  ASN   4          2HD2      ASN   4 -22.762  11.445  -1.423
   27   2HD2  ASN   4          1HD2      ASN   4 -21.961  12.675  -0.572
   28    H    ALA   5             H      ALA   5 -18.178  15.617  -1.767
   29    HA   ALA   5            HA      ALA   5 -17.908  17.220  -4.205
   30   1HB   ALA   5           2HB      ALA   5 -16.609  17.433  -1.449
   31   2HB   ALA   5           1HB      ALA   5 -16.303  18.578  -2.758
   32   3HB   ALA   5           3HB      ALA   5 -17.928  18.411  -2.090
   33    OH   TYR   6            OH      TYR   6 -13.300  17.873   1.372
   34    H    TYR   6             H      TYR   6 -15.925  14.938  -2.342
   35    HA   TYR   6            HA      TYR   6 -13.600  15.265  -4.114
   36   1HB   TYR   6           2HB      TYR   6 -14.125  12.994  -2.188
   37   2HB   TYR   6           1HB      TYR   6 -12.563  13.482  -2.861
   38    HD1  TYR   6           HD1      TYR   6 -11.668  15.802  -2.345
   39    HD2  TYR   6           HD2      TYR   6 -15.063  14.149  -0.460
   40    HE1  TYR   6           HE1      TYR   6 -11.599  17.611  -0.643
   41    HE2  TYR   6           HE2      TYR   6 -15.024  15.870   1.268
   42    HH   TYR   6            HH      TYR   6 -14.052  18.446   1.198
   43    H    ILE   7             H      ILE   7 -16.613  13.808  -4.363
   44    HA   ILE   7            HA      ILE   7 -15.822  11.900  -6.457
   45    HB   ILE   7            HB      ILE   7 -18.395  12.456  -5.025
   46   1HG1  ILE   7          2HG1      ILE   7 -16.607  10.821  -4.243
   47   2HG1  ILE   7          1HG1      ILE   7 -18.212  10.134  -4.435
   48   1HG2  ILE   7          1HG2      ILE   7 -18.016  11.300  -7.758
   49   2HG2  ILE   7          3HG2      ILE   7 -19.239  10.575  -6.706
   50   3HG2  ILE   7          2HG2      ILE   7 -19.352  12.282  -7.147
   51   1HD1  ILE   7          3HD1      ILE   7 -16.563  10.042  -6.852
   52   2HD1  ILE   7          2HD1      ILE   7 -15.920   9.093  -5.525
   53   3HD1  ILE   7          1HD1      ILE   7 -17.544   8.783  -6.128
   54    H    ASP   8             H      ASP   8 -17.034  15.113  -5.865
   55    HA   ASP   8            HA      ASP   8 -17.952  15.771  -8.442
   56   1HB   ASP   8           2HB      ASP   8 -17.351  17.212  -5.989
   57   2HB   ASP   8           1HB      ASP   8 -17.357  18.153  -7.424
   58    H    ASN   9             H      ASN   9 -14.879  15.310  -7.035
   59    HA   ASN   9            HA      ASN   9 -13.078  16.809  -8.475
   60   1HB   ASN   9           2HB      ASN   9 -11.967  15.465  -6.964
   61   2HB   ASN   9           1HB      ASN   9 -13.203  14.341  -6.971
   62   1HD2  ASN   9          2HD2      ASN   9 -11.154  11.737  -8.581
   63   2HD2  ASN   9          1HD2      ASN   9 -12.346  12.125  -7.387
   64    H    LEU  10             H      LEU  10 -14.295  13.804  -9.200
   65    HA   LEU  10            HA      LEU  10 -13.413  13.173 -11.724
   66   1HB   LEU  10           2HB      LEU  10 -16.052  12.652 -10.412
   67   2HB   LEU  10           1HB      LEU  10 -15.503  11.807 -11.821
   68    HG   LEU  10            HG      LEU  10 -14.841  10.321 -10.328
   69   1HD1  LEU  10          2HD1      LEU  10 -12.576  12.285 -10.182
   70   2HD1  LEU  10          1HD1      LEU  10 -12.518  10.747  -9.371
   71   3HD1  LEU  10          3HD1      LEU  10 -12.690  10.801 -11.104
   72   1HD2  LEU  10          3HD2      LEU  10 -14.927  12.522  -8.318
   73   2HD2  LEU  10          2HD2      LEU  10 -15.821  11.057  -8.325
   74   3HD2  LEU  10          1HD2      LEU  10 -14.118  11.069  -7.893
   75    H    MET  11             H      MET  11 -16.191  14.794 -10.618
   76    HA   MET  11            HA      MET  11 -17.174  15.061 -13.333
   77   1HB   MET  11           2HB      MET  11 -18.058  16.370 -10.729
   78   2HB   MET  11           1HB      MET  11 -19.027  16.196 -12.207
   79   1HG   MET  11           2HG      MET  11 -17.767  13.626 -10.835
   80   2HG   MET  11           1HG      MET  11 -19.382  14.279 -10.361
   81   1HE   MET  11           3HE      MET  11 -17.690  11.820 -12.120
   82   2HE   MET  11           2HE      MET  11 -18.306  11.622 -13.759
   83   3HE   MET  11           1HE      MET  11 -17.199  12.943 -13.394
   84    H    ALA  12             H      ALA  12 -15.160  17.015 -11.288
   85    HA   ALA  12            HA      ALA  12 -15.081  19.389 -12.938
   86   1HB   ALA  12           2HB      ALA  12 -13.910  18.560 -10.333
   87   2HB   ALA  12           1HB      ALA  12 -13.175  19.904 -11.215
   88   3HB   ALA  12           3HB      ALA  12 -14.866  19.993 -10.730
   89    H    ASP  13             H      ASP  13 -13.334  16.431 -12.999
   90    HA   ASP  13            HA      ASP  13 -10.768  17.666 -13.901
   91   1HB   ASP  13           2HB      ASP  13 -10.146  15.044 -13.998
   92   2HB   ASP  13           1HB      ASP  13 -10.087  15.983 -12.528
   93    H    GLY  14             H      GLY  14 -13.387  16.627 -15.751
   94   1HA   GLY  14           2HA      GLY  14 -13.510  15.798 -18.050
   95   2HA   GLY  14           1HA      GLY  14 -12.343  17.084 -18.295
   96    H    THR  15             H      THR  15 -11.304  14.359 -16.417
   97    HA   THR  15            HA      THR  15  -9.855  13.002 -18.565
   98    HB   THR  15            HB      THR  15  -8.728  13.942 -15.934
   99    HG1  THR  15           HG1      THR  15  -8.432  15.583 -17.251
  100   1HG2  THR  15          1HG2      THR  15  -7.585  12.134 -18.084
  101   2HG2  THR  15          3HG2      THR  15  -6.609  12.887 -16.791
  102   3HG2  THR  15          2HG2      THR  15  -7.912  11.757 -16.384
  103    H    CYS  16             H      CYS  16 -11.399  12.982 -15.428
  104    HA   CYS  16            HA      CYS  16 -10.839  10.366 -14.719
  105   1HB   CYS  16           2HB      CYS  16 -12.101  10.836 -12.878
  106   2HB   CYS  16           1HB      CYS  16 -11.791  12.406 -13.424
  107    HG   CYS  16            HG      CYS  16 -14.460  10.949 -14.053
  108    H    GLN  17             H      GLN  17 -12.957   8.989 -14.266
  109    HA   GLN  17            HA      GLN  17 -14.889   8.869 -16.429
  110   1HB   GLN  17           2HB      GLN  17 -12.649   7.511 -16.857
  111   2HB   GLN  17           1HB      GLN  17 -13.449   6.322 -15.862
  112   1HG   GLN  17           2HG      GLN  17 -14.985   7.579 -18.099
  113   2HG   GLN  17           1HG      GLN  17 -13.749   6.378 -18.514
  114   1HE2  GLN  17          2HE2      GLN  17 -16.315   3.967 -17.984
  115   2HE2  GLN  17          1HE2      GLN  17 -15.321   4.735 -19.126
  116    H    ASP  18             H      ASP  18 -13.374   7.176 -13.716
  117    HA   ASP  18            HA      ASP  18 -15.932   7.068 -12.288
  118   1HB   ASP  18           2HB      ASP  18 -15.087   4.860 -13.396
  119   2HB   ASP  18           1HB      ASP  18 -14.102   4.800 -11.968
  120    H    ALA  19             H      ALA  19 -15.279   6.206  -9.880
  121    HA   ALA  19            HA      ALA  19 -12.783   7.475  -8.819
  122   1HB   ALA  19           1HB      ALA  19 -15.329   8.894  -9.207
  123   2HB   ALA  19           3HB      ALA  19 -14.695   8.940  -7.545
  124   3HB   ALA  19           2HB      ALA  19 -13.687   9.406  -8.875
  125    H    ALA  20             H      ALA  20 -12.418   6.275  -6.834
  126    HA   ALA  20            HA      ALA  20 -14.949   5.573  -5.331
  127   1HB   ALA  20           3HB      ALA  20 -13.994   3.631  -6.714
  128   2HB   ALA  20           2HB      ALA  20 -12.832   3.497  -5.428
  129   3HB   ALA  20           1HB      ALA  20 -14.562   3.343  -5.081
  130    H    ILE  21             H      ILE  21 -14.790   6.534  -3.486
  131    HA   ILE  21            HA      ILE  21 -12.233   6.493  -1.953
  132    HB   ILE  21            HB      ILE  21 -14.917   7.765  -1.254
  133   1HG1  ILE  21          2HG1      ILE  21 -12.390   8.854  -2.537
  134   2HG1  ILE  21          1HG1      ILE  21 -14.026   8.888  -3.192
  135   1HG2  ILE  21          2HG2      ILE  21 -12.780   7.093   0.419
  136   2HG2  ILE  21          1HG2      ILE  21 -12.455   8.783   0.026
  137   3HG2  ILE  21          3HG2      ILE  21 -13.992   8.327   0.765
  138   1HD1  ILE  21          1HD1      ILE  21 -14.351  10.187  -0.796
  139   2HD1  ILE  21          3HD1      ILE  21 -12.729  10.687  -1.272
  140   3HD1  ILE  21          2HD1      ILE  21 -14.093  10.990  -2.346
  141    H    VAL  22             H      VAL  22 -12.084   4.472  -0.904
  142    HA   VAL  22            HA      VAL  22 -14.639   3.164  -0.153
  143    HB   VAL  22            HB      VAL  22 -12.016   1.865  -0.940
  144   1HG1  VAL  22          2HG1      VAL  22 -13.621   0.598   0.606
  145   2HG1  VAL  22          1HG1      VAL  22 -14.756   0.594  -0.745
  146   3HG1  VAL  22          3HG1      VAL  22 -13.191  -0.217  -0.902
  147   1HG2  VAL  22          1HG2      VAL  22 -13.156   3.143  -2.793
  148   2HG2  VAL  22          3HG2      VAL  22 -13.070   1.401  -3.086
  149   3HG2  VAL  22          2HG2      VAL  22 -14.582   2.127  -2.544
  150    H    GLY  23             H      GLY  23 -14.857   3.121   2.090
  151   1HA   GLY  23           2HA      GLY  23 -12.624   3.300   3.955
  152   2HA   GLY  23           1HA      GLY  23 -14.288   2.851   4.386
  153    OH   TYR  24            OH      TYR  24  -5.295   0.972   4.923
  154    H    TYR  24             H      TYR  24 -11.284   1.605   3.116
  155    HA   TYR  24            HA      TYR  24 -12.084  -1.145   2.921
  156   1HB   TYR  24           2HB      TYR  24  -9.982  -1.498   1.888
  157   2HB   TYR  24           1HB      TYR  24 -10.344   0.155   1.478
  158    HD1  TYR  24           HD1      TYR  24  -9.675   1.635   3.965
  159    HD2  TYR  24           HD2      TYR  24  -7.725  -1.696   2.158
  160    HE1  TYR  24           HE1      TYR  24  -7.595   2.263   5.121
  161    HE2  TYR  24           HE2      TYR  24  -5.628  -1.088   3.275
  162    HH   TYR  24            HH      TYR  24  -4.985   0.203   5.404
  163    H    LYS  25             H      LYS  25 -12.239   0.013   5.701
  164    HA   LYS  25            HA      LYS  25 -10.120  -0.853   7.348
  165   1HB   LYS  25           2HB      LYS  25 -12.974  -0.242   7.788
  166   2HB   LYS  25           1HB      LYS  25 -11.991  -0.820   9.095
  167   1HG   LYS  25           2HG      LYS  25 -11.817   1.520   9.273
  168   2HG   LYS  25           1HG      LYS  25 -10.341   1.044   8.438
  169   1HD   LYS  25           2HD      LYS  25 -11.095   1.800   6.390
  170   2HD   LYS  25           1HD      LYS  25 -12.794   1.720   6.870
  171   1HE   LYS  25           2HE      LYS  25 -10.740   3.665   7.949
  172   2HE   LYS  25           1HE      LYS  25 -12.028   4.055   6.817
  173   1HZ   LYS  25           2HZ      LYS  25 -13.500   2.994   8.696
  174   2HZ   LYS  25           1HZ      LYS  25 -12.193   3.452   9.681
  175   3HZ   LYS  25           3HZ      LYS  25 -13.025   4.623   8.778
  176    H    ASP  26             H      ASP  26 -11.626  -2.538   9.186
  177    HA   ASP  26            HA      ASP  26 -10.956  -5.156   8.529
  178   1HB   ASP  26           2HB      ASP  26 -13.147  -5.792   9.822
  179   2HB   ASP  26           1HB      ASP  26 -11.792  -5.100  10.678
  180    H    SER  27             H      SER  27 -14.166  -3.788   8.013
  181    HA   SER  27            HA      SER  27 -14.617  -5.650   5.781
  182   1HB   SER  27           2HB      SER  27 -17.005  -4.843   6.165
  183   2HB   SER  27           1HB      SER  27 -16.360  -5.922   7.369
  184    HG   SER  27            HG      SER  27 -16.822  -4.374   8.710
  185    HA   PRO  28            HA      PRO  28 -13.951  -1.877   3.558
  186   1HB   PRO  28           2HB      PRO  28 -14.197  -2.909   1.035
  187   2HB   PRO  28           1HB      PRO  28 -12.733  -3.040   2.023
  188   1HG   PRO  28           2HG      PRO  28 -14.694  -5.131   1.357
  189   2HG   PRO  28           1HG      PRO  28 -13.053  -5.279   1.939
  190   1HD   PRO  28           2HD      PRO  28 -15.437  -5.596   3.432
  191   2HD   PRO  28           1HD      PRO  28 -13.763  -5.663   4.022
  192    H    SER  29             H      SER  29 -15.151  -0.371   2.372
  193    HA   SER  29            HA      SER  29 -17.786  -1.000   1.428
  194   1HB   SER  29           2HB      SER  29 -18.854   0.722   2.889
  195   2HB   SER  29           1HB      SER  29 -18.276  -0.678   3.788
  196    HG   SER  29            HG      SER  29 -17.500   1.087   4.851
  197    H    VAL  30             H      VAL  30 -18.702   0.833   0.308
  198    HA   VAL  30            HA      VAL  30 -16.599   2.443  -0.895
  199    HB   VAL  30            HB      VAL  30 -19.471   1.823  -1.561
  200   1HG1  VAL  30          3HG1      VAL  30 -19.038   4.181  -2.150
  201   2HG1  VAL  30          2HG1      VAL  30 -17.589   3.690  -3.025
  202   3HG1  VAL  30          1HG1      VAL  30 -19.179   3.173  -3.589
  203   1HG2  VAL  30          2HG2      VAL  30 -17.005   0.574  -2.070
  204   2HG2  VAL  30          1HG2      VAL  30 -18.531   0.244  -2.889
  205   3HG2  VAL  30          3HG2      VAL  30 -17.393   1.401  -3.573
  206    CH2  TRP  31           CH2      TRP  31 -13.345   6.154   6.743
  207    H    TRP  31             H      TRP  31 -16.127   4.098   0.463
  208    HA   TRP  31            HA      TRP  31 -17.967   5.554   2.079
  209   1HB   TRP  31           2HB      TRP  31 -15.089   5.805   1.299
  210   2HB   TRP  31           1HB      TRP  31 -15.877   7.220   1.993
  211    HD1  TRP  31           HD1      TRP  31 -17.305   4.016   3.260
  212    HE1  TRP  31           HE1      TRP  31 -16.520   3.583   5.631
  213    HE3  TRP  31           HE3      TRP  31 -13.567   7.492   3.626
  214    HZ2  TRP  31           HZ2      TRP  31 -14.575   4.557   7.495
  215    HZ3  TRP  31           HZ3      TRP  31 -12.285   7.722   5.723
  216    HH2  TRP  31           HH2      TRP  31 -12.775   6.252   7.654
  217    H    ALA  32             H      ALA  32 -17.113   5.723  -1.275
  218    HA   ALA  32            HA      ALA  32 -19.139   7.474  -2.034
  219   1HB   ALA  32           2HB      ALA  32 -16.642   8.893  -1.187
  220   2HB   ALA  32           1HB      ALA  32 -17.519   9.513  -2.599
  221   3HB   ALA  32           3HB      ALA  32 -18.328   9.386  -1.035
  222    H    ALA  33             H      ALA  33 -18.978   5.757  -3.647
  223    HA   ALA  33            HA      ALA  33 -16.879   6.258  -5.688
  224   1HB   ALA  33           1HB      ALA  33 -16.924   3.900  -4.871
  225   2HB   ALA  33           3HB      ALA  33 -18.610   3.785  -5.378
  226   3HB   ALA  33           2HB      ALA  33 -17.340   4.024  -6.577
  227    H    VAL  34             H      VAL  34 -17.605   7.067  -7.608
  228    HA   VAL  34            HA      VAL  34 -20.155   8.164  -8.016
  229    HB   VAL  34            HB      VAL  34 -18.334   7.026 -10.203
  230   1HG1  VAL  34          3HG1      VAL  34 -20.763   8.811 -10.182
  231   2HG1  VAL  34          2HG1      VAL  34 -19.515   9.065 -11.408
  232   3HG1  VAL  34          1HG1      VAL  34 -20.352   7.502 -11.298
  233   1HG2  VAL  34          2HG2      VAL  34 -17.455   8.814  -8.485
  234   2HG2  VAL  34          1HG2      VAL  34 -17.225   9.107 -10.209
  235   3HG2  VAL  34          3HG2      VAL  34 -18.526   9.918  -9.343
  236    HA   PRO  35            HA      PRO  35 -22.187   4.100  -7.973
  237   1HB   PRO  35           2HB      PRO  35 -24.757   5.056  -7.623
  238   2HB   PRO  35           1HB      PRO  35 -23.603   4.772  -6.307
  239   1HG   PRO  35           2HG      PRO  35 -24.441   7.362  -7.547
  240   2HG   PRO  35           1HG      PRO  35 -23.887   7.036  -5.896
  241   1HD   PRO  35           2HD      PRO  35 -22.312   8.187  -7.913
  242   2HD   PRO  35           1HD      PRO  35 -21.683   7.419  -6.441
  243    H    GLY  36             H      GLY  36 -23.390   2.886  -9.394
  244   1HA   GLY  36           2HA      GLY  36 -24.887   2.575 -11.269
  245   2HA   GLY  36           1HA      GLY  36 -24.527   4.222 -11.786
  246    H    LYS  37             H      LYS  37 -21.505   3.399 -11.093
  247    HA   LYS  37            HA      LYS  37 -20.992   2.416 -13.843
  248   1HB   LYS  37           2HB      LYS  37 -19.427   3.940 -11.816
  249   2HB   LYS  37           1HB      LYS  37 -18.539   2.986 -13.002
  250   1HG   LYS  37           2HG      LYS  37 -18.793   4.798 -14.358
  251   2HG   LYS  37           1HG      LYS  37 -20.439   4.202 -14.577
  252   1HD   LYS  37           2HD      LYS  37 -21.009   5.552 -12.448
  253   2HD   LYS  37           1HD      LYS  37 -19.466   6.367 -12.713
  254   1HE   LYS  37           2HE      LYS  37 -20.617   7.751 -14.089
  255   2HE   LYS  37           1HE      LYS  37 -20.627   6.408 -15.232
  256   1HZ   LYS  37           3HZ      LYS  37 -22.710   5.653 -14.259
  257   2HZ   LYS  37           2HZ      LYS  37 -22.703   6.965 -13.179
  258   3HZ   LYS  37           1HZ      LYS  37 -22.854   7.235 -14.851
  259    H    THR  38             H      THR  38 -18.787   1.809 -11.063
  260    HA   THR  38            HA      THR  38 -19.304  -1.087 -11.093
  261    HB   THR  38            HB      THR  38 -17.034   0.172 -12.532
  262    HG1  THR  38           HG1      THR  38 -18.020  -0.680 -14.122
  263   1HG2  THR  38          3HG2      THR  38 -16.870  -2.406 -11.044
  264   2HG2  THR  38          2HG2      THR  38 -16.159  -2.363 -12.655
  265   3HG2  THR  38          1HG2      THR  38 -15.584  -1.249 -11.408
  266    H    PHE  39             H      PHE  39 -17.168   1.520 -10.012
  267    HA   PHE  39            HA      PHE  39 -15.606   0.108  -8.099
  268   1HB   PHE  39           2HB      PHE  39 -16.514   2.954  -8.185
  269   2HB   PHE  39           1HB      PHE  39 -15.288   2.321  -7.094
  270    HD1  PHE  39           HD2      PHE  39 -15.040   0.442 -10.115
  271    HD2  PHE  39           HD1      PHE  39 -14.082   4.275  -8.451
  272    HE1  PHE  39           HE2      PHE  39 -13.359   0.769 -11.854
  273    HE2  PHE  39           HE1      PHE  39 -12.397   4.576 -10.161
  274    HZ   PHE  39            HZ      PHE  39 -12.025   2.810 -11.883
  275    H    VAL  40             H      VAL  40 -18.671   1.732  -7.678
  276    HA   VAL  40            HA      VAL  40 -18.831   1.647  -4.869
  277    HB   VAL  40            HB      VAL  40 -20.364   3.055  -6.034
  278   1HG1  VAL  40          1HG1      VAL  40 -21.042   0.545  -7.550
  279   2HG1  VAL  40          3HG1      VAL  40 -22.152   1.919  -7.514
  280   3HG1  VAL  40          2HG1      VAL  40 -20.520   2.118  -8.170
  281   1HG2  VAL  40          1HG2      VAL  40 -21.206   1.211  -4.128
  282   2HG2  VAL  40          3HG2      VAL  40 -22.083   2.659  -4.626
  283   3HG2  VAL  40          2HG2      VAL  40 -22.445   1.108  -5.378
  284    H    ASN  41             H      ASN  41 -19.044  -0.887  -7.221
  285    HA   ASN  41            HA      ASN  41 -20.389  -2.765  -5.437
  286   1HB   ASN  41           2HB      ASN  41 -19.164  -2.995  -8.204
  287   2HB   ASN  41           1HB      ASN  41 -19.949  -4.309  -7.358
  288   1HD2  ASN  41          2HD2      ASN  41 -22.209  -1.490  -9.189
  289   2HD2  ASN  41          1HD2      ASN  41 -20.511  -1.427  -9.222
  290    H    ILE  42             H      ILE  42 -17.674  -1.434  -4.817
  291    HA   ILE  42            HA      ILE  42 -15.640  -3.447  -5.129
  292    HB   ILE  42            HB      ILE  42 -15.901  -0.690  -3.946
  293   1HG1  ILE  42          2HG1      ILE  42 -13.642  -1.949  -5.502
  294   2HG1  ILE  42          1HG1      ILE  42 -15.093  -1.370  -6.284
  295   1HG2  ILE  42          2HG2      ILE  42 -14.319  -2.675  -2.522
  296   2HG2  ILE  42          1HG2      ILE  42 -13.256  -1.479  -3.240
  297   3HG2  ILE  42          3HG2      ILE  42 -14.550  -0.986  -2.161
  298   1HD1  ILE  42          3HD1      ILE  42 -14.495   0.810  -4.823
  299   2HD1  ILE  42          2HD1      ILE  42 -12.867   0.155  -5.025
  300   3HD1  ILE  42          1HD1      ILE  42 -13.844   0.554  -6.454
  301    H    THR  43             H      THR  43 -15.211  -5.033  -3.767
  302    HA   THR  43            HA      THR  43 -16.540  -5.330  -1.085
  303    HB   THR  43            HB      THR  43 -16.310  -7.868  -1.812
  304    HG1  THR  43           HG1      THR  43 -16.428  -8.107  -4.069
  305   1HG2  THR  43          1HG2      THR  43 -18.270  -5.837  -2.729
  306   2HG2  THR  43          3HG2      THR  43 -18.419  -7.487  -3.328
  307   3HG2  THR  43          2HG2      THR  43 -18.491  -7.171  -1.596
  308    HA   PRO  44            HA      PRO  44 -12.464  -6.332   0.484
  309   1HB   PRO  44           2HB      PRO  44 -12.697  -8.663   1.801
  310   2HB   PRO  44           1HB      PRO  44 -13.200  -7.129   2.463
  311   1HG   PRO  44           2HG      PRO  44 -14.881  -9.334   1.350
  312   2HG   PRO  44           1HG      PRO  44 -15.296  -8.126   2.578
  313   1HD   PRO  44           2HD      PRO  44 -16.127  -8.022  -0.068
  314   2HD   PRO  44           1HD      PRO  44 -16.083  -6.628   1.009
  315    H    ALA  45             H      ALA  45 -13.665  -8.138  -1.925
  316    HA   ALA  45            HA      ALA  45 -11.501 -10.082  -2.160
  317   1HB   ALA  45           1HB      ALA  45 -14.055  -9.521  -3.562
  318   2HB   ALA  45           3HB      ALA  45 -12.769 -10.275  -4.510
  319   3HB   ALA  45           2HB      ALA  45 -13.378 -11.076  -3.061
  320    H    GLU  46             H      GLU  46 -12.890  -7.719  -4.304
  321    HA   GLU  46            HA      GLU  46 -10.554  -7.352  -5.885
  322   1HB   GLU  46           2HB      GLU  46 -11.754  -5.343  -6.787
  323   2HB   GLU  46           1HB      GLU  46 -12.748  -6.776  -6.791
  324   1HG   GLU  46           2HG      GLU  46 -14.127  -5.027  -5.959
  325   2HG   GLU  46           1HG      GLU  46 -13.666  -5.979  -4.554
  326    H    VAL  47             H      VAL  47 -11.632  -5.926  -2.859
  327    HA   VAL  47            HA      VAL  47  -9.556  -3.915  -2.784
  328    HB   VAL  47            HB      VAL  47 -11.928  -4.402  -1.189
  329   1HG1  VAL  47          1HG1      VAL  47 -10.202  -4.796   0.525
  330   2HG1  VAL  47          3HG1      VAL  47  -9.536  -3.229   0.085
  331   3HG1  VAL  47          2HG1      VAL  47 -11.148  -3.319   0.783
  332   1HG2  VAL  47          3HG2      VAL  47 -11.254  -2.409  -2.698
  333   2HG2  VAL  47          2HG2      VAL  47 -12.004  -2.037  -1.141
  334   3HG2  VAL  47          1HG2      VAL  47 -10.218  -1.925  -1.314
  335    H    GLY  48             H      GLY  48  -9.955  -7.208  -1.878
  336   1HA   GLY  48           2HA      GLY  48  -7.967  -7.475   0.139
  337   2HA   GLY  48           1HA      GLY  48  -8.432  -8.744  -0.989
  338    H    VAL  49             H      VAL  49  -7.774  -7.164  -3.333
  339    HA   VAL  49            HA      VAL  49  -4.834  -7.546  -3.251
  340    HB   VAL  49            HB      VAL  49  -6.114  -8.619  -5.115
  341   1HG1  VAL  49          1HG1      VAL  49  -7.722  -6.761  -5.495
  342   2HG1  VAL  49          3HG1      VAL  49  -6.398  -5.744  -6.062
  343   3HG1  VAL  49          2HG1      VAL  49  -6.859  -7.185  -6.969
  344   1HG2  VAL  49          3HG2      VAL  49  -3.827  -6.718  -5.449
  345   2HG2  VAL  49          2HG2      VAL  49  -3.881  -8.473  -5.646
  346   3HG2  VAL  49          1HG2      VAL  49  -4.533  -7.427  -6.905
  347    H    LEU  50             H      LEU  50  -7.146  -5.030  -3.950
  348    HA   LEU  50            HA      LEU  50  -5.433  -2.957  -4.788
  349   1HB   LEU  50           2HB      LEU  50  -8.041  -3.197  -3.553
  350   2HB   LEU  50           1HB      LEU  50  -7.329  -1.662  -3.449
  351    HG   LEU  50            HG      LEU  50  -7.793  -3.165  -5.995
  352   1HD1  LEU  50          1HD1      LEU  50  -9.390  -1.063  -4.463
  353   2HD1  LEU  50          3HD1      LEU  50  -9.596  -1.327  -6.206
  354   3HD1  LEU  50          2HD1      LEU  50  -9.943  -2.635  -5.083
  355   1HD2  LEU  50          1HD2      LEU  50  -6.007  -1.260  -5.665
  356   2HD2  LEU  50          3HD2      LEU  50  -7.068  -1.229  -7.071
  357   3HD2  LEU  50          2HD2      LEU  50  -7.419  -0.206  -5.675
  358    H    VAL  51             H      VAL  51  -6.015  -4.341  -1.725
  359    HA   VAL  51            HA      VAL  51  -4.283  -2.358  -0.426
  360    HB   VAL  51            HB      VAL  51  -5.836  -2.102   1.361
  361   1HG1  VAL  51          3HG1      VAL  51  -7.434  -2.454  -1.166
  362   2HG1  VAL  51          2HG1      VAL  51  -8.012  -1.632   0.270
  363   3HG1  VAL  51          1HG1      VAL  51  -6.638  -0.983  -0.618
  364   1HG2  VAL  51          1HG2      VAL  51  -6.562  -4.843   0.735
  365   2HG2  VAL  51          3HG2      VAL  51  -6.844  -3.938   2.221
  366   3HG2  VAL  51          2HG2      VAL  51  -7.998  -3.839   0.893
  367    H    GLY  52             H      GLY  52  -4.863  -5.673  -1.002
  368   1HA   GLY  52           2HA      GLY  52  -4.110  -7.155   1.143
  369   2HA   GLY  52           1HA      GLY  52  -3.564  -7.530  -0.487
  370    H    LYS  53             H      LYS  53  -2.243  -7.750   2.092
  371    HA   LYS  53            HA      LYS  53  -0.157  -5.819   2.262
  372   1HB   LYS  53           2HB      LYS  53   0.720  -7.239   4.054
  373   2HB   LYS  53           1HB      LYS  53  -1.001  -6.942   4.248
  374   1HG   LYS  53           2HG      LYS  53  -1.130  -9.210   4.476
  375   2HG   LYS  53           1HG      LYS  53  -1.040  -9.202   2.715
  376   1HD   LYS  53           2HD      LYS  53   1.392  -9.465   2.802
  377   2HD   LYS  53           1HD      LYS  53   1.354  -9.397   4.563
  378   1HE   LYS  53           2HE      LYS  53   0.021 -11.444   4.646
  379   2HE   LYS  53           1HE      LYS  53  -0.048 -11.497   2.884
  380   1HZ   LYS  53           3HZ      LYS  53   2.508 -11.431   3.068
  381   2HZ   LYS  53           2HZ      LYS  53   2.255 -11.951   4.666
  382   3HZ   LYS  53           1HZ      LYS  53   1.704 -12.895   3.363
  383    H    ASP  54             H      ASP  54  -0.479  -8.347   0.125
  384    HA   ASP  54            HA      ASP  54   1.933  -9.649   0.048
  385   1HB   ASP  54           2HB      ASP  54  -0.213  -9.916  -1.409
  386   2HB   ASP  54           1HB      ASP  54   0.692  -8.918  -2.528
  387    NH1  ARG  55           NH1      ARG  55   8.099  -5.286   3.970
  388    NH2  ARG  55           NH2      ARG  55  10.089  -4.914   2.962
  389    H    ARG  55             H      ARG  55   3.860  -9.104  -0.616
  390    HA   ARG  55            HA      ARG  55   4.442  -6.346  -1.179
  391   1HB   ARG  55           2HB      ARG  55   5.488  -8.090   0.613
  392   2HB   ARG  55           1HB      ARG  55   6.665  -8.207  -0.693
  393   1HG   ARG  55           2HG      ARG  55   7.132  -5.859  -0.605
  394   2HG   ARG  55           1HG   63  -5.219  -5.705  -8.213
  451   1HB   LEU  63           2HB      LEU  63  -5.741  -2.791  -8.923
  452   2HB   LEU  63           1HB      LEU  63  -6.161  -3.547  -7.385
  453    HG   LEU  63            HG      LEU  63  -3.330  -3.317  -8.457
  454   1HD1  LEU  63          1HD1      LEU  63  -5.032  -1.291  -7.452
  455   2HD1  LEU  63          3HD1      LEU  63  -3.990  -1.734  -6.102
  456   3HD1  LEU  63          2HD1      LEU  63  -3.294  -1.207  -7.628
  457   1HD2  LEU  63          2HD2      LEU  63  -4.694  -4.379  -5.995
  458   2HD2  LEU  63          1HD2      LEU  63  -3.350  -5.070  -6.914
  459   3HD2  LEU  63          3HD2      LEU  63  -3.074  -3.688  -5.853
  460    H    THR  64             H      THR  64  -7.753  -4.356  -7.874
  461    HA   THR  64            HA      THR  64  -9.364  -4.829 -10.206
  462    HB   THR  64            HB      THR  64 -10.749  -6.536  -8.925
  463    HG1  THR  64           HG1      THR  64  -9.366  -7.729  -7.422
  464   1HG2  THR  64          2HG2      THR  64  -9.100  -6.937 -10.837
  465   2HG2  THR  64          1HG2      THR  64  -7.969  -7.494  -9.589
  466   3HG2  THR  64          3HG2      THR  64  -9.514  -8.327  -9.835
  467    H    LEU  65             H      LEU  65 -10.954  -3.452 -10.047
  468    HA   LEU  65            HA      LEU  65 -12.006  -2.675  -7.429
  469   1HB   LEU  65           2HB      LEU  65 -12.228  -0.310  -8.546
  470   2HB   LEU  65           1HB      LEU  65 -10.835  -0.778  -7.626
  471    HG   LEU  65            HG      LEU  65  -9.660  -1.397  -9.712
  472   1HD1  LEU  65          1HD1      LEU  65 -12.253  -0.530 -10.890
  473   2HD1  LEU  65          3HD1      LEU  65 -10.778  -0.338 -11.809
  474   3HD1  LEU  65          2HD1      LEU  65 -11.286  -1.932 -11.272
  475   1HD2  LEU  65          2HD2      LEU  65 -10.668   1.337  -9.080
  476   2HD2  LEU  65          1HD2      LEU  65  -9.009   0.725  -9.135
  477   3HD2  LEU  65          3HD2      LEU  65  -9.845   1.129 -10.638
  478    H    GLY  66             H      GLY  66 -13.905  -3.616  -7.540
  479   1HA   GLY  66           2HA      GLY  66 -16.176  -3.812  -8.072
  480   2HA   GLY  66           1HA      GLY  66 -15.947  -2.563  -9.305
  481    H    GLY  67             H      GLY  67 -13.863  -5.381  -9.158
  482   1HA   GLY  67           2HA      GLY  67 -13.862  -7.363 -10.461
  483   2HA   GLY  67           1HA      GLY  67 -15.342  -6.815 -11.254
  484    H    GLN  68             H      GLN  68 -13.066  -4.221 -11.172
  485    HA   GLN  68            HA      GLN  68 -12.364  -4.852 -14.024
  486   1HB   GLN  68           2HB      GLN  68 -13.477  -2.813 -14.010
  487   2HB   GLN  68           1HB      GLN  68 -12.656  -2.337 -12.578
  488   1HG   GLN  68           2HG      GLN  68 -11.895  -1.164 -14.740
  489   2HG   GLN  68           1HG      GLN  68 -10.620  -1.809 -13.714
  490   1HE2  GLN  68          2HE2      GLN  68  -9.385  -3.413 -16.656
  491   2HE2  GLN  68          1HE2      GLN  68  -9.098  -2.230 -15.468
  492    H    LYS  69             H      LYS  69 -10.515  -5.924 -14.083
  493    HA   LYS  69            HA      LYS  69  -8.392  -5.686 -12.218
  494   1HB   LYS  69           2HB      LYS  69  -9.115  -7.472 -14.156
  495   2HB   LYS  69           1HB      LYS  69  -7.730  -6.682 -14.913
  496   1HG   LYS  69           2HG      LYS  69  -6.249  -7.484 -13.360
  497   2HG   LYS  69           1HG      LYS  69  -7.441  -7.466 -12.063
  498   1HD   LYS  69           2HD      LYS  69  -8.584  -9.386 -13.091
  499   2HD   LYS  69           1HD      LYS  69  -7.352  -9.428 -14.354
  500   1HE   LYS  69           2HE      LYS  69  -5.586  -9.823 -12.650
  501   2HE   LYS  69           1HE      LYS  69  -6.825  -9.787 -11.383
  502   1HZ   LYS  69           1HZ      LYS  69  -7.940 -11.613 -12.761
  503   2HZ   LYS  69           3HZ      LYS  69  -6.435 -11.786 -13.519
  504   3HZ   LYS  69           2HZ      LYS  69  -6.575 -12.030 -11.841
  505    H    CYS  70             H      CYS  70  -7.252  -3.775 -12.018
  506    HA   CYS  70            HA      CYS  70  -6.375  -2.403 -14.574
  507   1HB   CYS  70           2HB      CYS  70  -5.717  -0.561 -12.929
  508   2HB   CYS  70           1HB      CYS  70  -7.422  -0.808 -13.167
  509    HG   CYS  70            HG      CYS  70  -5.905  -1.774 -10.620
  510    H    SER  71             H      SER  71  -4.022  -1.268 -13.586
  511    HA   SER  71            HA      SER  71  -2.389  -3.548 -12.651
  512   1HB   SER  71           2HB      SER  71  -0.898  -3.356 -14.542
  513   2HB   SER  71           1HB      SER  71  -2.549  -3.706 -15.042
  514    HG   SER  71            HG      SER  71  -1.040  -1.384 -15.330
  515    H    VAL  72             H      VAL  72  -1.518  -2.634 -10.927
  516    HA   VAL  72            HA      VAL  72  -0.711  -0.054 -10.326
  517    HB   VAL  72            HB      VAL  72   0.963  -2.440  -9.721
  518   1HG1  VAL  72          2HG1      VAL  72   1.320   0.195  -9.078
  519   2HG1  VAL  72          1HG1      VAL  72   0.482  -0.430  -7.675
  520   3HG1  VAL  72          3HG1      VAL  72   1.991  -1.163  -8.175
  521   1HG2  VAL  72          3HG2      VAL  72  -1.651  -1.586  -8.582
  522   2HG2  VAL  72          2HG2      VAL  72  -1.162  -3.194  -9.097
  523   3HG2  VAL  72          1HG2      VAL  72  -0.516  -2.509  -7.619
  524    H    ILE  73             H      ILE  73   0.550   1.290 -11.220
  525    HA   ILE  73            HA      ILE  73   3.019   0.402 -12.447
  526    HB   ILE  73            HB      ILE  73   1.052   2.244 -13.666
  527   1HG1  ILE  73          2HG1      ILE  73   2.409   0.016 -15.113
  528   2HG1  ILE  73          1HG1      ILE  73   1.171  -0.413 -13.938
  529   1HG2  ILE  73          3HG2      ILE  73   3.972   2.044 -14.099
  530   2HG2  ILE  73          2HG2      ILE  73   2.953   2.263 -15.523
  531   3HG2  ILE  73          1HG2      ILE  73   2.928   3.459 -14.225
  532   1HD1  ILE  73          3HD1      ILE  73   0.724   1.516 -16.254
  533   2HD1  ILE  73          2HD1      ILE  73   0.252  -0.202 -16.303
  534   3HD1  ILE  73          1HD1      ILE  73  -0.504   0.916 -15.139
  535    NH1  ARG  74           NH1      ARG  74   5.323   5.833 -13.981
  536    NH2  ARG  74           NH2      ARG  74   6.417   7.751 -13.520
  537    H    ARG  74             H      ARG  74   3.476   0.994 -10.275
  538    HA   ARG  74            HA      ARG  74   5.173   2.372  -9.192
  539   1HB   ARG  74           2HB      ARG  74   3.354   4.549 -10.154
  540   2HB   ARG  74           1HB      ARG  74   4.454   4.806  -8.815
  541   1HG   ARG  74           2HG      ARG  74   6.295   3.916 -10.238
  542   2HG   ARG  74           1HG      ARG  74   5.174   3.916 -11.599
  543   1HD   ARG  74           2HD      ARG  74   4.776   6.400 -11.066
  544   2HD   ARG  74           1HD      ARG  74   6.210   6.285 -10.042
  545    HE   ARG  74            HE      ARG  74   7.501   5.691 -12.072
  546   1HH1  ARG  74          2HH1      ARG  74   5.083   4.893 -13.738
  547   2HH1  ARG  74          1HH1      ARG  74   4.962   6.240 -14.821
  548   1HH2  ARG  74          1HH2      ARG  74   7.017   8.286 -12.922
  549   2HH2  ARG  74          2HH2      ARG  74   6.065   8.153 -14.363
  550    H    ASP  75             H      ASP  75   4.125   0.736  -7.826
  551    HA   ASP  75            HA      ASP  75   1.871   1.490  -6.257
  552   1HB   ASP  75           2HB      ASP  75   1.935  -0.798  -6.225
  553   2HB   ASP  75           1HB      ASP  75   3.650  -0.829  -6.238
  554    H    SER  76             H      SER  76   2.065   3.428  -5.315
  555    HA   SER  76            HA      SER  76   4.239   3.509  -3.227
  556   1HB   SER  76           2HB      SER  76   3.513   6.204  -3.742
  557   2HB   SER  76           1HB      SER  76   5.002   5.431  -4.203
  558    HG   SER  76            HG      SER  76   4.376   5.587  -6.177
  559    H    LEU  77             H      LEU  77   1.276   2.657  -3.414
  560    HA   LEU  77            HA      LEU  77  -0.711   4.012  -2.153
  561   1HB   LEU  77           2HB      LEU  77  -0.295   1.473  -2.767
  562   2HB   LEU  77           1HB      LEU  77  -0.016   1.318  -1.053
  563    HG   LEU  77            HG      LEU  77  -2.228   2.287  -0.647
  564   1HD1  LEU  77          3HD1      LEU  77  -2.225   2.426  -3.660
  565   2HD1  LEU  77          2HD1      LEU  77  -3.749   2.300  -2.768
  566   3HD1  LEU  77          1HD1      LEU  77  -2.687   3.685  -2.501
  567   1HD2  LEU  77          3HD2      LEU  77  -2.156  -0.067  -2.535
  568   2HD2  LEU  77          2HD2      LEU  77  -2.037  -0.131  -0.776
  569   3HD2  LEU  77          1HD2      LEU  77  -3.549   0.360  -1.541
  570    H    LEU  78             H      LEU  78   1.573   2.137  -0.119
  571    HA   LEU  78            HA      LEU  78   0.862   4.052   2.020
  572   1HB   LEU  78           2HB      LEU  78   2.018   1.516   2.776
  573   2HB   LEU  78           1HB      LEU  78   0.805   2.415   3.596
  574    HG   LEU  78            HG      LEU  78  -0.485   1.701   1.260
  575   1HD1  LEU  78          1HD1      LEU  78   1.378  -0.546   2.069
  576   2HD1  LEU  78          3HD1      LEU  78  -0.078  -0.793   1.102
  577   3HD1  LEU  78          2HD1      LEU  78   1.232   0.212   0.482
  578   1HD2  LEU  78          1HD2      LEU  78  -0.402   0.540   4.028
  579   2HD2  LEU  78          3HD2      LEU  78  -1.690   1.450   3.238
  580   3HD2  LEU  78          2HD2      LEU  78  -1.401  -0.233   2.795
  581    H    GLN  79             H      GLN  79   2.862   4.962   0.339
  582    HA   GLN  79            HA      GLN  79   5.272   4.623   2.030
  583   1HB   GLN  79           2HB      GLN  79   6.584   5.254   0.099
  584   2HB   GLN  79           1HB      GLN  79   5.572   3.913  -0.341
  585   1HG   GLN  79           2HG      GLN  79   4.559   5.102  -1.882
  586   2HG   GLN  79           1HG      GLN  79   4.316   6.455  -0.837
  587   1HE2  GLN  79          2HE2      GLN  79   7.533   6.317  -3.319
  588   2HE2  GLN  79          1HE2      GLN  79   6.542   4.961  -3.088
  589    H    ASP  80             H      ASP  80   3.543   6.005   3.121
  590    HA   ASP  80            HA      ASP  80   2.434   8.271   3.029
  591   1HB   ASP  80           2HB      ASP  80   3.309   7.180   5.176
  592   2HB   ASP  80           1HB      ASP  80   4.705   8.244   5.004
  593    H    GLY  81             H      GLY  81   2.581   9.980   2.047
  594   1HA   GLY  81           2HA      GLY  81   3.531  12.195   1.573
  595   2HA   GLY  81           1HA      GLY  81   5.136  11.468   1.624
  596    H    GLU  82             H      GLU  82   2.653   9.642   0.118
  597    HA   GLU  82            HA      GLU  82   2.897  10.567  -2.515
  598   1HB   GLU  82           2HB      GLU  82   4.363   8.228  -1.543
  599   2HB   GLU  82           1HB      GLU  82   3.592   8.121  -3.077
  600   1HG   GLU  82           2HG      GLU  82   5.712  10.087  -2.259
  601   2HG   GLU  82           1HG      GLU  82   5.845   8.777  -3.445
  602    H    PHE  83             H      PHE  83   2.364   7.474  -0.863
  603    HA   PHE  83            HA      PHE  83   0.600   5.952  -1.150
  604   1HB   PHE  83           2HB      PHE  83  -1.743   7.172  -0.901
  605   2HB   PHE  83           1HB      PHE  83  -0.713   6.794   0.413
  606    HD1  PHE  83           HD1      PHE  83   1.057   8.617   1.089
  607    HD2  PHE  83           HD2      PHE  83  -2.454   9.336  -1.296
  608    HE1  PHE  83           HE1      PHE  83   1.150  11.077   1.607
  609    HE2  PHE  83           HE2      PHE  83  -2.331  11.757  -0.780
  610    HZ   PHE  83            HZ      PHE  83  -0.528  12.624   0.674
  611    H    SER  84             H      SER  84   1.202   7.630  -3.844
  612    HA   SER  84            HA      SER  84  -1.402   7.154  -5.116
  613   1HB   SER  84           2HB      SER  84  -0.118   8.227  -7.119
  614   2HB   SER  84           1HB      SER  84  -0.658   9.239  -5.779
  615    HG   SER  84            HG      SER  84   1.420   9.771  -5.857
  616    H    MET  85             H      MET  85  -1.743   5.679  -6.614
  617    HA   MET  85            HA      MET  85   0.562   3.894  -7.378
  618   1HB   MET  85           2HB      MET  85  -1.086   3.180  -5.496
  619   2HB   MET  85           1HB      MET  85  -2.150   2.940  -6.803
  620   1HG   MET  85           2HG      MET  85  -1.187   1.039  -7.443
  621   2HG   MET  85           1HG      MET  85   0.398   1.727  -7.277
  622   1HE   MET  85           3HE      MET  85  -1.657  -0.744  -6.600
  623   2HE   MET  85           2HE      MET  85  -0.113  -1.465  -6.051
  624   3HE   MET  85           1HE      MET  85  -1.465  -1.327  -4.922
  625    H    ASP  86             H      ASP  86   0.702   3.899  -9.660
  626    HA   ASP  86            HA      ASP  86  -1.674   4.904 -11.107
  627   1HB   ASP  86           2HB      ASP  86   1.147   4.350 -11.676
  628   2HB   ASP  86           1HB      ASP  86   0.031   4.295 -13.013
  629    H    LEU  87             H      LEU  87  -3.026   2.913 -10.511
  630    HA   LEU  87            HA      LEU  87  -2.168   0.585 -12.048
  631   1HB   LEU  87           2HB      LEU  87  -4.367  -0.456 -11.035
  632   2HB   LEU  87           1HB      LEU  87  -2.851  -0.486 -10.204
  633    HG   LEU  87            HG      LEU  87  -4.702   0.097  -8.719
  634   1HD1  LEU  87          2HD1      LEU  87  -2.295   1.540  -9.005
  635   2HD1  LEU  87          1HD1      LEU  87  -3.555   2.660  -8.489
  636   3HD1  LEU  87          3HD1      LEU  87  -3.224   1.215  -7.542
  637   1HD2  LEU  87          1HD2      LEU  87  -5.825   1.394 -10.734
  638   2HD2  LEU  87          3HD2      LEU  87  -6.181   1.790  -9.064
  639   3HD2  LEU  87          2HD2      LEU  87  -5.029   2.764  -9.972
  640    NH1  ARG  88           NH1      ARG  88   0.170   1.069 -20.800
  641    NH2  ARG  88           NH2      ARG  88   0.606   2.983 -19.674
  642    H    ARG  88             H      ARG  88  -2.575   0.535 -14.044
  643    HA   ARG  88            HA      ARG  88  -5.034   1.897 -15.006
  644   1HB   ARG  88           2HB      ARG  88  -3.874   2.586 -16.900
  645   2HB   ARG  88           1HB      ARG  88  -2.549   2.478 -15.786
  646   1HG   ARG  88           2HG      ARG  88  -1.773   0.373 -16.774
  647   2HG   ARG  88           1HG      ARG  88  -3.270   0.153 -17.703
  648   1HD   ARG  88           2HD      ARG  88  -2.542   1.451 -19.357
  649   2HD   ARG  88           1HD      ARG  88  -2.059   2.753 -18.233
  650    HE   ARG  88            HE      ARG  88  -0.100   0.731 -18.051
  651   1HH1  ARG  88          2HH1      ARG  88  -0.244   0.160 -20.833
  652   2HH1  ARG  88          1HH1      ARG  88   0.653   1.427 -21.599
  653   1HH2  ARG  88          1HH2      ARG  88   0.526   3.538 -18.845
  654   2HH2  ARG  88          2HH2      ARG  88   1.090   3.342 -20.471
  655    H    THR  89             H      THR  89  -6.315   1.046 -16.591
  656    HA   THR  89            HA      THR  89  -6.683  -1.817 -16.570
  657    HB   THR  89            HB      THR  89  -8.557  -1.382 -17.951
  658    HG1  THR  89           HG1      THR  89  -7.983  -0.377 -19.685
  659   1HG2  THR  89          1HG2      THR  89  -8.293   0.128 -15.727
  660   2HG2  THR  89          3HG2      THR  89  -8.577   1.380 -16.945
  661   3HG2  THR  89          2HG2      THR  89  -9.757   0.084 -16.702
  662    H    LYS  90             H      LYS  90  -5.127  -3.021 -17.662
  663    HA   LYS  90            HA      LYS  90  -3.929  -1.840 -20.022
  664   1HB   LYS  90           2HB      LYS  90  -2.967  -4.462 -19.065
  665   2HB   LYS  90           1HB      LYS  90  -2.111  -3.043 -19.619
  666   1HG   LYS  90           2HG      LYS  90  -2.745  -1.935 -17.449
  667   2HG   LYS  90           1HG      LYS  90  -3.090  -3.580 -16.878
  668   1HD   LYS  90           2HD      LYS  90  -0.526  -3.231 -18.405
  669   2HD   LYS  90           1HD      LYS  90  -0.560  -2.499 -16.818
  670   1HE   LYS  90           2HE      LYS  90  -0.065  -4.550 -15.985
  671   2HE   LYS  90           1HE      LYS  90  -1.712  -5.020 -16.414
  672   1HZ   LYS  90           2HZ      LYS  90  -0.855  -5.559 -18.662
  673   2HZ   LYS  90           1HZ      LYS  90   0.721  -5.282 -18.093
  674   3HZ   LYS  90           3HZ      LYS  90  -0.207  -6.538 -17.434
  675    H    SER  91             H      SER  91  -4.384  -2.703 -21.989
  676    HA   SER  91            HA      SER  91  -6.265  -4.999 -22.095
  677   1HB   SER  91           2HB      SER  91  -6.927  -2.586 -22.821
  678   2HB   SER  91           1HB      SER  91  -6.147  -3.032 -24.298
  679    HG   SER  91            HG      SER  91  -8.515  -3.842 -23.225
  680    H    THR  92             H      THR  92  -6.301  -5.474 -24.741
  681    HA   THR  92            HA      THR  92  -3.798  -6.942 -25.085
  682    HB   THR  92            HB      THR  92  -4.934  -8.082 -26.872
  683    HG1  THR  92           HG1      THR  92  -7.014  -7.289 -27.543
  684   1HG2  THR  92          2HG2      THR  92  -6.785  -7.397 -24.555
  685   2HG2  THR  92          1HG2      THR  92  -7.134  -8.672 -25.742
  686   3HG2  THR  92          3HG2      THR  92  -5.709  -8.798 -24.704
  687    H    GLY  93             H      GLY  93  -3.454  -7.031 -27.795
  688   1HA   GLY  93           2HA      GLY  93  -1.746  -4.878 -28.377
  689   2HA   GLY  93           1HA      GLY  93  -2.426  -5.940 -29.600
  690    H    GLY  94             H      GLY  94  -4.649  -5.347 -30.426
  691   1HA   GLY  94           2HA      GLY  94  -4.744  -2.473 -31.003
  692   2HA   GLY  94           1HA      GLY  94  -5.807  -3.699 -31.689
  693    H    ALA  95             H      ALA  95  -5.533  -3.537 -28.178
  694    HA   ALA  95            HA      ALA  95  -8.329  -2.566 -28.078
  695   1HB   ALA  95           3HB      ALA  95  -6.612  -4.175 -26.241
  696   2HB   ALA  95           2HB      ALA  95  -7.887  -3.158 -25.540
  697   3HB   ALA  95           1HB      ALA  95  -8.296  -4.418 -26.722
  698    HA   PRO  96            HA      PRO  96  -7.072   1.199 -26.233
  699   1HB   PRO  96           2HB      PRO  96  -9.411   1.913 -25.094
  700   2HB   PRO  96           1HB      PRO  96  -9.211   1.842 -26.854
  701   1HG   PRO  96           2HG      PRO  96 -10.721  -0.017 -25.087
  702   2HG   PRO  96           1HG      PRO  96 -10.914   0.273 -26.812
  703   1HD   PRO  96           2HD      PRO  96  -9.530  -1.900 -25.563
  704   2HD   PRO  96           1HD      PRO  96  -9.689  -1.548 -27.298
  705    H    THR  97             H      THR  97  -5.898   1.481 -24.391
  706    HA   THR  97            HA      THR  97  -6.654   0.011 -21.895
  707    HB   THR  97            HB      THR  97  -4.481   0.884 -21.005
  708    HG1  THR  97           HG1      THR  97  -3.139   2.015 -22.450
  709   1HG2  THR  97          2HG2      THR  97  -4.854  -1.072 -22.964
  710   2HG2  THR  97          1HG2      THR  97  -3.497  -0.105 -23.568
  711   3HG2  THR  97          3HG2      THR  97  -3.407  -0.829 -21.959
  712    H    PHE  98             H      PHE  98  -6.337   1.418 -19.926
  713    HA   PHE  98            HA      PHE  98  -7.101   4.249 -20.079
  714   1HB   PHE  98           2HB      PHE  98  -8.881   2.022 -19.128
  715   2HB   PHE  98           1HB      PHE  98  -9.072   3.689 -18.642
  716    HD1  PHE  98           HD1      PHE  98  -8.650   5.418 -20.766
  717    HD2  PHE  98           HD2      PHE  98 -10.256   1.429 -20.961
  718    HE1  PHE  98           HE1      PHE  98  -9.819   6.045 -22.838
  719    HE2  PHE  98           HE2      PHE  98 -11.411   2.012 -23.083
  720    HZ   PHE  98            HZ      PHE  98 -11.193   4.286 -24.039
  721    H    ASN  99             H      ASN  99  -7.182   5.119 -17.719
  722    HA   ASN  99            HA      ASN  99  -5.392   3.428 -16.052
  723   1HB   ASN  99           2HB      ASN  99  -4.605   6.297 -16.324
  724   2HB   ASN  99           1HB      ASN  99  -3.602   4.895 -15.945
  725   1HD2  ASN  99          2HD2      ASN  99  -2.388   4.924 -19.230
  726   2HD2  ASN  99          1HD2      ASN  99  -2.058   4.904 -17.567
  727    H    VAL 100             H      VAL 100  -5.091   4.082 -13.885
  728    HA   VAL 100            HA      VAL 100  -7.116   5.891 -12.691
  729    HB   VAL 100            HB      VAL 100  -6.441   3.144 -11.545
  730   1HG1  VAL 100          3HG1      VAL 100  -7.567   5.211 -10.344
  731   2HG1  VAL 100          2HG1      VAL 100  -9.013   4.560 -11.096
  732   3HG1  VAL 100          1HG1      VAL 100  -8.058   3.563 -10.006
  733   1HG2  VAL 100          1HG2      VAL 100  -8.537   3.899 -13.592
  734   2HG2  VAL 100          3HG2      VAL 100  -7.503   2.470 -13.541
  735   3HG2  VAL 100          2HG2      VAL 100  -8.865   2.615 -12.429
  736    H    THR 101             H      THR 101  -6.357   6.734 -10.684
  737    HA   THR 101            HA      THR 101  -3.634   5.927  -9.816
  738    HB   THR 101            HB      THR 101  -4.907   8.714  -9.952
  739    HG1  THR 101           HG1      THR 101  -3.443   8.822 -11.431
  740   1HG2  THR 101          2HG2      THR 101  -4.188   8.338  -7.591
  741   2HG2  THR 101          1HG2      THR 101  -2.582   7.883  -8.160
  742   3HG2  THR 101          3HG2      THR 101  -3.174   9.524  -8.368
  743    H    VAL 102             H      VAL 102  -3.693   5.271  -7.742
  744    HA   VAL 102            HA      VAL 102  -6.210   5.667  -6.230
  745    HB   VAL 102            HB      VAL 102  -4.540   3.253  -6.845
  746   1HG1  VAL 102          2HG1      VAL 102  -6.069   3.752  -4.269
  747   2HG1  VAL 102          1HG1      VAL 102  -6.012   2.133  -4.965
  748   3HG1  VAL 102          3HG1      VAL 102  -4.521   2.938  -4.491
  749   1HG2  VAL 102          2HG2      VAL 102  -7.410   4.083  -6.850
  750   2HG2  VAL 102          1HG2      VAL 102  -6.433   3.494  -8.161
  751   3HG2  VAL 102          3HG2      VAL 102  -6.978   2.383  -6.917
  752    H    THR 103             H      THR 103  -5.942   6.851  -4.470
  753    HA   THR 103            HA      THR 103  -3.248   7.177  -3.273
  754    HB   THR 103            HB      THR 103  -4.316   9.241  -2.228
  755    HG1  THR 103           HG1      THR 103  -6.074  10.002  -3.508
  756   1HG2  THR 103          1HG2      THR 103  -2.862   8.863  -4.475
  757   2HG2  THR 103          3HG2      THR 103  -4.310   9.622  -5.176
  758   3HG2  THR 103          2HG2      THR 103  -3.381  10.449  -3.909
  759    H    LYS 104             H      LYS 104  -3.015   5.889  -1.539
  760    HA   LYS 104            HA      LYS 104  -5.253   5.206   0.224
  761   1HB   LYS 104           2HB      LYS 104  -3.775   3.438  -0.405
  762   2HB   LYS 104           1HB      LYS 104  -2.363   4.364   0.037
  763   1HG   LYS 104           2HG      LYS 104  -2.709   2.767   1.803
  764   2HG   LYS 104           1HG      LYS 104  -3.217   4.322   2.441
  765   1HD   LYS 104           2HD      LYS 104  -5.150   3.306   2.971
  766   2HD   LYS 104           1HD      LYS 104  -5.521   3.385   1.257
  767   1HE   LYS 104           2HE      LYS 104  -4.481   1.058   2.855
  768   2HE   LYS 104           1HE      LYS 104  -5.829   1.113   1.733
  769   1HZ   LYS 104           3HZ      LYS 104  -4.006   1.576  -0.002
  770   2HZ   LYS 104           2HZ      LYS 104  -2.950   0.929   1.155
  771   3HZ   LYS 104           1HZ      LYS 104  -4.227  -0.006   0.546
  772    H    THR 105             H      THR 105  -5.703   6.467   1.929
  773    HA   THR 105            HA      THR 105  -3.733   8.378   3.008
  774    HB   THR 105            HB      THR 105  -5.596   9.155   4.391
  775    HG1  THR 105           HG1      THR 105  -7.386   7.999   4.631
  776   1HG2  THR 105          1HG2      THR 105  -5.752   8.904   1.495
  777   2HG2  THR 105          3HG2      THR 105  -7.358   8.983   2.216
  778   3HG2  THR 105          2HG2      THR 105  -6.197  10.270   2.522
  779    H    ASP 106             H      ASP 106  -5.007   7.874   5.816
  780    HA   ASP 106            HA      ASP 106  -3.124   5.727   6.571
  781   1HB   ASP 106           2HB      ASP 106  -3.219   7.901   7.824
  782   2HB   ASP 106           1HB      ASP 106  -4.837   7.451   8.369
  783    H    LYS 107             H      LYS 107  -6.585   6.315   6.275
  784    HA   LYS 107            HA      LYS 107  -7.090   3.467   6.978
  785   1HB   LYS 107           2HB      LYS 107  -8.811   5.639   8.204
  786   2HB   LYS 107           1HB      LYS 107  -8.767   3.925   8.616
  787   1HG   LYS 107           2HG      LYS 107  -6.525   4.154   9.538
  788   2HG   LYS 107           1HG      LYS 107  -6.456   5.836   9.018
  789   1HD   LYS 107           2HD      LYS 107  -8.753   5.890  10.465
  790   2HD   LYS 107           1HD      LYS 107  -7.860   4.644  11.340
  791   1HE   LYS 107           2HE      LYS 107  -6.372   7.129  10.594
  792   2HE   LYS 107           1HE      LYS 107  -7.548   7.251  11.902
  793   1HZ   LYS 107           1HZ      LYS 107  -6.446   5.366  12.982
  794   2HZ   LYS 107           3HZ      LYS 107  -5.285   5.328  11.746
  795   3HZ   LYS 107           2HZ      LYS 107  -5.389   6.680  12.774
  796    H    THR 108             H      THR 108  -7.323   5.411   4.545
  797    HA   THR 108            HA      THR 108 -10.044   4.496   3.751
  798    HB   THR 108            HB      THR 108 -10.706   6.605   2.930
  799    HG1  THR 108           HG1      THR 108  -8.845   7.194   1.856
  800   1HG2  THR 108          1HG2      THR 108 -10.643   6.461   5.433
  801   2HG2  THR 108          3HG2      THR 108  -9.069   7.262   5.404
  802   3HG2  THR 108          2HG2      THR 108 -10.504   8.120   4.835
  803    H    LEU 109             H      LEU 109 -10.150   4.003   1.537
  804    HA   LEU 109            HA      LEU 109  -7.556   3.693   0.141
  805   1HB   LEU 109           2HB      LEU 109  -9.313   1.782   0.956
  806   2HB   LEU 109           1HB      LEU 109 -10.006   2.092  -0.615
  807    HG   LEU 109            HG      LEU 109  -7.987   0.309   0.002
  808   1HD1  LEU 109          3HD1      LEU 109  -9.217   1.346  -2.445
  809   2HD1  LEU 109          2HD1      LEU 109  -7.763   0.363  -2.628
  810   3HD1  LEU 109          1HD1      LEU 109  -9.169  -0.288  -1.789
  811   1HD2  LEU 109          1HD2      LEU 109  -6.353   2.103   0.078
  812   2HD2  LEU 109          3HD2      LEU 109  -6.026   0.962  -1.211
  813   3HD2  LEU 109          2HD2      LEU 109  -6.746   2.526  -1.579
  814    H    VAL 110             H      VAL 110  -7.841   6.005  -0.849
  815    HA   VAL 110            HA      VAL 110 -10.302   6.482  -2.337
  816    HB   VAL 110            HB      VAL 110  -7.764   8.082  -1.820
  817   1HG1  VAL 110          3HG1      VAL 110  -9.738   8.470  -4.042
  818   2HG1  VAL 110          2HG1      VAL 110  -9.022   9.883  -3.270
  819   3HG1  VAL 110          1HG1      VAL 110  -7.997   8.695  -4.061
  820   1HG2  VAL 110          3HG2      VAL 110 -10.451   8.018  -0.802
  821   2HG2  VAL 110          2HG2      VAL 110  -9.113   9.054  -0.294
  822   3HG2  VAL 110          1HG2      VAL 110 -10.204   9.591  -1.590
  823    H    LEU 111             H      LEU 111 -10.483   6.496  -4.522
  824    HA   LEU 111            HA      LEU 111  -8.181   5.650  -6.125
  825   1HB   LEU 111           2HB      LEU 111 -10.909   4.558  -6.798
  826   2HB   LEU 111           1HB      LEU 111  -9.339   3.926  -7.259
  827    HG   LEU 111            HG      LEU 111 -10.525   3.810  -4.487
  828   1HD1  LEU 111          3HD1      LEU 111 -11.507   2.308  -6.337
  829   2HD1  LEU 111          2HD1      LEU 111  -9.949   1.469  -6.300
  830   3HD1  LEU 111          1HD1      LEU 111 -10.971   1.512  -4.856
  831   1HD2  LEU 111          3HD2      LEU 111  -7.916   3.829  -5.005
  832   2HD2  LEU 111          2HD2      LEU 111  -8.607   2.928  -3.685
  833   3HD2  LEU 111          1HD2      LEU 111  -8.232   2.117  -5.207
  834    H    LEU 112             H      LEU 112  -8.344   6.448  -8.262
  835    HA   LEU 112            HA      LEU 112 -10.480   8.373  -8.858
  836   1HB   LEU 112           2HB      LEU 112  -8.538   9.707  -8.093
  837   2HB   LEU 112           1HB      LEU 112  -7.508   8.764  -9.110
  838    HG   LEU 112            HG      LEU 112  -8.168   9.830 -11.071
  839   1HD1  LEU 112          1HD1      LEU 112 -10.770   9.984  -9.826
  840   2HD1  LEU 112          3HD1      LEU 112 -10.346  11.475 -10.664
  841   3HD1  LEU 112          2HD1      LEU 112 -10.339   9.943 -11.534
  842   1HD2  LEU 112          2HD2      LEU 112  -7.031  11.341  -9.471
  843   2HD2  LEU 112          1HD2      LEU 112  -7.977  12.164 -10.713
  844   3HD2  LEU 112          3HD2      LEU 112  -8.610  12.010  -9.070
  845    H    MET 113             H      MET 113 -11.349   7.203 -10.476
  846    HA   MET 113            HA      MET 113  -9.389   5.958 -12.431
  847   1HB   MET 113           2HB      MET 113 -11.144   4.508 -11.510
  848   2HB   MET 113           1HB      MET 113 -12.357   5.494 -12.292
  849   1HG   MET 113           2HG      MET 113 -10.663   4.944 -14.376
  850   2HG   MET 113           1HG      MET 113 -10.509   3.480 -13.428
  851   1HE   MET 113           3HE      MET 113 -11.824   1.641 -13.565
  852   2HE   MET 113           2HE      MET 113 -13.135   1.433 -14.725
  853   3HE   MET 113           1HE      MET 113 -11.539   1.926 -15.294
  854    H    GLY 114             H      GLY 114  -9.452   6.452 -14.551
  855   1HA   GLY 114           2HA      GLY 114 -11.356   8.253 -15.536
  856   2HA   GLY 114           1HA      GLY 114  -9.850   9.011 -15.217
  857    H    LYS 115             H      LYS 115 -11.329   8.573 -17.767
  858    HA   LYS 115            HA      LYS 115  -9.078   7.552 -19.158
  859   1HB   LYS 115           2HB      LYS 115 -11.793   6.552 -19.637
  860   2HB   LYS 115           1HB      LYS 115 -10.350   5.847 -20.141
  861   1HG   LYS 115           2HG      LYS 115  -9.917   5.027 -17.875
  862   2HG   LYS 115           1HG      LYS 115 -11.326   5.900 -17.317
  863   1HD   LYS 115           2HD      LYS 115 -12.785   4.618 -18.773
  864   2HD   LYS 115           1HD      LYS 115 -11.413   3.742 -19.419
  865   1HE   LYS 115           2HE      LYS 115 -11.315   3.521 -16.577
  866   2HE   LYS 115           1HE      LYS 115 -12.956   3.139 -17.104
  867   1HZ   LYS 115           2HZ      LYS 115 -11.575   1.817 -18.936
  868   2HZ   LYS 115           1HZ      LYS 115 -10.466   1.749 -17.654
  869   3HZ   LYS 115           3HZ      LYS 115 -12.027   1.128 -17.449
  870    H    GLU 116             H      GLU 116  -8.862   9.244 -20.665
  871    HA   GLU 116            HA      GLU 116 -10.688   9.062 -22.946
  872   1HB   GLU 116           2HB      GLU 116 -10.294  11.322 -21.710
  873   2HB   GLU 116           1HB      GLU 116  -8.863  11.312 -22.656
  874   1HG   GLU 116           2HG      GLU 116 -10.381  10.823 -24.687
  875   2HG   GLU 116           1HG      GLU 116 -11.704  11.336 -23.636
  876    H    GLY 117             H      GLY 117  -9.030   7.076 -23.550
  877   1HA   GLY 117           2HA      GLY 117  -6.811   6.318 -24.211
  878   2HA   GLY 117           1HA      GLY 117  -6.626   7.963 -24.827
  879    H    VAL 118             H      VAL 118  -7.287   8.317 -21.462
  880    HA   VAL 118            HA      VAL 118  -5.572   9.888 -20.498
  881    HB   VAL 118            HB      VAL 118  -7.409   9.135 -19.220
  882   1HG1  VAL 118          3HG1      VAL 118  -6.552   6.588 -19.830
  883   2HG1  VAL 118          2HG1      VAL 118  -6.104   6.718 -18.131
  884   3HG1  VAL 118          1HG1      VAL 118  -7.765   6.986 -18.620
  885   1HG2  VAL 118          3HG2      VAL 118  -4.779   9.582 -18.105
  886   2HG2  VAL 118          2HG2      VAL 118  -6.328   9.864 -17.333
  887   3HG2  VAL 118          1HG2      VAL 118  -5.512   8.300 -17.122
  888    H    HIS 119             H      HIS 119  -3.737  10.202 -19.799
  889    HA   HIS 119            HA      HIS 119  -1.475   8.467 -20.383
  890   1HB   HIS 119           2HB      HIS 119  -1.464  10.985 -20.530
  891   2HB   HIS 119           1HB      HIS 119  -1.612  11.056 -18.771
  892    HD1  HIS 119           HD1      HIS 119   0.495   8.261 -19.928
  893    HD2  HIS 119           HD2      HIS 119   1.084  12.267 -18.938
  894    HE1  HIS 119           HE1      HIS 119   2.983   8.546 -19.541
  895    H    GLY 120             H      GLY 120  -2.805   9.915 -17.398
  896   1HA   GLY 120           2HA      GLY 120  -3.258   8.514 -15.402
  897   2HA   GLY 120           1HA      GLY 120  -1.825   7.562 -15.825
  898    H    GLY 121             H      GLY 121  -1.448  10.973 -16.298
  899   1HA   GLY 121           2HA      GLY 121   0.184  11.163 -13.797
  900   2HA   GLY 121           1HA      GLY 121   0.517  12.074 -15.269
  901    H    LEU 122             H      LEU 122  -2.294  12.700 -15.753
  902    HA   LEU 122            HA      LEU 122  -2.565  15.067 -14.007
  903   1HB   LEU 122           2HB      LEU 122  -4.824  14.260 -15.849
  904   2HB   LEU 122           1HB      LEU 122  -4.143  15.852 -15.574
  905    HG   LEU 122            HG      LEU 122  -2.191  14.210 -16.907
  906   1HD1  LEU 122          3HD1      LEU 122  -4.971  14.073 -17.972
  907   2HD1  LEU 122          2HD1      LEU 122  -3.611  14.110 -19.097
  908   3HD1  LEU 122          1HD1      LEU 122  -3.744  12.807 -17.910
  909   1HD2  LEU 122          1HD2      LEU 122  -2.990  16.835 -16.886
  910   2HD2  LEU 122          3HD2      LEU 122  -1.844  16.146 -18.038
  911   3HD2  LEU 122          2HD2      LEU 122  -3.549  16.287 -18.468
  912    H    ILE 123             H      ILE 123  -4.051  11.911 -14.548
  913    HA   ILE 123            HA      ILE 123  -6.219  12.265 -12.651
  914    HB   ILE 123            HB      ILE 123  -4.781   9.932 -13.906
  915   1HG1  ILE 123          2HG1      ILE 123  -7.617  11.055 -14.195
  916   2HG1  ILE 123          1HG1      ILE 123  -6.340  11.077 -15.414
  917   1HG2  ILE 123          3HG2      ILE 123  -6.248   9.770 -11.414
  918   2HG2  ILE 123          2HG2      ILE 123  -7.176   8.935 -12.648
  919   3HG2  ILE 123          1HG2      ILE 123  -5.514   8.456 -12.328
  920   1HD1  ILE 123          2HD1      ILE 123  -6.366   8.523 -15.313
  921   2HD1  ILE 123          1HD1      ILE 123  -7.849   8.668 -14.360
  922   3HD1  ILE 123          3HD1      ILE 123  -7.805   9.277 -16.015
  923    H    ASN 124             H      ASN 124  -2.851  11.174 -12.599
  924    HA   ASN 124            HA      ASN 124  -2.765  10.291  -9.925
  925   1HB   ASN 124           2HB      ASN 124  -0.989   9.846 -11.620
  926   2HB   ASN 124           1HB      ASN 124  -0.527  11.546 -11.488
  927   1HD2  ASN 124          2HD2      ASN 124   0.941   8.976  -8.818
  928   2HD2  ASN 124          1HD2      ASN 124   0.243   8.513 -10.291
  929    H    LYS 125             H      LYS 125  -2.774  13.425 -11.423
  930    HA   LYS 125            HA      LYS 125  -1.791  14.833  -8.934
  931   1HB   LYS 125           2HB      LYS 125  -1.596  16.679 -10.353
  932   2HB   LYS 125           1HB      LYS 125  -1.660  15.440 -11.608
  933   1HG   LYS 125           2HG      LYS 125  -3.250  16.832 -12.454
  934   2HG   LYS 125           1HG      LYS 125  -4.260  15.928 -11.361
  935   1HD   LYS 125           2HD      LYS 125  -4.808  18.073 -10.711
  936   2HD   LYS 125           1HD      LYS 125  -3.496  17.679  -9.589
  937   1HE   LYS 125           2HE      LYS 125  -1.893  18.876 -10.896
  938   2HE   LYS 125           1HE      LYS 125  -3.001  19.018 -12.259
  939   1HZ   LYS 125           1HZ      LYS 125  -4.471  20.234 -10.530
  940   2HZ   LYS 125           3HZ      LYS 125  -3.012  20.460  -9.701
  941   3HZ   LYS 125           2HZ      LYS 125  -3.193  21.063 -11.278
  942    H    LYS 126             H      LYS 126  -4.850  14.148 -10.576
  943    HA   LYS 126            HA      LYS 126  -6.517  15.767  -8.805
  944   1HB   LYS 126           2HB      LYS 126  -6.975  13.894 -11.091
  945   2HB   LYS 126           1HB      LYS 126  -8.320  14.161  -9.973
  946   1HG   LYS 126           2HG      LYS 126  -8.736  16.038 -11.182
  947   2HG   LYS 126           1HG      LYS 126  -7.364  16.733 -10.343
  948   1HD   LYS 126           2HD      LYS 126  -7.112  17.074 -12.742
  949   2HD   LYS 126           1HD      LYS 126  -5.898  15.954 -12.181
  950   1HE   LYS 126           2HE      LYS 126  -6.763  14.194 -13.337
  951   2HE   LYS 126           1HE      LYS 126  -8.418  14.726 -13.084
  952   1HZ   LYS 126           2HZ      LYS 126  -7.024  16.598 -14.717
  953   2HZ   LYS 126           1HZ      LYS 126  -6.898  15.037 -15.381
  954   3HZ   LYS 126           3HZ      LYS 126  -8.424  15.706 -15.073
  955    H    CYS 127             H      CYS 127  -5.196  12.595  -8.611
  956    HA   CYS 127            HA      CYS 127  -7.179  11.624  -6.667
  957   1HB   CYS 127           2HB      CYS 127  -5.758  10.224  -8.431
  958   2HB   CYS 127           1HB      CYS 127  -4.582  10.257  -7.137
  959    HG   CYS 127            HG      CYS 127  -6.551   9.256  -5.577
  960    OH   TYR 128            OH      TYR 128   1.654  16.086  -2.008
  961    H    TYR 128             H      TYR 128  -3.913  12.853  -6.963
  962    HA   TYR 128            HA      TYR 128  -3.068  12.483  -4.257
  963   1HB   TYR 128           2HB      TYR 128  -1.571  13.015  -6.164
  964   2HB   TYR 128           1HB      TYR 128  -2.345  14.580  -6.354
  965    HD1  TYR 128           HD1      TYR 128  -1.395  12.898  -3.144
  966    HD2  TYR 128           HD2      TYR 128  -0.602  16.022  -5.994
  967    HE1  TYR 128           HE1      TYR 128   0.238  13.894  -1.570
  968    HE2  TYR 128           HE2      TYR 128   1.032  17.036  -4.399
  969    HH   TYR 128            HH      TYR 128   2.524  15.759  -2.243
  970    H    GLU 129             H      GLU 129  -5.186  14.803  -5.918
  971    HA   GLU 129            HA      GLU 129  -5.336  16.672  -3.605
  972   1HB   GLU 129           2HB      GLU 129  -6.823  16.490  -6.242
  973   2HB   GLU 129           1HB      GLU 129  -7.196  17.704  -5.018
  974   1HG   GLU 129           2HG      GLU 129  -4.527  18.037  -5.143
  975   2HG   GLU 129           1HG      GLU 129  -4.811  17.461  -6.783
  976    H    MET 130             H      MET 130  -7.309  14.093  -5.079
  977    HA   MET 130            HA      MET 130  -9.710  14.331  -3.532
  978   1HB   MET 130           2HB      MET 130  -8.894  12.700  -5.542
  979   2HB   MET 130           1HB      MET 130  -8.615  11.605  -4.197
  980   1HG   MET 130           2HG      MET 130 -11.046  12.096  -3.487
  981   2HG   MET 130           1HG      MET 130 -11.244  12.851  -5.090
  982   1HE   MET 130           2HE      MET 130 -13.012  10.968  -4.171
  983   2HE   MET 130           1HE      MET 130 -13.213  10.798  -5.911
  984   3HE   MET 130           3HE      MET 130 -13.014   9.361  -4.894
  985    H    ALA 131             H      ALA 131  -6.673  12.624  -2.916
  986    HA   ALA 131            HA      ALA 131  -7.370  11.716  -0.232
  987   1HB   ALA 131           2HB      ALA 131  -4.848  11.621  -1.926
  988   2HB   ALA 131           1HB      ALA 131  -4.862  11.122  -0.225
  989   3HB   ALA 131           3HB      ALA 131  -5.869  10.272  -1.400
  990    H    SER 132             H      SER 132  -5.944  14.565  -1.704
  991    HA   SER 132            HA      SER 132  -4.373  15.518   0.476
  992   1HB   SER 132           2HB      SER 132  -5.949  17.006  -1.637
  993   2HB   SER 132           1HB      SER 132  -5.035  17.849  -0.404
  994    HG   SER 132            HG      SER 132  -3.514  17.588  -1.860
  995    H    HIS 133             H      HIS 133  -7.876  15.414  -0.118
  996    HA   HIS 133            HA      HIS 133  -8.446  16.993   2.305
  997   1HB   HIS 133           2HB      HIS 133 -10.041  16.858   0.309
  998   2HB   HIS 133           1HB      HIS 133 -10.519  15.256   0.944
  999    HD1  HIS 133           HD1      HIS 133 -12.169  15.273   2.816
 1000    HD2  HIS 133           HD2      HIS 133 -10.280  18.974   2.447
 1001    HE1  HIS 133           HE1      HIS 133 -13.248  16.807   4.525
 1002    H    LEU 134             H      LEU 134  -8.466  13.550   1.267
 1003    HA   LEU 134            HA      LEU 134  -9.439  12.645   3.857
 1004   1HB   LEU 134           2HB      LEU 134  -7.987  11.288   1.601
 1005   2HB   LEU 134           1HB      LEU 134  -8.401  10.439   3.080
 1006    HG   LEU 134            HG      LEU 134 -10.736  11.753   2.464
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.235  11.201  -0.006
 1008   2HD1  LEU 134          1HD1      LEU 134 -10.934  10.746  -0.001
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.469  12.411   0.319
 1010   1HD2  LEU 134          1HD2      LEU 134 -10.447   9.394   3.244
 1011   2HD2  LEU 134          3HD2      LEU 134 -11.622   9.552   1.938
 1012   3HD2  LEU 134          2HD2      LEU 134 -10.002   8.954   1.600
 1013    NH1  ARG 135           NH1      ARG 135  -2.189  13.058   7.292
 1014    NH2  ARG 135           NH2      ARG 135  -1.160  11.066   6.982
 1015    H    ARG 135             H      ARG 135  -6.518  14.016   3.023
 1016    HA   ARG 135            HA      ARG 135  -4.961  12.696   5.152
 1017   1HB   ARG 135           2HB      ARG 135  -4.342  14.575   2.892
 1018   2HB   ARG 135           1HB      ARG 135  -3.299  14.617   4.316
 1019   1HG   ARG 135           2HG      ARG 135  -3.962  11.926   3.225
 1020   2HG   ARG 135           1HG      ARG 135  -2.873  12.926   2.262
 1021   1HD   ARG 135           2HD      ARG 135  -1.449  11.707   3.725
 1022   2HD   ARG 135           1HD      ARG 135  -1.562  13.318   4.431
 1023    HE   ARG 135            HE      ARG 135  -3.487  11.324   5.442
 1024   1HH1  ARG 135          2HH1      ARG 135  -2.831  13.758   6.981
 1025   2HH1  ARG 135          1HH1      ARG 135  -1.684  13.186   8.145
 1026   1HH2  ARG 135          1HH2      ARG 135  -1.012  10.246   6.430
 1027   2HH2  ARG 135          2HH2      ARG 135  -0.670  11.183   7.845
 1028    NH1  ARG 136           NH1      ARG 136  -3.822  21.577   2.577
 1029    NH2  ARG 136           NH2      ARG 136  -5.194  23.259   3.204
 1030    H    ARG 136             H      ARG 136  -6.437  15.751   4.176
 1031    HA   ARG 136            HA      ARG 136  -5.874  17.052   6.731
 1032   1HB   ARG 136           2HB      ARG 136  -7.392  17.785   4.244
 1033   2HB   ARG 136           1HB      ARG 136  -7.652  18.707   5.724
 1034   1HG   ARG 136           2HG      ARG 136  -5.361  19.386   5.827
 1035   2HG   ARG 136           1HG      ARG 136  -4.881  18.205   4.610
 1036   1HD   ARG 136           2HD      ARG 136  -5.428  19.594   2.901
 1037   2HD   ARG 136           1HD      ARG 136  -6.967  20.032   3.646
 1038    HE   ARG 136            HE      ARG 136  -5.363  21.516   5.168
 1039   1HH1  ARG 136          2HH1      ARG 136  -3.504  20.637   2.679
 1040   2HH1  ARG 136          1HH1      ARG 136  -3.401  22.176   1.894
 1041   1HH2  ARG 136          1HH2      ARG 136  -5.926  23.606   3.788
 1042   2HH2  ARG 136          2HH2      ARG 136  -4.777  23.855   2.516
 1043    H    SER 137             H      SER 137  -7.948  14.630   5.749
 1044    HA   SER 137            HA      SER 137 -10.328  15.372   7.253
 1045   1HB   SER 137           2HB      SER 137 -11.212  13.270   6.454
 1046   2HB   SER 137           1HB      SER 137 -10.294  13.920   5.117
 1047    HG   SER 137            HG      SER 137  -9.843  11.701   5.531
 1048    H    GLN 138             H      GLN 138  -7.258  13.802   7.829
 1049    HA   GLN 138            HA      GLN 138  -6.324  13.046   9.863
 1050   1HB   GLN 138           2HB      GLN 138  -8.163  14.712  10.847
 1051   2HB   GLN 138           1HB      GLN 138  -8.936  13.203  11.332
 1052   1HG   GLN 138           2HG      GLN 138  -7.538  13.804  13.153
 1053   2HG   GLN 138           1HG      GLN 138  -6.659  12.535  12.300
 1054   1HE2  GLN 138          2HE2      GLN 138  -5.315  16.412  11.941
 1055   2HE2  GLN 138          1HE2      GLN 138  -6.961  16.137  12.256
 1056    OH   TYR 139            OH      TYR 139 -14.667  11.217   9.834
 1057    H    TYR 139             H      TYR 139  -8.248  11.508   7.881
 1058    HA   TYR 139            HA      TYR 139  -8.912   9.172   9.578
 1059   1HB   TYR 139           2HB      TYR 139  -9.541   9.927   6.717
 1060   2HB   TYR 139           1HB      TYR 139  -9.868   8.320   7.358
 1061    HD1  TYR 139           HD1      TYR 139 -10.790   8.838  10.099
 1062    HD2  TYR 139           HD2      TYR 139 -11.598  10.998   6.476
 1063    HE1  TYR 139           HE1      TYR 139 -12.933   9.642  11.053
 1064    HE2  TYR 139           HE2      TYR 139 -13.732  11.805   7.430
 1065    HH   TYR 139            HH      TYR 139 -15.366  10.642   9.514
   
  Start of MODEL          11
 Raw file had 1065 H/Q atoms
  Start of MODEL   11
    1   1H    ALA   1            3H      ALA   1 -18.263  18.198   6.355
    2   2H    ALA   1            2H      ALA   1 -17.158  17.523   7.455
    3   3H    ALA   1            1H      ALA   1 -16.599  18.273   6.038
    4    HA   ALA   1            HA      ALA   1 -16.443  15.982   5.621
    5   1HB   ALA   1           3HB      ALA   1 -18.907  15.971   7.232
    6   2HB   ALA   1           2HB      ALA   1 -18.958  14.879   5.848
    7   3HB   ALA   1           1HB      ALA   1 -17.679  14.722   7.051
    8    H    GLY   2             H      GLY   2 -16.302  16.237   3.439
    9   1HA   GLY   2           2HA      GLY   2 -18.835  16.683   1.913
   10   2HA   GLY   2           1HA      GLY   2 -17.391  17.620   1.522
   11    CH2  TRP   3           CH2      TRP   3 -13.028  11.305   3.958
   12    H    TRP   3             H      TRP   3 -18.049  14.118   2.158
   13    HA   TRP   3            HA      TRP   3 -16.098  13.003   0.534
   14   1HB   TRP   3           2HB      TRP   3 -18.671  12.098   1.413
   15   2HB   TRP   3           1HB      TRP   3 -17.906  11.196   0.149
   16    HD1  TRP   3           HD1      TRP   3 -18.242   9.601   2.477
   17    HE1  TRP   3           HE1      TRP   3 -16.413   8.811   4.090
   18    HE3  TRP   3           HE3      TRP   3 -14.616  13.200   1.638
   19    HZ2  TRP   3           HZ2      TRP   3 -13.818   9.552   4.902
   20    HZ3  TRP   3           HZ3      TRP   3 -12.501  13.064   2.858
   21    HH2  TRP   3           HH2      TRP   3 -12.090  11.265   4.491
   22    H    ASN   4             H      ASN   4 -19.402  13.889  -0.408
   23    HA   ASN   4            HA      ASN   4 -19.271  13.074  -3.129
   24   1HB   ASN   4           2HB      ASN   4 -20.984  15.009  -1.618
   25   2HB   ASN   4           1HB      ASN   4 -21.079  14.984  -3.381
   26   1HD2  ASN   4          1HD2      ASN   4 -20.758  12.399  -0.874
   27   2HD2  ASN   4          2HD2      ASN   4 -22.043  11.465  -1.468
   28    H    ALA   5             H      ALA   5 -17.984  15.876  -1.604
   29    HA   ALA   5            HA      ALA   5 -17.597  17.545  -3.974
   30   1HB   ALA   5           3HB      ALA   5 -17.499  18.267  -1.456
   31   2HB   ALA   5           2HB      ALA   5 -15.837  17.680  -1.506
   32   3HB   ALA   5           1HB      ALA   5 -16.343  18.991  -2.576
   33    OH   TYR   6            OH      TYR   6 -13.533  17.649   1.717
   34    H    TYR   6             H      TYR   6 -15.708  15.097  -2.198
   35    HA   TYR   6            HA      TYR   6 -13.404  15.362  -4.019
   36   1HB   TYR   6           2HB      TYR   6 -13.922  13.013  -2.186
   37   2HB   TYR   6           1HB      TYR   6 -12.365  13.624  -2.773
   38    HD1  TYR   6           HD1      TYR   6 -11.910  16.193  -2.279
   39    HD2  TYR   6           HD2      TYR   6 -14.669  13.738  -0.236
   40    HE1  TYR   6           HE1      TYR   6 -12.024  17.872  -0.452
   41    HE2  TYR   6           HE2      TYR   6 -14.791  15.358   1.630
   42    HH   TYR   6            HH      TYR   6 -13.582  18.519   1.311
   43    H    ILE   7             H      ILE   7 -16.482  14.038  -4.188
   44    HA   ILE   7            HA      ILE   7 -15.824  12.164  -6.369
   45    HB   ILE   7            HB      ILE   7 -18.345  12.806  -4.905
   46   1HG1  ILE   7          2HG1      ILE   7 -16.608  11.131  -4.104
   47   2HG1  ILE   7          1HG1      ILE   7 -18.246  10.522  -4.234
   48   1HG2  ILE   7          1HG2      ILE   7 -18.031  11.615  -7.609
   49   2HG2  ILE   7          3HG2      ILE   7 -19.267  10.950  -6.535
   50   3HG2  ILE   7          2HG2      ILE   7 -19.321  12.656  -6.994
   51   1HD1  ILE   7          2HD1      ILE   7 -16.810  10.199  -6.724
   52   2HD1  ILE   7          1HD1      ILE   7 -15.942   9.438  -5.399
   53   3HD1  ILE   7          3HD1      ILE   7 -17.605   8.980  -5.742
   54    H    ASP   8             H      ASP   8 -16.847  15.413  -5.672
   55    HA   ASP   8            HA      ASP   8 -17.821  16.194  -8.186
   56   1HB   ASP   8           2HB      ASP   8 -17.019  17.560  -5.737
   57   2HB   ASP   8           1HB      ASP   8 -17.038  18.520  -7.154
   58    H    ASN   9             H      ASN   9 -14.762  15.436  -6.906
   59    HA   ASN   9            HA      ASN   9 -12.893  16.850  -8.380
   60   1HB   ASN   9           2HB      ASN   9 -11.857  15.456  -6.867
   61   2HB   ASN   9           1HB      ASN   9 -13.146  14.389  -6.889
   62   1HD2  ASN   9          2HD2      ASN   9 -11.284  11.717  -8.550
   63   2HD2  ASN   9          1HD2      ASN   9 -12.466  12.157  -7.370
   64    H    LEU  10             H      LEU  10 -14.169  13.816  -9.084
   65    HA   LEU  10            HA      LEU  10 -13.449  13.175 -11.651
   66   1HB   LEU  10           2HB      LEU  10 -16.106  12.873 -10.336
   67   2HB   LEU  10           1HB      LEU  10 -15.632  12.003 -11.753
   68    HG   LEU  10            HG      LEU  10 -15.123  10.453 -10.293
   69   1HD1  LEU  10          1HD1      LEU  10 -12.674  12.234 -10.116
   70   2HD1  LEU  10          3HD1      LEU  10 -12.741  10.699  -9.270
   71   3HD1  LEU  10          2HD1      LEU  10 -12.879  10.751 -11.029
   72   1HD2  LEU  10          2HD2      LEU  10 -15.198  12.625  -8.328
   73   2HD2  LEU  10          1HD2      LEU  10 -15.966  11.087  -8.261
   74   3HD2  LEU  10          3HD2      LEU  10 -14.271  11.272  -7.862
   75    H    MET  11             H      MET  11 -16.052  15.013 -10.490
   76    HA   MET  11            HA      MET  11 -17.071  15.356 -13.186
   77   1HB   MET  11           2HB      MET  11 -17.821  16.642 -10.542
   78   2HB   MET  11           1HB      MET  11 -18.838  16.533 -11.987
   79   1HG   MET  11           2HG      MET  11 -17.663  13.878 -10.721
   80   2HG   MET  11           1HG      MET  11 -19.189  14.614 -10.125
   81   1HE   MET  11           1HE      MET  11 -17.203  13.279 -13.083
   82   2HE   MET  11           3HE      MET  11 -17.956  11.908 -12.253
   83   3HE   MET  11           2HE      MET  11 -18.389  12.280 -13.919
   84    H    ALA  12             H      ALA  12 -15.100  17.233 -11.032
   85    HA   ALA  12            HA      ALA  12 -14.848  19.580 -12.691
   86   1HB   ALA  12           1HB      ALA  12 -13.863  18.769  -9.981
   87   2HB   ALA  12           3HB      ALA  12 -13.078  20.114 -10.821
   88   3HB   ALA  12           2HB      ALA  12 -14.800  20.195 -10.452
   89    H    ASP  13             H      ASP  13 -13.276  16.549 -12.845
   90    HA   ASP  13            HA      ASP  13 -10.579  17.700 -13.482
   91   1HB   ASP  13           2HB      ASP  13 -10.059  15.070 -13.660
   92   2HB   ASP  13           1HB      ASP  13 -10.059  15.928 -12.138
   93    H    GLY  14             H      GLY  14 -13.173  16.882 -15.418
   94   1HA   GLY  14           2HA      GLY  14 -13.339  16.161 -17.724
   95   2HA   GLY  14           1HA      GLY  14 -12.108  17.393 -17.924
   96    H    THR  15             H      THR  15 -11.188  14.522 -16.157
   97    HA   THR  15            HA      THR  15  -9.903  13.196 -18.420
   98    HB   THR  15            HB      THR  15  -8.579  14.095 -15.879
   99    HG1  THR  15           HG1      THR  15  -7.225  15.164 -17.416
  100   1HG2  THR  15          2HG2      THR  15  -7.609  12.298 -18.111
  101   2HG2  THR  15          1HG2      THR  15  -6.559  13.010 -16.859
  102   3HG2  THR  15          3HG2      THR  15  -7.847  11.893 -16.401
  103    H    CYS  16             H      CYS  16 -11.733  13.019 -15.545
  104    HA   CYS  16            HA      CYS  16 -10.948  10.400 -14.782
  105   1HB   CYS  16           2HB      CYS  16 -12.144  10.874 -12.870
  106   2HB   CYS  16           1HB      CYS  16 -11.879  12.456 -13.429
  107    HG   CYS  16            HG      CYS  16 -14.561  10.975 -13.972
  108    H    GLN  17             H      GLN  17 -13.085   9.064 -14.263
  109    HA   GLN  17            HA      GLN  17 -15.071   8.989 -16.370
  110   1HB   GLN  17           2HB      GLN  17 -12.854   7.620 -16.856
  111   2HB   GLN  17           1HB      GLN  17 -13.631   6.433 -15.841
  112   1HG   GLN  17           2HG      GLN  17 -15.017   7.742 -18.168
  113   2HG   GLN  17           1HG      GLN  17 -14.042   6.278 -18.358
  114   1HE2  GLN  17          2HE2      GLN  17 -16.471   4.162 -16.840
  115   2HE2  GLN  17          1HE2      GLN  17 -14.903   4.281 -17.483
  116    H    ASP  18             H      ASP  18 -13.541   7.343 -13.630
  117    HA   ASP  18            HA      ASP  18 -16.071   7.297 -12.152
  118   1HB   ASP  18           2HB      ASP  18 -15.391   5.027 -13.272
  119   2HB   ASP  18           1HB      ASP  18 -14.360   4.911 -11.857
  120    H    ALA  19             H      ALA  19 -15.385   6.420  -9.737
  121    HA   ALA  19            HA      ALA  19 -12.759   7.498  -8.773
  122   1HB   ALA  19           2HB      ALA  19 -14.158   9.318  -9.469
  123   2HB   ALA  19           1HB      ALA  19 -15.340   8.960  -8.250
  124   3HB   ALA  19           3HB      ALA  19 -13.684   9.402  -7.806
  125    H    ALA  20             H      ALA  20 -12.406   6.164  -6.819
  126    HA   ALA  20            HA      ALA  20 -14.993   5.841  -5.251
  127   1HB   ALA  20           1HB      ALA  20 -13.219   3.622  -6.099
  128   2HB   ALA  20           3HB      ALA  20 -14.330   3.484  -4.740
  129   3HB   ALA  20           2HB      ALA  20 -14.936   3.862  -6.338
  130    H    ILE  21             H      ILE  21 -14.765   6.767  -3.450
  131    HA   ILE  21            HA      ILE  21 -12.290   6.571  -1.860
  132    HB   ILE  21            HB      ILE  21 -15.022   7.690  -1.113
  133   1HG1  ILE  21          2HG1      ILE  21 -12.557   8.946  -2.361
  134   2HG1  ILE  21          1HG1      ILE  21 -14.211   8.989  -2.961
  135   1HG2  ILE  21          2HG2      ILE  21 -12.923   7.001   0.553
  136   2HG2  ILE  21          1HG2      ILE  21 -12.553   8.692   0.203
  137   3HG2  ILE  21          3HG2      ILE  21 -14.107   8.257   0.919
  138   1HD1  ILE  21          2HD1      ILE  21 -14.525  10.131  -0.508
  139   2HD1  ILE  21          1HD1      ILE  21 -12.894  10.660  -0.925
  140   3HD1  ILE  21          3HD1      ILE  21 -14.243  11.045  -1.992
  141    H    VAL  22             H      VAL  22 -12.076   4.641  -0.671
  142    HA   VAL  22            HA      VAL  22 -14.607   3.137  -0.124
  143    HB   VAL  22            HB      VAL  22 -11.882   1.984  -0.922
  144   1HG1  VAL  22          3HG1      VAL  22 -13.631   0.644   0.524
  145   2HG1  VAL  22          2HG1      VAL  22 -14.471   0.468  -1.015
  146   3HG1  VAL  22          1HG1      VAL  22 -12.822  -0.144  -0.834
  147   1HG2  VAL  22          2HG2      VAL  22 -13.275   3.293  -2.700
  148   2HG2  VAL  22          1HG2      VAL  22 -12.658   1.684  -3.120
  149   3HG2  VAL  22          3HG2      VAL  22 -14.351   1.897  -2.645
  150    H    GLY  23             H      GLY  23 -14.816   2.855   2.092
  151   1HA   GLY  23           2HA      GLY  23 -12.589   3.123   3.962
  152   2HA   GLY  23           1HA      GLY  23 -14.228   2.580   4.375
  153    OH   TYR  24            OH      TYR  24  -5.370   1.151   5.196
  154    H    TYR  24             H      TYR  24 -11.220   1.534   2.927
  155    HA   TYR  24            HA      TYR  24 -11.828  -1.246   2.604
  156   1HB   TYR  24           2HB      TYR  24  -9.670  -1.323   1.573
  157   2HB   TYR  24           1HB      TYR  24 -10.158   0.327   1.367
  158    HD1  TYR  24           HD2      TYR  24  -9.518   1.938   3.486
  159    HD2  TYR  24           HD1      TYR  24  -7.612  -1.744   2.513
  160    HE1  TYR  24           HE2      TYR  24  -7.564   2.614   4.842
  161    HE2  TYR  24           HE1      TYR  24  -5.647  -1.124   3.854
  162    HH   TYR  24            HH      TYR  24  -5.612   1.075   6.125
  163    H    LYS  25             H      LYS  25 -11.868  -0.055   5.477
  164    HA   LYS  25            HA      LYS  25  -9.784  -1.048   7.050
  165   1HB   LYS  25           2HB      LYS  25 -12.532  -0.124   7.514
  166   2HB   LYS  25           1HB      LYS  25 -11.726  -0.932   8.802
  167   1HG   LYS  25           2HG      LYS  25 -11.370   1.485   9.035
  168   2HG   LYS  25           1HG      LYS  25  -9.848   0.691   8.666
  169   1HD   LYS  25           2HD      LYS  25  -9.753   2.430   7.174
  170   2HD   LYS  25           1HD      LYS  25 -10.569   1.265   6.179
  171   1HE   LYS  25           2HE      LYS  25 -11.849   3.495   7.751
  172   2HE   LYS  25           1HE      LYS  25 -11.757   3.362   5.997
  173   1HZ   LYS  25           3HZ      LYS  25 -13.073   1.273   6.227
  174   2HZ   LYS  25           2HZ      LYS  25 -13.308   1.650   7.863
  175   3HZ   LYS  25           1HZ      LYS  25 -13.910   2.674   6.654
  176    H    ASP  26             H      ASP  26 -11.323  -2.608   8.945
  177    HA   ASP  26            HA      ASP  26 -10.827  -5.261   8.370
  178   1HB   ASP  26           2HB      ASP  26 -13.058  -5.747   9.656
  179   2HB   ASP  26           1HB      ASP  26 -11.688  -5.071  10.505
  180    H    SER  27             H      SER  27 -13.987  -3.799   7.766
  181    HA   SER  27            HA      SER  27 -14.459  -5.691   5.560
  182   1HB   SER  27           2HB      SER  27 -16.844  -4.903   5.952
  183   2HB   SER  27           1HB      SER  27 -16.188  -5.948   7.180
  184    HG   SER  27            HG      SER  27 -16.753  -4.356   8.447
  185    HA   PRO  28            HA      PRO  28 -13.874  -1.930   3.324
  186   1HB   PRO  28           2HB      PRO  28 -14.137  -2.945   0.803
  187   2HB   PRO  28           1HB      PRO  28 -12.670  -3.064   1.782
  188   1HG   PRO  28           2HG      PRO  28 -14.579  -5.184   1.099
  189   2HG   PRO  28           1HG      PRO  28 -12.956  -5.293   1.731
  190   1HD   PRO  28           2HD      PRO  28 -15.396  -5.604   3.159
  191   2HD   PRO  28           1HD      PRO  28 -13.732  -5.739   3.771
  192    H    SER  29             H      SER  29 -15.096  -0.394   2.251
  193    HA   SER  29            HA      SER  29 -17.734  -1.029   1.297
  194   1HB   SER  29           2HB      SER  29 -18.807   0.661   2.791
  195   2HB   SER  29           1HB      SER  29 -18.212  -0.748   3.662
  196    HG   SER  29            HG      SER  29 -16.525   0.416   4.406
  197    H    VAL  30             H      VAL  30 -18.736   0.957   0.406
  198    HA   VAL  30            HA      VAL  30 -16.653   2.541  -0.875
  199    HB   VAL  30            HB      VAL  30 -19.536   1.937  -1.483
  200   1HG1  VAL  30          2HG1      VAL  30 -19.014   4.302  -2.077
  201   2HG1  VAL  30          1HG1      VAL  30 -17.657   3.724  -3.040
  202   3HG1  VAL  30          3HG1      VAL  30 -19.301   3.291  -3.496
  203   1HG2  VAL  30          2HG2      VAL  30 -17.055   0.679  -2.038
  204   2HG2  VAL  30          1HG2      VAL  30 -18.624   0.289  -2.735
  205   3HG2  VAL  30          3HG2      VAL  30 -17.560   1.429  -3.539
  206    CH2  TRP  31           CH2      TRP  31 -13.332   6.058   6.826
  207    H    TRP  31             H      TRP  31 -16.147   4.176   0.471
  208    HA   TRP  31            HA      TRP  31 -17.975   5.562   2.171
  209   1HB   TRP  31           2HB      TRP  31 -15.115   5.863   1.352
  210   2HB   TRP  31           1HB      TRP  31 -15.901   7.259   2.092
  211    HD1  TRP  31           HD1      TRP  31 -17.286   4.007   3.290
  212    HE1  TRP  31           HE1      TRP  31 -16.480   3.509   5.635
  213    HE3  TRP  31           HE3      TRP  31 -13.555   7.492   3.756
  214    HZ2  TRP  31           HZ2      TRP  31 -14.549   4.433   7.521
  215    HZ3  TRP  31           HZ3      TRP  31 -12.287   7.663   5.867
  216    HH2  TRP  31           HH2      TRP  31 -12.761   6.128   7.740
  217    H    ALA  32             H      ALA  32 -16.986   5.941  -1.137
  218    HA   ALA  32            HA      ALA  32 -19.151   7.618  -1.842
  219   1HB   ALA  32           1HB      ALA  32 -16.597   9.145  -1.249
  220   2HB   ALA  32           3HB      ALA  32 -17.901   9.806  -2.260
  221   3HB   ALA  32           2HB      ALA  32 -18.199   9.415  -0.551
  222    H    ALA  33             H      ALA  33 -18.977   6.007  -3.528
  223    HA   ALA  33            HA      ALA  33 -16.914   6.622  -5.572
  224   1HB   ALA  33           1HB      ALA  33 -16.806   4.263  -4.772
  225   2HB   ALA  33           3HB      ALA  33 -18.497   4.051  -5.243
  226   3HB   ALA  33           2HB      ALA  33 -17.270   4.362  -6.472
  227    H    VAL  34             H      VAL  34 -17.683   7.376  -7.480
  228    HA   VAL  34            HA      VAL  34 -20.292   8.362  -7.875
  229    HB   VAL  34            HB      VAL  34 -18.484   7.326 -10.120
  230   1HG1  VAL  34          1HG1      VAL  34 -20.939   8.029 -10.545
  231   2HG1  VAL  34          3HG1      VAL  34 -20.405   9.673 -10.150
  232   3HG1  VAL  34          2HG1      VAL  34 -19.694   8.816 -11.521
  233   1HG2  VAL  34          1HG2      VAL  34 -17.416   8.982  -8.415
  234   2HG2  VAL  34          3HG2      VAL  34 -17.372   9.447 -10.109
  235   3HG2  VAL  34          2HG2      VAL  34 -18.561  10.163  -9.023
  236    HA   PRO  35            HA      PRO  35 -22.073   4.178  -7.988
  237   1HB   PRO  35           2HB      PRO  35 -24.678   4.931  -7.500
  238   2HB   PRO  35           1HB      PRO  35 -23.458   4.681  -6.237
  239   1HG   PRO  35           2HG      PRO  35 -24.546   7.250  -7.315
  240   2HG   PRO  35           1HG      PRO  35 -23.872   6.900  -5.714
  241   1HD   PRO  35           2HD      PRO  35 -22.514   8.231  -7.805
  242   2HD   PRO  35           1HD      PRO  35 -21.763   7.538  -6.357
  243    H    GLY  36             H      GLY  36 -22.950   3.003  -9.588
  244   1HA   GLY  36           2HA      GLY  36 -24.668   2.795 -11.381
  245   2HA   GLY  36           1HA      GLY  36 -24.252   4.441 -11.856
  246    H    LYS  37             H      LYS  37 -21.290   3.763 -11.274
  247    HA   LYS  37            HA      LYS  37 -20.766   2.758 -13.998
  248   1HB   LYS  37           2HB      LYS  37 -18.793   3.750 -11.922
  249   2HB   LYS  37           1HB      LYS  37 -18.455   3.467 -13.627
  250   1HG   LYS  37           2HG      LYS  37 -20.354   5.534 -12.463
  251   2HG   LYS  37           1HG      LYS  37 -18.833   5.850 -13.294
  252   1HD   LYS  37           2HD      LYS  37 -20.302   4.271 -15.101
  253   2HD   LYS  37           1HD      LYS  37 -21.487   5.384 -14.423
  254   1HE   LYS  37           2HE      LYS  37 -18.887   6.592 -15.151
  255   2HE   LYS  37           1HE      LYS  37 -19.845   5.994 -16.507
  256   1HZ   LYS  37           2HZ      LYS  37 -21.052   7.657 -14.385
  257   2HZ   LYS  37           1HZ      LYS  37 -20.258   8.363 -15.710
  258   3HZ   LYS  37           3HZ      LYS  37 -21.613   7.378 -15.965
  259    H    THR  38             H      THR  38 -18.629   1.980 -11.217
  260    HA   THR  38            HA      THR  38 -19.177  -0.881 -11.354
  261    HB   THR  38            HB      THR  38 -17.085   0.380 -12.998
  262    HG1  THR  38           HG1      THR  38 -17.607  -1.359 -14.334
  263   1HG2  THR  38          2HG2      THR  38 -16.518  -2.145 -11.445
  264   2HG2  THR  38          1HG2      THR  38 -15.784  -1.881 -13.022
  265   3HG2  THR  38          3HG2      THR  38 -15.444  -0.756 -11.695
  266    H    PHE  39             H      PHE  39 -16.893   1.621 -10.364
  267    HA   PHE  39            HA      PHE  39 -15.305   0.190  -8.529
  268   1HB   PHE  39           2HB      PHE  39 -16.143   3.044  -8.735
  269   2HB   PHE  39           1HB      PHE  39 -15.151   2.476  -7.418
  270    HD1  PHE  39           HD1      PHE  39 -14.909   1.016 -10.812
  271    HD2  PHE  39           HD2      PHE  39 -13.168   3.745  -7.993
  272    HE1  PHE  39           HE1      PHE  39 -12.875   1.120 -12.167
  273    HE2  PHE  39           HE2      PHE  39 -11.117   3.845  -9.356
  274    HZ   PHE  39            HZ      PHE  39 -10.991   2.501 -11.442
  275    H    VAL  40             H      VAL  40 -18.356   1.813  -7.960
  276    HA   VAL  40            HA      VAL  40 -18.404   1.703  -5.164
  277    HB   VAL  40            HB      VAL  40 -20.027   3.116  -6.149
  278   1HG1  VAL  40          1HG1      VAL  40 -20.719   0.683  -7.764
  279   2HG1  VAL  40          3HG1      VAL  40 -21.822   2.056  -7.639
  280   3HG1  VAL  40          2HG1      VAL  40 -20.205   2.284  -8.325
  281   1HG2  VAL  40          3HG2      VAL  40 -20.770   1.271  -4.272
  282   2HG2  VAL  40          2HG2      VAL  40 -21.825   2.576  -4.830
  283   3HG2  VAL  40          1HG2      VAL  40 -21.973   0.962  -5.527
  284    H    ASN  41             H      ASN  41 -18.753  -0.827  -7.482
  285    HA   ASN  41            HA      ASN  41 -20.035  -2.666  -5.617
  286   1HB   ASN  41           2HB      ASN  41 -19.173  -2.747  -8.463
  287   2HB   ASN  41           1HB      ASN  41 -19.342  -4.246  -7.577
  288   1HD2  ASN  41          2HD2      ASN  41 -22.709  -2.000  -8.235
  289   2HD2  ASN  41          1HD2      ASN  41 -21.188  -1.246  -8.264
  290    H    ILE  42             H      ILE  42 -17.250  -1.381  -5.147
  291    HA   ILE  42            HA      ILE  42 -15.295  -3.435  -5.436
  292    HB   ILE  42            HB      ILE  42 -15.474  -0.689  -4.222
  293   1HG1  ILE  42          2HG1      ILE  42 -13.334  -2.084  -5.835
  294   2HG1  ILE  42          1HG1      ILE  42 -14.688  -1.228  -6.533
  295   1HG2  ILE  42          3HG2      ILE  42 -13.915  -2.740  -2.836
  296   2HG2  ILE  42          2HG2      ILE  42 -12.871  -1.490  -3.481
  297   3HG2  ILE  42          1HG2      ILE  42 -14.192  -1.066  -2.401
  298   1HD1  ILE  42          3HD1      ILE  42 -12.801   0.109  -4.593
  299   2HD1  ILE  42          2HD1      ILE  42 -12.454   0.054  -6.332
  300   3HD1  ILE  42          1HD1      ILE  42 -13.915   0.864  -5.738
  301    H    THR  43             H      THR  43 -14.813  -5.023  -4.069
  302    HA   THR  43            HA      THR  43 -16.238  -5.371  -1.444
  303    HB   THR  43            HB      THR  43 -16.067  -7.844  -2.146
  304    HG1  THR  43           HG1      THR  43 -15.092  -8.292  -3.904
  305   1HG2  THR  43          2HG2      THR  43 -18.066  -6.205  -2.450
  306   2HG2  THR  43          1HG2      THR  43 -17.621  -6.283  -4.155
  307   3HG2  THR  43          3HG2      THR  43 -18.091  -7.754  -3.301
  308    HA   PRO  44            HA      PRO  44 -12.218  -6.317   0.325
  309   1HB   PRO  44           2HB      PRO  44 -12.508  -8.638   1.647
  310   2HB   PRO  44           1HB      PRO  44 -13.057  -7.110   2.270
  311   1HG   PRO  44           2HG      PRO  44 -14.648  -9.337   1.102
  312   2HG   PRO  44           1HG      PRO  44 -15.142  -8.106   2.275
  313   1HD   PRO  44           2HD      PRO  44 -15.802  -8.079  -0.425
  314   2HD   PRO  44           1HD      PRO  44 -15.880  -6.671   0.628
  315    H    ALA  45             H      ALA  45 -13.289  -8.146  -2.123
  316    HA   ALA  45            HA      ALA  45 -11.106 -10.091  -2.202
  317   1HB   ALA  45           3HB      ALA  45 -13.672  -9.725  -3.526
  318   2HB   ALA  45           2HB      ALA  45 -12.386 -10.056  -4.690
  319   3HB   ALA  45           1HB      ALA  45 -12.706 -11.198  -3.385
  320    H    GLU  46             H      GLU  46 -12.405  -7.712  -4.372
  321    HA   GLU  46            HA      GLU  46  -9.992  -7.343  -5.853
  322   1HB   GLU  46           2HB      GLU  46 -11.148  -5.373  -6.784
  323   2HB   GLU  46           1HB      GLU  46 -12.189  -6.764  -6.784
  324   1HG   GLU  46           2HG      GLU  46 -13.562  -5.044  -5.962
  325   2HG   GLU  46           1HG      GLU  46 -13.015  -5.866  -4.502
  326    H    VAL  47             H      VAL  47 -11.244  -5.926  -2.897
  327    HA   VAL  47            HA      VAL  47  -9.157  -3.943  -2.696
  328    HB   VAL  47            HB      VAL  47 -11.639  -4.389  -1.285
  329   1HG1  VAL  47          2HG1      VAL  47  -9.938  -4.750   0.543
  330   2HG1  VAL  47          1HG1      VAL  47  -9.446  -3.091   0.207
  331   3HG1  VAL  47          3HG1      VAL  47 -11.072  -3.419   0.756
  332   1HG2  VAL  47          3HG2      VAL  47 -10.606  -2.424  -2.772
  333   2HG2  VAL  47          2HG2      VAL  47 -11.799  -2.091  -1.516
  334   3HG2  VAL  47          1HG2      VAL  47 -10.053  -1.863  -1.163
  335    H    GLY  48             H      GLY  48  -9.657  -7.223  -1.816
  336   1HA   GLY  48           2HA      GLY  48  -7.766  -7.513   0.297
  337   2HA   GLY  48           1HA      GLY  48  -8.189  -8.773  -0.864
  338    H    VAL  49             H      VAL  49  -7.445  -7.073  -3.146
  339    HA   VAL  49            HA      VAL  49  -4.522  -7.492  -3.072
  340    HB   VAL  49            HB      VAL  49  -5.684  -8.526  -4.972
  341   1HG1  VAL  49          3HG1      VAL  49  -6.552  -5.688  -5.506
  342   2HG1  VAL  49          2HG1      VAL  49  -6.554  -6.918  -6.760
  343   3HG1  VAL  49          1HG1      VAL  49  -7.556  -7.123  -5.328
  344   1HG2  VAL  49          3HG2      VAL  49  -3.501  -6.580  -5.212
  345   2HG2  VAL  49          2HG2      VAL  49  -3.654  -8.179  -5.937
  346   3HG2  VAL  49          1HG2      VAL  49  -4.371  -6.781  -6.734
  347    H    LEU  50             H      LEU  50  -6.819  -4.914  -3.665
  348    HA   LEU  50            HA      LEU  50  -4.987  -2.831  -4.299
  349   1HB   LEU  50           2HB      LEU  50  -7.749  -3.047  -3.418
  350   2HB   LEU  50           1HB      LEU  50  -7.010  -1.552  -3.138
  351    HG   LEU  50            HG      LEU  50  -6.413  -2.132  -5.784
  352   1HD1  LEU  50          2HD1      LEU  50  -9.063  -3.214  -4.949
  353   2HD1  LEU  50          1HD1      LEU  50  -8.982  -2.339  -6.475
  354   3HD1  LEU  50          3HD1      LEU  50  -7.982  -3.771  -6.231
  355   1HD2  LEU  50          1HD2      LEU  50  -7.350  -0.002  -4.378
  356   2HD2  LEU  50          3HD2      LEU  50  -7.446  -0.079  -6.145
  357   3HD2  LEU  50          2HD2      LEU  50  -8.856  -0.504  -5.160
  358    H    VAL  51             H      VAL  51  -5.618  -4.461  -1.374
  359    HA   VAL  51            HA      VAL  51  -4.042  -2.474   0.132
  360    HB   VAL  51            HB      VAL  51  -5.739  -2.126   1.782
  361   1HG1  VAL  51          1HG1      VAL  51  -6.234  -0.960  -0.305
  362   2HG1  VAL  51          3HG1      VAL  51  -7.209  -2.335  -0.825
  363   3HG1  VAL  51          2HG1      VAL  51  -7.701  -1.381   0.576
  364   1HG2  VAL  51          1HG2      VAL  51  -6.625  -4.779   0.977
  365   2HG2  VAL  51          3HG2      VAL  51  -6.875  -3.930   2.503
  366   3HG2  VAL  51          2HG2      VAL  51  -7.964  -3.653   1.149
  367    H    GLY  52             H      GLY  52  -4.671  -5.764  -0.469
  368   1HA   GLY  52           2HA      GLY  52  -4.255  -7.100   1.910
  369   2HA   GLY  52           1HA      GLY  52  -3.706  -7.701   0.352
  370    H    LYS  53             H      LYS  53  -2.370  -8.053   2.753
  371    HA   LYS  53            HA      LYS  53  -0.219  -6.307   3.239
  372   1HB   LYS  53           2HB      LYS  53   0.882  -8.275   4.333
  373   2HB   LYS  53           1HB      LYS  53  -0.768  -7.990   4.886
  374   1HG   LYS  53           2HG      LYS  53  -1.333 -10.075   4.250
  375   2HG   LYS  53           1HG      LYS  53  -0.942  -9.666   2.581
  376   1HD   LYS  53           2HD      LYS  53   0.497 -11.473   2.992
  377   2HD   LYS  53           1HD      LYS  53   1.539 -10.089   3.332
  378   1HE   LYS  53           2HE      LYS  53   1.901 -11.315   5.255
  379   2HE   LYS  53           1HE      LYS  53   0.500 -10.375   5.770
  380   1HZ   LYS  53           1HZ      LYS  53  -0.831 -12.316   4.781
  381   2HZ   LYS  53           3HZ      LYS  53   0.619 -13.187   4.890
  382   3HZ   LYS  53           2HZ      LYS  53  -0.087 -12.536   6.292
  383    H    ASP  54             H      ASP  54  -0.775  -8.428   0.650
  384    HA   ASP  54            HA      ASP  54   1.519  -9.458  -0.333
  385   1HB   ASP  54           2HB      ASP  54  -0.820  -9.265  -1.358
  386   2HB   ASP  54           1HB      ASP  54  -0.228  -7.780  -2.071
  387    NH1  ARG  55           NH1      ARG  55   9.218  -6.803   3.103
  388    NH2  ARG  55           NH2      ARG  55   9.050  -4.726   3.980
  389    H    ARG  55             H      ARG  55   3.470  -8.557  -0.337
  390    HA   ARG  55            HA      ARG  55   3.823  -5.714  -0.724
  391   1HB   ARG  55           2HB      ARG  55   4.786  -7.160   1.220
  392   2HB   ARG  55           1HB      ARG  55   6.049  -7.525   0.048
  393   1HG   ARG  55           2HG      ARG  55   5.971  -4.868  -0.282
  394   2HG   ARG  55           1HG      ARG  55   5.392  -4.941   1.382
  395   1HD   ARG  55           2HD      ARG  55   7.708  -6.687   0.868
  396   2HD   ARG  55           1HD      ARG  55   8.044  -4.972   0.640
  397    HE   ARG  55            HE      ARG  55   6.637  -5.244   3.087
  398   1HH1  ARG  55          2HH1      ARG  55   8.852  -7.529   2.523
  399   2HH1  ARG  55          1HH1      ARG  55  10.081  -6.938   3.590
  400   1HH2  ARG  55          1HH2      ARG  55   8.555  -3.863   4.073
  401   2HH2  ARG  55          2HH2      ARG  55   9.914  -4.861   4.466
  402    H    SER  56             H      SER  56   3.741  -8.052  -3.027
  403    HA   SER  56            HA      SER  56   5.588  -6.597  -4.739
  404   1HB   SER  56           2HB      SER  56   7.110  -8.034  -3.345
  405   2HB   SER  56           1HB      SER  56   6.412  -9.417  -4.181
  406    HG   SER  56            HG      SER  56   7.872  -8.966  -5.627
  407    H    SER  57             H      SER  57   4.039  -9.717  -4.502
  408    HA   SER  57            HA      SER  57   3.984 -10.429  -7.182
  409   1HB   SER  57           2HB      SER  57   1.752 -11.584  -6.583
  410   2HB   SER  57           1HB      SER  57   3.264 -12.150  -5.902
  411    HG   SER  57            HG      SER  57   1.961 -11.888  -4.193
  412    H    PHE  58             H      PHE  58   0.884  -9.450  -5.900
  413    HA   PHE  58            HA      PHE  58  -0.436  -8.961  -8.211
  414   1HB   PHE  58           2HB      PHE  58  -2.039  -7.570  -7.172
  415   2HB   PHE  58           1HB      PHE  58  -1.446  -8.647  -5.948
  416    HD1  PHE  58           HD1      PHE  58  -0.918  -5.233  -7.315
  417    HD2  PHE  58           HD2      PHE  58  -0.665  -7.831  -3.930
  418    HE1  PHE  58           HE1      PHE  58  -0.394  -3.309  -5.867
  419    HE2  PHE  58           HE2      PHE  58  -0.134  -5.885  -2.482
  420    HZ   PHE  58            HZ      PHE  58  -0.007  -3.623  -3.455
  421    OH   TYR  59            OH      TYR  59   3.051  -3.260  -2.878
  422    H    TYR  59             H      TYR  59   2.177  -6.814  -7.330
  423    HA   TYR  59            HA      TYR  59   1.377  -4.581  -8.848
  424   1HB   TYR  59           2HB      TYR  59   4.221  -5.468  -8.489
  425   2HB   TYR  59           1HB      TYR  59   3.677  -3.851  -8.922
  426    HD1  TYR  59           HD1      TYR  59   1.624  -3.114  -7.202
  427    HD2  TYR  59           HD2      TYR  59   5.014  -5.555  -6.302
  428    HE1  TYR  59           HE1      TYR  59   1.457  -2.444  -4.817
  429    HE2  TYR  59           HE2      TYR  59   4.856  -4.904  -3.903
  430    HH   TYR  59            HH      TYR  59   3.210  -4.039  -2.342
  431    H    VAL  60             H      VAL  60   1.863  -7.562 -10.096
  432    HA   VAL  60            HA      VAL  60   2.547  -6.480 -12.739
  433    HB   VAL  60            HB      VAL  60   3.234  -9.030 -13.028
  434   1HG1  VAL  60          2HG1      VAL  60   4.794  -6.775 -11.789
  435   2HG1  VAL  60          1HG1      VAL  60   5.571  -8.284 -12.283
  436   3HG1  VAL  60          3HG1      VAL  60   4.773  -7.269 -13.485
  437   1HG2  VAL  60          1HG2      VAL  60   2.594  -9.587 -10.661
  438   2HG2  VAL  60          3HG2      VAL  60   4.276  -9.959 -11.046
  439   3HG2  VAL  60          2HG2      VAL  60   3.881  -8.506 -10.127
  440    H    ASN  61             H      ASN  61   0.339  -8.649 -10.947
  441    HA   ASN  61            HA      ASN  61  -0.867  -9.560 -13.418
  442   1HB   ASN  61           2HB      ASN  61  -2.551 -10.597 -11.845
  443   2HB   ASN  61           1HB      ASN  61  -0.937 -11.198 -11.768
  444   1HD2  ASN  61          2HD2      ASN  61  -2.277  -8.953  -8.679
  445   2HD2  ASN  61          1HD2      ASN  61  -2.886  -8.687 -10.215
  446    H    GLY  62             H      GLY  62  -1.429  -7.110 -11.025
  447   1HA   GLY  62           2HA      GLY  62  -2.567  -5.113 -11.653
  448   2HA   GLY  62           1HA      GLY  62  -3.598  -6.063 -12.696
  449    H    LEU  63             H      LEU  63  -4.306  -4.144 -10.587
  450    HA   LEU  63            HA       -6.359  -2.405 -14.805
  507   1HB   CYS  70           2HB      CYS  70  -5.745  -0.658 -13.034
  508   2HB   CYS  70           1HB      CYS  70  -7.440  -0.835 -13.380
  509    HG   CYS  70            HG      CYS  70  -7.075  -0.799 -10.751
  510    H    SER  71             H      SER  71  -3.997  -1.415 -13.778
  511    HA   SER  71            HA      SER  71  -2.615  -3.642 -12.522
  512   1HB   SER  71           2HB      SER  71  -1.279  -4.252 -14.247
  513   2HB   SER  71           1HB      SER  71  -2.743  -3.828 -15.088
  514    HG   SER  71            HG      SER  71  -1.808  -1.731 -15.371
  515    H    VAL  72             H      VAL  72  -1.523  -2.858 -10.993
  516    HA   VAL  72            HA      VAL  72  -0.710  -0.308 -10.377
  517    HB   VAL  72            HB      VAL  72   1.094  -2.618  -9.865
  518   1HG1  VAL  72          2HG1      VAL  72   1.368  -0.077  -9.176
  519   2HG1  VAL  72          1HG1      VAL  72   0.332  -0.604  -7.855
  520   3HG1  VAL  72          3HG1      VAL  72   1.884  -1.390  -8.117
  521   1HG2  VAL  72          3HG2      VAL  72  -1.662  -2.204  -8.897
  522   2HG2  VAL  72          2HG2      VAL  72  -0.764  -3.711  -9.096
  523   3HG2  VAL  72          1HG2      VAL  72  -0.474  -2.689  -7.699
  524    H    ILE  73             H      ILE  73   0.616   1.042 -11.214
  525    HA   ILE  73            HA      ILE  73   2.996   0.156 -12.583
  526    HB   ILE  73            HB      ILE  73   0.986   2.019 -13.686
  527   1HG1  ILE  73          2HG1      ILE  73   2.410  -0.015 -15.304
  528   2HG1  ILE  73          1HG1      ILE  73   1.314  -0.638 -14.077
  529   1HG2  ILE  73          3HG2      ILE  73   3.912   1.929 -14.201
  530   2HG2  ILE  73          2HG2      ILE  73   2.829   2.258 -15.553
  531   3HG2  ILE  73          1HG2      ILE  73   2.842   3.330 -14.153
  532   1HD1  ILE  73          1HD1      ILE  73   0.157   1.536 -15.704
  533   2HD1  ILE  73          3HD1      ILE  73   0.562   0.089 -16.635
  534   3HD1  ILE  73          2HD1      ILE  73  -0.536  -0.025 -15.257
  535    NH1  ARG  74           NH1      ARG  74   9.953   2.804 -10.596
  536    NH2  ARG  74           NH2      ARG  74   8.939   0.808 -10.888
  537    H    ARG  74             H      ARG  74   3.671   0.654 -10.555
  538    HA   ARG  74            HA      ARG  74   5.284   1.763  -9.300
  539   1HB   ARG  74           2HB      ARG  74   4.095   4.164 -10.609
  540   2HB   ARG  74           1HB      ARG  74   5.013   4.340  -9.125
  541   1HG   ARG  74           2HG      ARG  74   6.169   2.588 -11.226
  542   2HG   ARG  74           1HG      ARG  74   6.184   4.326 -11.552
  543   1HD   ARG  74           2HD      ARG  74   8.057   4.404 -10.285
  544   2HD   ARG  74           1HD      ARG  74   7.004   4.143  -8.895
  545    HE   ARG  74            HE      ARG  74   7.625   1.816  -8.902
  546   1HH1  ARG  74          2HH1      ARG  74   9.964   3.718 -10.195
  547   2HH1  ARG  74          1HH1      ARG  74  10.711   2.505 -11.176
  548   1HH2  ARG  74          1HH2      ARG  74   8.171   0.191 -10.711
  549   2HH2  ARG  74          2HH2      ARG  74   9.699   0.504 -11.463
  550    H    ASP  75             H      ASP  75   4.171   0.587  -7.833
  551    HA   ASP  75            HA      ASP  75   1.833   1.662  -6.587
  552   1HB   ASP  75           2HB      ASP  75   1.778  -0.616  -6.283
  553   2HB   ASP  75           1HB      ASP  75   3.500  -0.729  -6.162
  554    H    SER  76             H      SER  76   2.123   3.627  -5.836
  555    HA   SER  76            HA      SER  76   4.232   3.923  -3.692
  556   1HB   SER  76           2HB      SER  76   3.184   6.534  -4.492
  557   2HB   SER  76           1HB      SER  76   4.826   5.963  -4.617
  558    HG   SER  76            HG      SER  76   4.545   5.548  -6.665
  559    H    LEU  77             H      LEU  77   1.725   2.579  -3.524
  560    HA   LEU  77            HA      LEU  77  -0.489   4.081  -2.522
  561   1HB   LEU  77           2HB      LEU  77  -0.390   1.698  -3.452
  562   2HB   LEU  77           1HB      LEU  77   0.192   1.201  -1.862
  563    HG   LEU  77            HG      LEU  77  -1.852   2.190  -0.840
  564   1HD1  LEU  77          3HD1      LEU  77  -2.401   2.805  -3.733
  565   2HD1  LEU  77          2HD1      LEU  77  -3.719   2.636  -2.574
  566   3HD1  LEU  77          1HD1      LEU  77  -2.494   3.878  -2.341
  567   1HD2  LEU  77          3HD2      LEU  77  -1.836  -0.054  -2.787
  568   2HD2  LEU  77          2HD2      LEU  77  -2.321  -0.041  -1.093
  569   3HD2  LEU  77          1HD2      LEU  77  -3.435   0.533  -2.330
  570    H    LEU  78             H      LEU  78   1.854   2.104  -0.531
  571    HA   LEU  78            HA      LEU  78   0.859   3.727   1.759
  572   1HB   LEU  78           2HB      LEU  78   2.170   1.538   2.839
  573   2HB   LEU  78           1HB      LEU  78   0.476   1.874   2.898
  574    HG   LEU  78            HG      LEU  78   1.807   0.419   0.589
  575   1HD1  LEU  78          3HD1      LEU  78   1.539  -0.580   3.157
  576   2HD1  LEU  78          2HD1      LEU  78   0.039  -1.116   2.388
  577   3HD1  LEU  78          1HD1      LEU  78   1.600  -1.560   1.692
  578   1HD2  LEU  78          3HD2      LEU  78  -0.572   1.681   0.578
  579   2HD2  LEU  78          2HD2      LEU  78  -0.328   0.159  -0.270
  580   3HD2  LEU  78          1HD2      LEU  78  -1.083   0.168   1.317
  581    H    GLN  79             H      GLN  79   2.848   4.951   0.229
  582    HA   GLN  79            HA      GLN  79   5.200   4.706   2.011
  583   1HB   GLN  79           2HB      GLN  79   6.528   5.623   0.163
  584   2HB   GLN  79           1HB      GLN  79   5.714   4.144  -0.313
  585   1HG   GLN  79           2HG      GLN  79   3.951   5.481  -1.379
  586   2HG   GLN  79           1HG      GLN  79   4.838   6.910  -0.928
  587   1HE2  GLN  79          2HE2      GLN  79   6.822   4.485  -3.544
  588   2HE2  GLN  79          1HE2      GLN  79   5.978   3.791  -2.250
  589    H    ASP  80             H      ASP  80   3.379   5.942   3.139
  590    HA   ASP  80            HA      ASP  80   2.158   8.166   3.112
  591   1HB   ASP  80           2HB      ASP  80   3.140   6.968   5.209
  592   2HB   ASP  80           1HB      ASP  80   4.340   8.262   5.159
  593    H    GLY  81             H      GLY  81   2.277   9.921   2.192
  594   1HA   GLY  81           2HA      GLY  81   3.088  12.199   1.808
  595   2HA   GLY  81           1HA      GLY  81   4.734  11.548   1.869
  596    H    GLU  82             H      GLU  82   2.144   9.822   0.313
  597    HA   GLU  82            HA      GLU  82   2.503  10.657  -2.314
  598   1HB   GLU  82           2HB      GLU  82   4.032   8.440  -1.223
  599   2HB   GLU  82           1HB      GLU  82   3.330   8.222  -2.779
  600   1HG   GLU  82           2HG      GLU  82   4.999   9.344  -3.716
  601   2HG   GLU  82           1HG      GLU  82   4.538  10.780  -2.781
  602    H    PHE  83             H      PHE  83   2.088   7.517  -0.777
  603    HA   PHE  83            HA      PHE  83   0.499   5.903  -1.144
  604   1HB   PHE  83           2HB      PHE  83  -1.953   7.142  -1.071
  605   2HB   PHE  83           1HB      PHE  83  -1.181   6.247   0.153
  606    HD1  PHE  83           HD1      PHE  83   0.629   7.499   1.572
  607    HD2  PHE  83           HD2      PHE  83  -2.532   9.360  -0.673
  608    HE1  PHE  83           HE1      PHE  83   0.648   9.465   3.110
  609    HE2  PHE  83           HE2      PHE  83  -2.462  11.330   0.825
  610    HZ   PHE  83            HZ      PHE  83  -0.869  11.366   2.724
  611    H    SER  84             H      SER  84   0.950   7.798  -3.764
  612    HA   SER  84            HA      SER  84  -1.498   7.057  -5.209
  613   1HB   SER  84           2HB      SER  84  -0.175   8.180  -7.132
  614   2HB   SER  84           1HB      SER  84  -0.801   9.182  -5.823
  615    HG   SER  84            HG      SER  84   1.179   9.597  -5.216
  616    H    MET  85             H      MET  85  -1.689   5.513  -6.543
  617    HA   MET  85            HA      MET  85   0.628   3.723  -7.214
  618   1HB   MET  85           2HB      MET  85  -1.242   3.291  -5.367
  619   2HB   MET  85           1HB      MET  85  -2.166   2.869  -6.744
  620   1HG   MET  85           2HG      MET  85  -0.454   1.161  -7.284
  621   2HG   MET  85           1HG      MET  85   0.292   1.587  -5.746
  622   1HE   MET  85           2HE      MET  85  -0.195  -1.072  -6.037
  623   2HE   MET  85           1HE      MET  85  -1.640  -1.817  -5.349
  624   3HE   MET  85           3HE      MET  85  -1.684  -1.185  -7.009
  625    H    ASP  86             H      ASP  86   0.719   3.444  -9.561
  626    HA   ASP  86            HA      ASP  86  -1.621   4.666 -11.018
  627   1HB   ASP  86           2HB      ASP  86   1.180   4.031 -11.603
  628   2HB   ASP  86           1HB      ASP  86   0.063   4.048 -12.936
  629    H    LEU  87             H      LEU  87  -3.082   2.801 -10.565
  630    HA   LEU  87            HA      LEU  87  -2.329   0.379 -12.017
  631   1HB   LEU  87           2HB      LEU  87  -4.765  -0.251 -11.040
  632   2HB   LEU  87           1HB      LEU  87  -3.262  -0.637 -10.292
  633    HG   LEU  87            HG      LEU  87  -4.812   0.257  -8.670
  634   1HD1  LEU  87          1HD1      LEU  87  -2.209   1.270  -9.112
  635   2HD1  LEU  87          3HD1      LEU  87  -3.212   2.568  -8.472
  636   3HD1  LEU  87          2HD1      LEU  87  -3.075   1.056  -7.608
  637   1HD2  LEU  87          1HD2      LEU  87  -5.020   2.521 -10.633
  638   2HD2  LEU  87          3HD2      LEU  87  -6.305   1.663  -9.794
  639   3HD2  LEU  87          2HD2      LEU  87  -5.300   2.827  -8.929
  640    NH1  ARG  88           NH2      ARG  88   0.816   3.030 -18.575
  641    NH2  ARG  88           NH1      ARG  88   0.707   1.756 -20.446
  642    H    ARG  88             H      ARG  88  -2.638   0.441 -14.056
  643    HA   ARG  88            HA      ARG  88  -5.053   1.925 -15.023
  644   1HB   ARG  88           2HB      ARG  88  -3.874   2.649 -16.889
  645   2HB   ARG  88           1HB      ARG  88  -2.555   2.472 -15.760
  646   1HG   ARG  88           2HG      ARG  88  -1.858   0.361 -16.782
  647   2HG   ARG  88           1HG      ARG  88  -3.331   0.255 -17.757
  648   1HD   ARG  88           2HD      ARG  88  -2.531   1.636 -19.334
  649   2HD   ARG  88           1HD      ARG  88  -1.917   2.799 -18.117
  650    HE   ARG  88            HE      ARG  88  -0.322   0.338 -18.375
  651   1HH1  ARG  88          1HH2      ARG  88   0.520   3.218 -17.638
  652   2HH1  ARG  88          2HH2      ARG  88   1.490   3.623 -19.016
  653   1HH2  ARG  88          2HH1      ARG  88   0.322   0.974 -20.940
  654   2HH2  ARG  88          1HH1      ARG  88   1.390   2.337 -20.888
  655    H    THR  89             H      THR  89  -6.324   1.177 -16.691
  656    HA   THR  89            HA      THR  89  -6.814  -1.664 -16.687
  657    HB   THR  89            HB      THR  89  -8.665  -1.172 -18.071
  658    HG1  THR  89           HG1      THR  89  -8.629   0.167 -19.645
  659   1HG2  THR  89          1HG2      THR  89  -8.266   0.401 -15.836
  660   2HG2  THR  89          3HG2      THR  89  -8.761   1.557 -17.079
  661   3HG2  THR  89          2HG2      THR  89  -9.802   0.182 -16.670
  662    H    LYS  90             H      LYS  90  -4.956  -2.665 -17.555
  663    HA   LYS  90            HA      LYS  90  -3.971  -1.720 -20.096
  664   1HB   LYS  90           2HB      LYS  90  -2.889  -4.217 -18.912
  665   2HB   LYS  90           1HB      LYS  90  -2.100  -2.885 -19.705
  666   1HG   LYS  90           2HG      LYS  90  -3.036  -1.674 -17.445
  667   2HG   LYS  90           1HG      LYS  90  -2.534  -3.259 -16.889
  668   1HD   LYS  90           2HD      LYS  90  -0.745  -1.722 -18.764
  669   2HD   LYS  90           1HD      LYS  90  -0.724  -1.351 -17.043
  670   1HE   LYS  90           2HE      LYS  90  -0.580  -4.053 -16.929
  671   2HE   LYS  90           1HE      LYS  90   0.228  -3.776 -18.471
  672   1HZ   LYS  90           2HZ      LYS  90   1.637  -2.122 -17.315
  673   2HZ   LYS  90           1HZ      LYS  90   0.939  -2.603 -15.844
  674   3HZ   LYS  90           3HZ      LYS  90   1.848  -3.712 -16.749
  675    H    SER  91             H      SER  91  -4.930  -2.369 -21.843
  676    HA   SER  91            HA      SER  91  -6.788  -4.580 -21.867
  677   1HB   SER  91           2HB      SER  91  -7.028  -2.214 -22.915
  678   2HB   SER  91           1HB      SER  91  -6.231  -2.941 -24.271
  679    HG   SER  91            HG      SER  91  -8.715  -3.476 -23.097
  680    H    THR  92             H      THR  92  -6.824  -5.417 -24.393
  681    HA   THR  92            HA      THR  92  -4.645  -7.338 -24.390
  682    HB   THR  92            HB      THR  92  -5.882  -8.401 -26.190
  683    HG1  THR  92           HG1      THR  92  -7.405  -6.013 -26.214
  684   1HG2  THR  92          3HG2      THR  92  -7.487  -7.248 -23.898
  685   2HG2  THR  92          2HG2      THR  92  -8.261  -8.290 -25.106
  686   3HG2  THR  92          1HG2      THR  92  -6.922  -8.910 -24.143
  687    H    GLY  93             H      GLY  93  -4.175  -7.832 -27.047
  688   1HA   GLY  93           2HA      GLY  93  -2.178  -5.838 -27.688
  689   2HA   GLY  93           1HA      GLY  93  -2.518  -7.299 -28.613
  690    H    GLY  94             H      GLY  94  -3.018  -3.937 -28.372
  691   1HA   GLY  94           2HA      GLY  94  -3.546  -2.688 -30.440
  692   2HA   GLY  94           1HA      GLY  94  -4.671  -3.978 -30.865
  693    H    ALA  95             H      ALA  95  -5.681  -4.156 -28.067
  694    HA   ALA  95            HA      ALA  95  -7.932  -2.431 -28.260
  695   1HB   ALA  95           3HB      ALA  95  -6.736  -4.099 -26.100
  696   2HB   ALA  95           2HB      ALA  95  -7.909  -2.861 -25.628
  697   3HB   ALA  95           1HB      ALA  95  -8.365  -4.128 -26.780
  698    HA   PRO  96            HA      PRO  96  -6.525   1.303 -26.432
  699   1HB   PRO  96           2HB      PRO  96  -8.903   2.319 -25.636
  700   2HB   PRO  96           1HB      PRO  96  -8.492   2.135 -27.352
  701   1HG   PRO  96           2HG      PRO  96 -10.401   0.530 -25.720
  702   2HG   PRO  96           1HG      PRO  96 -10.354   0.763 -27.465
  703   1HD   PRO  96           2HD      PRO  96  -9.376  -1.500 -26.004
  704   2HD   PRO  96           1HD      PRO  96  -9.263  -1.183 -27.751
  705    H    THR  97             H      THR  97  -5.623   1.674 -24.447
  706    HA   THR  97            HA      THR  97  -6.674   0.206 -22.049
  707    HB   THR  97            HB      THR  97  -4.560   1.030 -20.982
  708    HG1  THR  97           HG1      THR  97  -4.286   2.932 -22.144
  709   1HG2  THR  97          1HG2      THR  97  -4.832  -0.883 -23.076
  710   2HG2  THR  97          3HG2      THR  97  -3.311  -0.009 -23.361
  711   3HG2  THR  97          2HG2      THR  97  -3.578  -0.799 -21.809
  712    H    PHE  98             H      PHE  98  -6.290   1.580 -20.030
  713    HA   PHE  98            HA      PHE  98  -7.076   4.429 -20.120
  714   1HB   PHE  98           2HB      PHE  98  -8.856   2.192 -19.248
  715   2HB   PHE  98           1HB      PHE  98  -9.032   3.817 -18.700
  716    HD1  PHE  98           HD1      PHE  98  -8.920   5.711 -20.642
  717    HD2  PHE  98           HD2      PHE  98  -9.955   1.563 -21.213
  718    HE1  PHE  98           HE1      PHE  98 -10.030   6.318 -22.721
  719    HE2  PHE  98           HE2      PHE  98 -11.078   2.157 -23.344
  720    HZ   PHE  98            HZ      PHE  98 -11.111   4.505 -24.123
  721    H    ASN  99             H      ASN  99  -7.269   5.118 -17.669
  722    HA   ASN  99            HA      ASN  99  -5.513   3.378 -16.074
  723   1HB   ASN  99           2HB      ASN  99  -4.691   6.248 -16.215
  724   2HB   ASN  99           1HB      ASN  99  -3.718   4.828 -15.828
  725   1HD2  ASN  99          2HD2      ASN  99  -2.360   4.888 -19.042
  726   2HD2  ASN  99          1HD2      ASN  99  -2.119   4.802 -17.367
  727    H    VAL 100             H      VAL 100  -5.364   3.882 -13.876
  728    HA   VAL 100            HA      VAL 100  -7.410   5.669 -12.688
  729    HB   VAL 100            HB      VAL 100  -6.747   2.911 -11.558
  730   1HG1  VAL 100          1HG1      VAL 100  -8.132   5.029 -10.548
  731   2HG1  VAL 100          3HG1      VAL 100  -9.440   4.114 -11.290
  732   3HG1  VAL 100          2HG1      VAL 100  -8.402   3.359 -10.082
  733   1HG2  VAL 100          3HG2      VAL 100  -7.613   2.578 -13.896
  734   2HG2  VAL 100          2HG2      VAL 100  -8.763   2.008 -12.685
  735   3HG2  VAL 100          1HG2      VAL 100  -9.034   3.548 -13.497
  736    H    THR 101             H      THR 101  -6.647   6.480 -10.654
  737    HA   THR 101            HA      THR 101  -3.902   5.689  -9.830
  738    HB   THR 101            HB      THR 101  -5.262   8.429  -9.823
  739    HG1  THR 101           HG1      THR 101  -3.912   7.644 -11.591
  740   1HG2  THR 101          2HG2      THR 101  -4.302   8.004  -7.557
  741   2HG2  THR 101          1HG2      THR 101  -2.747   7.642  -8.299
  742   3HG2  THR 101          3HG2      THR 101  -3.429   9.254  -8.401
  743    H    VAL 102             H      VAL 102  -3.931   4.849  -7.848
  744    HA   VAL 102            HA      VAL 102  -6.338   5.209  -6.174
  745    HB   VAL 102            HB      VAL 102  -4.702   2.833  -6.971
  746   1HG1  VAL 102          1HG1      VAL 102  -4.341   2.970  -4.475
  747   2HG1  VAL 102          3HG1      VAL 102  -6.085   2.952  -4.252
  748   3HG1  VAL 102          2HG1      VAL 102  -5.263   1.558  -4.956
  749   1HG2  VAL 102          1HG2      VAL 102  -7.334   3.751  -7.192
  750   2HG2  VAL 102          3HG2      VAL 102  -6.733   2.149  -7.617
  751   3HG2  VAL 102          2HG2      VAL 102  -7.431   2.432  -6.025
  752    H    THR 103             H      THR 103  -5.982   6.506  -4.572
  753    HA   THR 103            HA      THR 103  -3.255   6.803  -3.410
  754    HB   THR 103            HB      THR 103  -4.273   8.958  -2.475
  755    HG1  THR 103           HG1      THR 103  -6.450   8.074  -3.282
  756   1HG2  THR 103          3HG2      THR 103  -3.143   8.299  -5.029
  757   2HG2  THR 103          2HG2      THR 103  -4.320   9.603  -5.244
  758   3HG2  THR 103          1HG2      THR 103  -2.977   9.793  -4.103
  759    H    LYS 104             H      LYS 104  -3.069   5.565  -1.532
  760    HA   LYS 104            HA      LYS 104  -5.513   5.096   0.118
  761   1HB   LYS 104           2HB      LYS 104  -4.236   3.106  -0.561
  762   2HB   LYS 104           1HB      LYS 104  -2.783   3.764   0.184
  763   1HG   LYS 104           2HG      LYS 104  -3.452   2.484   1.974
  764   2HG   LYS 104           1HG      LYS 104  -4.486   3.862   2.318
  765   1HD   LYS 104           2HD      LYS 104  -6.203   2.400   2.223
  766   2HD   LYS 104           1HD      LYS 104  -5.977   2.455   0.476
  767   1HE   LYS 104           2HE      LYS 104  -4.607   0.504   2.349
  768   2HE   LYS 104           1HE      LYS 104  -5.986   0.131   1.328
  769   1HZ   LYS 104           2HZ      LYS 104  -3.425   1.173   0.270
  770   2HZ   LYS 104           1HZ      LYS 104  -3.770  -0.484   0.395
  771   3HZ   LYS 104           3HZ      LYS 104  -4.712   0.503  -0.610
  772    H    THR 105             H      THR 105  -5.840   6.438   1.774
  773    HA   THR 105            HA      THR 105  -3.668   8.021   2.994
  774    HB   THR 105            HB      THR 105  -5.408   8.857   4.520
  775    HG1  THR 105           HG1      THR 105  -6.866   6.707   3.432
  776   1HG2  THR 105          2HG2      THR 105  -5.643   8.914   1.635
  777   2HG2  THR 105          1HG2      THR 105  -7.233   9.052   2.394
  778   3HG2  THR 105          3HG2      THR 105  -5.954  10.205   2.804
  779    H    ASP 106             H      ASP 106  -4.737   7.586   5.825
  780    HA   ASP 106            HA      ASP 106  -3.196   5.136   6.419
  781   1HB   ASP 106           2HB      ASP 106  -2.851   7.372   7.600
  782   2HB   ASP 106           1HB      ASP 106  -4.382   7.051   8.415
  783    H    LYS 107             H      LYS 107  -6.485   6.240   6.235
  784    HA   LYS 107            HA      LYS 107  -7.402   3.652   7.361
  785   1HB   LYS 107           2HB      LYS 107  -7.684   6.212   8.625
  786   2HB   LYS 107           1HB      LYS 107  -9.273   5.612   8.208
  787   1HG   LYS 107           2HG      LYS 107  -8.907   3.595   9.406
  788   2HG   LYS 107           1HG      LYS 107  -7.199   3.956   9.618
  789   1HD   LYS 107           2HD      LYS 107  -8.925   6.088  10.655
  790   2HD   LYS 107           1HD      LYS 107  -9.216   4.540  11.447
  791   1HE   LYS 107           2HE      LYS 107  -6.431   5.673  11.067
  792   2HE   LYS 107           1HE      LYS 107  -7.400   6.000  12.502
  793   1HZ   LYS 107           3HZ      LYS 107  -7.266   3.201  11.789
  794   2HZ   LYS 107           2HZ      LYS 107  -5.761   3.878  12.191
  795   3HZ   LYS 107           1HZ      LYS 107  -7.050   3.952  13.296
  796    H    THR 108             H      THR 108  -7.329   5.217   4.622
  797    HA   THR 108            HA      THR 108 -10.052   4.394   3.817
  798    HB   THR 108            HB      THR 108 -10.720   6.477   2.939
  799    HG1  THR 108           HG1      THR 108  -8.896   7.148   1.909
  800   1HG2  THR 108          1HG2      THR 108 -10.667   6.326   5.474
  801   2HG2  THR 108          3HG2      THR 108  -9.167   7.265   5.416
  802   3HG2  THR 108          2HG2      THR 108 -10.666   7.976   4.819
  803    H    LEU 109             H      LEU 109 -10.158   4.250   1.449
  804    HA   LEU 109            HA      LEU 109  -7.543   3.890   0.079
  805   1HB   LEU 109           2HB      LEU 109  -9.157   1.904   0.911
  806   2HB   LEU 109           1HB      LEU 109  -9.918   2.205  -0.628
  807    HG   LEU 109            HG      LEU 109  -7.212   1.079  -0.041
  808   1HD1  LEU 109          3HD1      LEU 109  -9.452   0.558  -1.980
  809   2HD1  LEU 109          2HD1      LEU 109  -7.927  -0.313  -1.989
  810   3HD1  LEU 109          1HD1      LEU 109  -8.982  -0.404  -0.591
  811   1HD2  LEU 109          3HD2      LEU 109  -7.982   2.626  -2.490
  812   2HD2  LEU 109          2HD2      LEU 109  -6.636   2.964  -1.399
  813   3HD2  LEU 109          1HD2      LEU 109  -6.625   1.515  -2.411
  814    H    VAL 110             H      VAL 110  -7.921   6.101  -0.957
  815    HA   VAL 110            HA      VAL 110 -10.418   6.604  -2.317
  816    HB   VAL 110            HB      VAL 110  -7.832   8.118  -1.927
  817   1HG1  VAL 110          1HG1      VAL 110  -9.772   8.504  -4.142
  818   2HG1  VAL 110          3HG1      VAL 110  -9.254   9.946  -3.289
  819   3HG1  VAL 110          2HG1      VAL 110  -8.070   8.915  -4.076
  820   1HG2  VAL 110          1HG2      VAL 110 -10.269   8.022  -0.606
  821   2HG2  VAL 110          3HG2      VAL 110  -9.095   9.338  -0.478
  822   3HG2  VAL 110          2HG2      VAL 110 -10.444   9.464  -1.621
  823    H    LEU 111             H      LEU 111 -10.757   6.712  -4.522
  824    HA   LEU 111            HA      LEU 111  -8.706   5.496  -6.276
  825   1HB   LEU 111           2HB      LEU 111 -11.590   4.717  -5.885
  826   2HB   LEU 111           1HB      LEU 111 -10.886   4.553  -7.484
  827    HG   LEU 111            HG      LEU 111  -9.040   3.575  -5.723
  828   1HD1  LEU 111          3HD1      LEU 111 -11.756   2.560  -5.023
  829   2HD1  LEU 111          2HD1      LEU 111 -10.265   1.745  -4.558
  830   3HD1  LEU 111          1HD1      LEU 111 -10.619   3.356  -3.938
  831   1HD2  LEU 111          2HD2      LEU 111  -9.663   2.790  -8.059
  832   2HD2  LEU 111          1HD2      LEU 111  -9.253   1.507  -6.915
  833   3HD2  LEU 111          3HD2      LEU 111 -10.949   1.868  -7.277
  834    H    LEU 112             H      LEU 112  -8.612   6.385  -8.282
  835    HA   LEU 112            HA      LEU 112 -10.607   8.416  -8.969
  836   1HB   LEU 112           2HB      LEU 112  -8.575   9.638  -8.207
  837   2HB   LEU 112           1HB      LEU 112  -7.626   8.663  -9.284
  838    HG   LEU 112            HG      LEU 112  -8.468   9.712 -11.235
  839   1HD1  LEU 112          1HD1      LEU 112 -10.836  10.155  -9.655
  840   2HD1  LEU 112          3HD1      LEU 112 -10.363  11.621 -10.514
  841   3HD1  LEU 112          2HD1      LEU 112 -10.643  10.125 -11.406
  842   1HD2  LEU 112          3HD2      LEU 112  -7.162  11.152  -9.384
  843   2HD2  LEU 112          2HD2      LEU 112  -7.530  11.716 -11.016
  844   3HD2  LEU 112          1HD2      LEU 112  -8.574  12.173  -9.664
  845    H    MET 113             H      MET 113 -11.548   7.183 -10.435
  846    HA   MET 113            HA      MET 113  -9.866   5.702 -12.421
  847   1HB   MET 113           2HB      MET 113 -12.120   4.867 -11.403
  848   2HB   MET 113           1HB      MET 113 -12.846   5.895 -12.593
  849   1HG   MET 113           2HG      MET 113 -11.320   4.750 -14.304
  850   2HG   MET 113           1HG      MET 113 -11.027   3.545 -13.063
  851   1HE   MET 113           2HE      MET 113 -11.519   2.083 -14.698
  852   2HE   MET 113           1HE      MET 113 -13.029   1.187 -14.564
  853   3HE   MET 113           3HE      MET 113 -12.783   2.324 -15.889
  854    H    GLY 114             H      GLY 114  -9.765   6.297 -14.553
  855   1HA   GLY 114           2HA      GLY 114 -11.390   8.422 -15.520
  856   2HA   GLY 114           1HA      GLY 114  -9.805   8.963 -15.162
  857    H    LYS 115             H      LYS 115 -11.471   8.624 -17.706
  858    HA   LYS 115            HA      LYS 115  -9.313   7.628 -19.228
  859   1HB   LYS 115           2HB      LYS 115 -12.090   6.785 -19.425
  860   2HB   LYS 115           1HB      LYS 115 -10.830   6.164 -20.364
  861   1HG   LYS 115           2HG      LYS 115  -9.896   5.104 -18.338
  862   2HG   LYS 115           1HG      LYS 115 -11.247   5.732 -17.434
  863   1HD   LYS 115           2HD      LYS 115 -12.839   4.548 -18.801
  864   2HD   LYS 115           1HD      LYS 115 -11.587   4.013 -19.898
  865   1HE   LYS 115           2HE      LYS 115 -10.721   2.476 -18.345
  866   2HE   LYS 115           1HE      LYS 115 -11.510   3.276 -16.991
  867   1HZ   LYS 115           1HZ      LYS 115 -13.664   2.622 -17.953
  868   2HZ   LYS 115           3HZ      LYS 115 -12.854   1.779 -19.183
  869   3HZ   LYS 115           2HZ      LYS 115 -12.708   1.272 -17.567
  870    H    GLU 116             H      GLU 116  -9.129   9.400 -20.646
  871    HA   GLU 116            HA      GLU 116 -11.091   9.424 -22.789
  872   1HB   GLU 116           2HB      GLU 116 -10.552  11.577 -21.458
  873   2HB   GLU 116           1HB      GLU 116  -9.158  11.579 -22.468
  874   1HG   GLU 116           2HG      GLU 116 -11.862  11.218 -23.690
  875   2HG   GLU 116           1HG      GLU 116 -11.287  12.842 -23.320
  876    H    GLY 117             H      GLY 117  -9.602   7.437 -23.669
  877   1HA   GLY 117           2HA      GLY 117  -7.454   6.622 -24.506
  878   2HA   GLY 117           1HA      GLY 117  -7.195   8.295 -25.005
  879    H    VAL 118             H      VAL 118  -7.722   8.395 -21.628
  880    HA   VAL 118            HA      VAL 118  -5.982   9.805 -20.554
  881    HB   VAL 118            HB      VAL 118  -7.785   8.908 -19.348
  882   1HG1  VAL 118          2HG1      VAL 118  -7.019   6.460 -20.259
  883   2HG1  VAL 118          1HG1      VAL 118  -6.410   6.408 -18.630
  884   3HG1  VAL 118          3HG1      VAL 118  -8.111   6.695 -18.887
  885   1HG2  VAL 118          1HG2      VAL 118  -5.071   9.081 -18.226
  886   2HG2  VAL 118          3HG2      VAL 118  -6.604   9.578 -17.518
  887   3HG2  VAL 118          2HG2      VAL 118  -6.028   7.913 -17.301
  888    H    HIS 119             H      HIS 119  -4.098  10.087 -20.012
  889    HA   HIS 119            HA      HIS 119  -1.882   8.384 -20.806
  890   1HB   HIS 119           2HB      HIS 119  -1.917  10.921 -20.823
  891   2HB   HIS 119           1HB      HIS 119  -1.872  10.883 -19.054
  892    HD1  HIS 119           HD1      HIS 119   0.418  11.970 -21.081
  893    HD2  HIS 119           HD2      HIS 119   0.457   8.347 -19.022
  894    HE1  HIS 119           HE1      HIS 119   2.852  11.308 -20.849
  895    H    GLY 120             H      GLY 120  -3.056   9.682 -17.683
  896   1HA   GLY 120           2HA      GLY 120  -3.406   8.165 -15.753
  897   2HA   GLY 120           1HA      GLY 120  -1.996   7.244 -16.304
  898    H    GLY 121             H      GLY 121  -1.709  10.712 -16.507
  899   1HA   GLY 121           2HA      GLY 121   0.048  10.701 -14.069
  900   2HA   GLY 121           1HA      GLY 121   0.367  11.693 -15.494
  901    H    LEU 122             H      LEU 122  -2.386  12.483 -15.887
  902    HA   LEU 122            HA      LEU 122  -2.552  14.748 -14.047
  903   1HB   LEU 122           2HB      LEU 122  -4.872  13.938 -15.836
  904   2HB   LEU 122           1HB      LEU 122  -4.296  15.554 -15.437
  905    HG   LEU 122            HG      LEU 122  -2.195  14.283 -16.843
  906   1HD1  LEU 122          2HD1      LEU 122  -4.450  12.902 -17.509
  907   2HD1  LEU 122          1HD1      LEU 122  -4.456  14.178 -18.727
  908   3HD1  LEU 122          3HD1      LEU 122  -3.063  13.107 -18.579
  909   1HD2  LEU 122          2HD2      LEU 122  -4.234  16.325 -17.770
  910   2HD2  LEU 122          1HD2      LEU 122  -2.740  16.689 -16.908
  911   3HD2  LEU 122          3HD2      LEU 122  -2.678  16.026 -18.540
  912    H    ILE 123             H      ILE 123  -4.232  11.675 -14.596
  913    HA   ILE 123            HA      ILE 123  -6.287  12.074 -12.592
  914    HB   ILE 123            HB      ILE 123  -4.997   9.728 -13.920
  915   1HG1  ILE 123          2HG1      ILE 123  -7.822  10.892 -14.030
  916   2HG1  ILE 123          1HG1      ILE 123  -6.562  11.132 -15.243
  917   1HG2  ILE 123          1HG2      ILE 123  -6.492   9.610 -11.415
  918   2HG2  ILE 123          3HG2      ILE 123  -7.366   8.753 -12.684
  919   3HG2  ILE 123          2HG2      ILE 123  -5.712   8.297 -12.293
  920   1HD1  ILE 123          1HD1      ILE 123  -6.467   8.601 -15.485
  921   2HD1  ILE 123          3HD1      ILE 123  -7.930   8.536 -14.495
  922   3HD1  ILE 123          2HD1      ILE 123  -7.962   9.360 -16.054
  923    H    ASN 124             H      ASN 124  -2.965  10.885 -12.614
  924    HA   ASN 124            HA      ASN 124  -2.821   9.962  -9.941
  925   1HB   ASN 124           2HB      ASN 124  -1.050   9.437 -11.540
  926   2HB   ASN 124           1HB      ASN 124  -0.695  11.150 -11.726
  927   1HD2  ASN 124          2HD2      ASN 124   1.252  11.360  -8.768
  928   2HD2  ASN 124          1HD2      ASN 124   0.521  12.213 -10.041
  929    H    LYS 125             H      LYS 125  -2.729  13.110 -11.471
  930    HA   LYS 125            HA      LYS 125  -1.766  14.526  -9.002
  931   1HB   LYS 125           2HB      LYS 125  -1.600  16.402 -10.405
  932   2HB   LYS 125           1HB      LYS 125  -1.680  15.179 -11.680
  933   1HG   LYS 125           2HG      LYS 125  -3.260  16.700 -12.431
  934   2HG   LYS 125           1HG      LYS 125  -4.270  15.628 -11.502
  935   1HD   LYS 125           2HD      LYS 125  -4.891  17.289 -10.135
  936   2HD   LYS 125           1HD      LYS 125  -3.203  17.553  -9.688
  937   1HE   LYS 125           2HE      LYS 125  -4.115  18.594 -12.337
  938   2HE   LYS 125           1HE      LYS 125  -4.658  19.451 -10.898
  939   1HZ   LYS 125           3HZ      LYS 125  -1.826  18.721 -11.129
  940   2HZ   LYS 125           2HZ      LYS 125  -2.401  20.046 -12.022
  941   3HZ   LYS 125           1HZ      LYS 125  -2.538  20.036 -10.330
  942    H    LYS 126             H      LYS 126  -4.846  13.934 -10.622
  943    HA   LYS 126            HA      LYS 126  -6.491  15.577  -8.897
  944   1HB   LYS 126           2HB      LYS 126  -7.041  13.579 -11.077
  945   2HB   LYS 126           1HB      LYS 126  -8.347  14.311 -10.135
  946   1HG   LYS 126           2HG      LYS 126  -7.864  16.477 -10.891
  947   2HG   LYS 126           1HG      LYS 126  -6.211  16.062 -11.323
  948   1HD   LYS 126           2HD      LYS 126  -8.237  14.518 -12.784
  949   2HD   LYS 126           1HD      LYS 126  -8.299  16.248 -13.089
  950   1HE   LYS 126           2HE      LYS 126  -5.574  15.641 -13.160
  951   2HE   LYS 126           1HE      LYS 126  -6.341  14.296 -14.020
  952   1HZ   LYS 126           1HZ      LYS 126  -7.642  16.505 -14.960
  953   2HZ   LYS 126           3HZ      LYS 126  -6.050  17.064 -14.777
  954   3HZ   LYS 126           2HZ      LYS 126  -6.364  15.704 -15.736
  955    H    CYS 127             H      CYS 127  -5.159  12.466  -8.588
  956    HA   CYS 127            HA      CYS 127  -7.247  11.481  -6.757
  957   1HB   CYS 127           2HB      CYS 127  -5.796  10.060  -8.459
  958   2HB   CYS 127           1HB      CYS 127  -4.627  10.114  -7.146
  959    HG   CYS 127            HG      CYS 127  -7.521   9.048  -6.663
  960    OH   TYR 128            OH      TYR 128   2.454  13.726  -2.365
  961    H    TYR 128             H      TYR 128  -3.991  12.770  -6.933
  962    HA   TYR 128            HA      TYR 128  -3.185  12.445  -4.201
  963   1HB   TYR 128           2HB      TYR 128  -2.040  13.357  -6.472
  964   2HB   TYR 128           1HB      TYR 128  -2.493  14.899  -5.772
  965    HD1  TYR 128           HD2      TYR 128  -2.085  13.642  -2.789
  966    HD2  TYR 128           HD1      TYR 128   0.268  13.989  -6.378
  967    HE1  TYR 128           HE2      TYR 128  -0.013  13.587  -1.424
  968    HE2  TYR 128           HE1      TYR 128   2.348  13.927  -5.002
  969    HH   TYR 128            HH      TYR 128   2.782  12.824  -2.357
  970    H    GLU 129             H      GLU 129  -5.252  14.752  -5.966
  971    HA   GLU 129            HA      GLU 129  -5.554  16.663  -3.745
  972   1HB   GLU 129           2HB      GLU 129  -6.970  16.265  -6.388
  973   2HB   GLU 129           1HB      GLU 129  -7.508  17.474  -5.217
  974   1HG   GLU 129           2HG      GLU 129  -5.171  18.408  -5.206
  975   2HG   GLU 129           1HG      GLU 129  -4.775  17.298  -6.522
  976    H    MET 130             H      MET 130  -7.523  14.031  -5.109
  977    HA   MET 130            HA      MET 130  -9.862  14.283  -3.496
  978   1HB   MET 130           2HB      MET 130  -9.116  12.675  -5.537
  979   2HB   MET 130           1HB      MET 130  -8.794  11.563  -4.223
  980   1HG   MET 130           2HG      MET 130 -11.200  12.027  -3.431
  981   2HG   MET 130           1HG      MET 130 -11.444  12.827  -5.000
  982   1HE   MET 130           1HE      MET 130 -13.118  10.884  -3.923
  983   2HE   MET 130           3HE      MET 130 -13.512  10.678  -5.637
  984   3HE   MET 130           2HE      MET 130 -13.145   9.274  -4.640
  985    H    ALA 131             H      ALA 131  -6.837  12.496  -2.931
  986    HA   ALA 131            HA      ALA 131  -7.483  11.625  -0.224
  987   1HB   ALA 131           1HB      ALA 131  -5.122  11.397  -2.084
  988   2HB   ALA 131           3HB      ALA 131  -4.859  11.185  -0.348
  989   3HB   ALA 131           2HB      ALA 131  -5.983  10.127  -1.197
  990    H    SER 132             H      SER 132  -6.158  14.486  -1.693
  991    HA   SER 132            HA      SER 132  -4.519  15.409   0.454
  992   1HB   SER 132           2HB      SER 132  -4.508  17.516  -0.610
  993   2HB   SER 132           1HB      SER 132  -4.791  16.418  -1.952
  994    HG   SER 132            HG      SER 132  -6.343  17.928  -2.184
  995    H    HIS 133             H      HIS 133  -8.036  15.441  -0.147
  996    HA   HIS 133            HA      HIS 133  -8.493  17.034   2.283
  997   1HB   HIS 133           2HB      HIS 133 -10.139  16.861   0.289
  998   2HB   HIS 133           1HB      HIS 133 -10.704  15.361   1.086
  999    HD1  HIS 133           HD1      HIS 133 -10.719  19.092   1.413
 1000    HD2  HIS 133           HD2      HIS 133 -11.666  15.788   3.777
 1001    HE1  HIS 133           HE1      HIS 133 -11.953  19.988   3.444
 1002    H    LEU 134             H      LEU 134  -8.544  13.595   1.290
 1003    HA   LEU 134            HA      LEU 134  -9.465  12.669   3.886
 1004   1HB   LEU 134           2HB      LEU 134  -8.029  11.349   1.615
 1005   2HB   LEU 134           1HB      LEU 134  -8.371  10.497   3.111
 1006    HG   LEU 134            HG      LEU 134 -10.779  11.676   2.593
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.357  11.273   0.030
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.049  10.807   0.098
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.573  12.463   0.460
 1010   1HD2  LEU 134          1HD2      LEU 134  -9.817   8.970   1.655
 1011   2HD2  LEU 134          3HD2      LEU 134 -10.420   9.342   3.268
 1012   3HD2  LEU 134          2HD2      LEU 134 -11.505   9.420   1.878
 1013    NH1  ARG 135           NH2      ARG 135   1.024  12.408   3.890
 1014    NH2  ARG 135           NH1      ARG 135   0.990  14.640   3.516
 1015    H    ARG 135             H      ARG 135  -6.562  14.046   2.952
 1016    HA   ARG 135            HA      ARG 135  -4.897  12.800   5.041
 1017   1HB   ARG 135           2HB      ARG 135  -4.476  14.835   2.875
 1018   2HB   ARG 135           1HB      ARG 135  -3.412  14.892   4.276
 1019   1HG   ARG 135           2HG      ARG 135  -3.143  12.323   3.830
 1020   2HG   ARG 135           1HG      ARG 135  -3.712  12.738   2.211
 1021   1HD   ARG 135           2HD      ARG 135  -1.426  13.053   1.928
 1022   2HD   ARG 135           1HD      ARG 135  -1.902  14.670   2.431
 1023    HE   ARG 135            HE      ARG 135  -1.326  13.479   4.826
 1024   1HH1  ARG 135          1HH2      ARG 135   0.542  11.557   4.093
 1025   2HH1  ARG 135          2HH2      ARG 135   2.016  12.404   3.774
 1026   1HH2  ARG 135          2HH1      ARG 135   0.482  15.497   3.435
 1027   2HH2  ARG 135          1HH1      ARG 135   1.983  14.633   3.396
 1028    NH1  ARG 136           NH1      ARG 136  -3.617  21.857   6.431
 1029    NH2  ARG 136           NH2      ARG 136  -4.199  22.343   4.297
 1030    H    ARG 136             H      ARG 136  -6.495  15.834   4.198
 1031    HA   ARG 136            HA      ARG 136  -5.968  17.059   6.787
 1032   1HB   ARG 136           2HB      ARG 136  -7.441  17.809   4.313
 1033   2HB   ARG 136           1HB      ARG 136  -7.897  18.616   5.813
 1034   1HG   ARG 136           2HG      ARG 136  -4.977  18.404   5.291
 1035   2HG   ARG 136           1HG      ARG 136  -5.873  19.486   4.228
 1036   1HD   ARG 136           2HD      ARG 136  -6.863  20.030   6.808
 1037   2HD   ARG 136           1HD      ARG 136  -5.118  19.870   7.010
 1038    HE   ARG 136            HE      ARG 136  -6.496  21.964   5.467
 1039   1HH1  ARG 136          2HH1      ARG 136  -3.857  21.500   7.334
 1040   2HH1  ARG 136          1HH1      ARG 136  -2.695  22.206   6.258
 1041   1HH2  ARG 136          1HH2      ARG 136  -4.883  22.357   3.567
 1042   2HH2  ARG 136          2HH2      ARG 136  -3.278  22.691   4.124
 1043    H    SER 137             H      SER 137  -7.998  14.617   5.789
 1044    HA   SER 137            HA      SER 137 -10.332  15.249   7.404
 1045   1HB   SER 137           2HB      SER 137 -11.208  13.209   6.534
 1046   2HB   SER 137           1HB      SER 137 -10.238  13.825   5.225
 1047    HG   SER 137            HG      SER 137  -9.762  11.653   5.562
 1048    H    GLN 138             H      GLN 138  -7.191  13.725   7.799
 1049    HA   GLN 138            HA      GLN 138  -6.121  12.984   9.773
 1050   1HB   GLN 138           2HB      GLN 138  -8.078  14.624  10.797
 1051   2HB   GLN 138           1HB      GLN 138  -8.484  13.083  11.547
 1052   1HG   GLN 138           2HG      GLN 138  -5.679  13.255  11.752
 1053   2HG   GLN 138           1HG      GLN 138  -6.258  14.877  12.126
 1054   1HE2  GLN 138          2HE2      GLN 138  -6.560  13.528  15.437
 1055   2HE2  GLN 138          1HE2      GLN 138  -5.574  14.458  14.414
 1056    OH   TYR 139            OH      TYR 139 -14.676   9.624   9.231
 1057    H    TYR 139             H      TYR 139  -7.930  11.321   7.938
 1058    HA   TYR 139            HA      TYR 139  -8.767   9.086   9.696
 1059   1HB   TYR 139           2HB      TYR 139  -9.052   9.756   6.784
 1060   2HB   TYR 139           1HB      TYR 139  -9.093   8.058   7.245
 1061    HD1  TYR 139           HD1      TYR 139 -10.501   7.848   9.685
 1062    HD2  TYR 139           HD2      TYR 139 -11.183  10.627   6.484
 1063    HE1  TYR 139           HE1      TYR 139 -12.867   8.090  10.392
 1064    HE2  TYR 139           HE2      TYR 139 -13.544  10.867   7.192
 1065    HH   TYR 139            HH      TYR 139 -14.912  10.553   9.175
   
  Start of MODEL          12
 Raw file had 1065 H/Q atoms
  Start of MODEL   12
    1   1H    ALA   1            3H      ALA   1 -20.888  17.870   1.408
    2   2H    ALA   1            2H      ALA   1 -22.267  17.338   2.246
    3   3H    ALA   1            1H      ALA   1 -21.168  18.394   2.995
    4    HA   ALA   1            HA      ALA   1 -20.561  16.412   3.934
    5   1HB   ALA   1           2HB      ALA   1 -22.085  15.325   1.911
    6   2HB   ALA   1           1HB      ALA   1 -20.467  14.760   1.493
    7   3HB   ALA   1           3HB      ALA   1 -21.149  14.391   3.076
    8    H    GLY   2             H      GLY   2 -19.470  16.176   0.523
    9   1HA   GLY   2           2HA      GLY   2 -17.219  17.404   0.096
   10   2HA   GLY   2           1HA      GLY   2 -16.654  16.478   1.486
   11    CH2  TRP   3           CH2      TRP   3 -13.528  11.331   3.229
   12    H    TRP   3             H      TRP   3 -17.890  14.018   0.994
   13    HA   TRP   3            HA      TRP   3 -16.130  12.628  -0.654
   14   1HB   TRP   3           2HB      TRP   3 -18.800  12.079   0.314
   15   2HB   TRP   3           1HB      TRP   3 -18.158  11.018  -0.879
   16    HD1  TRP   3           HD1      TRP   3 -18.451   9.361   1.264
   17    HE1  TRP   3           HE1      TRP   3 -16.737   8.625   3.016
   18    HE3  TRP   3           HE3      TRP   3 -15.081  13.128   0.812
   19    HZ2  TRP   3           HZ2      TRP   3 -14.267   9.508   4.076
   20    HZ3  TRP   3           HZ3      TRP   3 -13.043  13.149   2.200
   21    HH2  TRP   3           HH2      TRP   3 -12.635  11.343   3.838
   22    H    ASN   4             H      ASN   4 -19.486  13.463  -1.542
   23    HA   ASN   4            HA      ASN   4 -19.368  12.600  -4.229
   24   1HB   ASN   4           2HB      ASN   4 -21.064  14.815  -3.044
   25   2HB   ASN   4           1HB      ASN   4 -21.368  14.017  -4.589
   26   1HD2  ASN   4          2HD2      ASN   4 -22.784  11.123  -3.125
   27   2HD2  ASN   4          1HD2      ASN   4 -22.266  11.873  -4.557
   28    H    ALA   5             H      ALA   5 -17.992  15.433  -2.861
   29    HA   ALA   5            HA      ALA   5 -17.846  17.009  -5.353
   30   1HB   ALA   5           1HB      ALA   5 -17.763  17.967  -2.967
   31   2HB   ALA   5           3HB      ALA   5 -16.119  17.338  -2.869
   32   3HB   ALA   5           2HB      ALA   5 -16.527  18.563  -4.072
   33    OH   TYR   6            OH      TYR   6 -13.996  17.450   0.682
   34    H    TYR   6             H      TYR   6 -15.830  14.823  -3.480
   35    HA   TYR   6            HA      TYR   6 -13.497  15.021  -5.186
   36   1HB   TYR   6           2HB      TYR   6 -14.130  12.748  -3.290
   37   2HB   TYR   6           1HB      TYR   6 -12.549  13.379  -3.745
   38    HD1  TYR   6           HD1      TYR   6 -13.219  16.330  -3.635
   39    HD2  TYR   6           HD2      TYR   6 -14.078  13.165  -0.906
   40    HE1  TYR   6           HE1      TYR   6 -13.402  17.994  -1.813
   41    HE2  TYR   6           HE2      TYR   6 -14.272  14.832   0.934
   42    HH   TYR   6            HH      TYR   6 -14.798  17.952   0.511
   43    H    ILE   7             H      ILE   7 -16.510  13.559  -5.380
   44    HA   ILE   7            HA      ILE   7 -15.752  11.622  -7.470
   45    HB   ILE   7            HB      ILE   7 -18.336  12.225  -6.094
   46   1HG1  ILE   7          2HG1      ILE   7 -16.402  10.819  -5.113
   47   2HG1  ILE   7          1HG1      ILE   7 -18.018  10.129  -5.055
   48   1HG2  ILE   7          1HG2      ILE   7 -17.805  10.571  -8.542
   49   2HG2  ILE   7          3HG2      ILE   7 -19.164  10.218  -7.471
   50   3HG2  ILE   7          2HG2      ILE   7 -19.067  11.780  -8.298
   51   1HD1  ILE   7          3HD1      ILE   7 -16.540   9.508  -7.518
   52   2HD1  ILE   7          2HD1      ILE   7 -15.778   8.869  -6.061
   53   3HD1  ILE   7          1HD1      ILE   7 -17.443   8.438  -6.451
   54    H    ASP   8             H      ASP   8 -17.062  14.805  -6.926
   55    HA   ASP   8            HA      ASP   8 -18.083  15.398  -9.476
   56   1HB   ASP   8           2HB      ASP   8 -17.336  16.934  -7.118
   57   2HB   ASP   8           1HB      ASP   8 -17.427  17.821  -8.586
   58    H    ASN   9             H      ASN   9 -14.947  14.914  -8.293
   59    HA   ASN   9            HA      ASN   9 -13.353  16.483  -9.956
   60   1HB   ASN   9           2HB      ASN   9 -12.073  15.510  -8.315
   61   2HB   ASN   9           1HB      ASN   9 -13.168  14.268  -8.073
   62   1HD2  ASN   9          2HD2      ASN   9 -10.871  11.740  -9.282
   63   2HD2  ASN   9          1HD2      ASN   9 -12.016  12.207  -8.086
   64    H    LEU  10             H      LEU  10 -13.793  13.140 -10.288
   65    HA   LEU  10            HA      LEU  10 -13.075  12.405 -12.784
   66   1HB   LEU  10           2HB      LEU  10 -15.671  11.492 -11.643
   67   2HB   LEU  10           1HB      LEU  10 -14.644  10.613 -12.762
   68    HG   LEU  10            HG      LEU  10 -14.205   9.603 -10.798
   69   1HD1  LEU  10          3HD1      LEU  10 -12.200  11.839 -10.937
   70   2HD1  LEU  10          2HD1      LEU  10 -11.985  10.446  -9.922
   71   3HD1  LEU  10          1HD1      LEU  10 -12.066  10.264 -11.655
   72   1HD2  LEU  10          1HD2      LEU  10 -15.039  12.148  -9.641
   73   2HD2  LEU  10          3HD2      LEU  10 -15.303  10.563  -9.021
   74   3HD2  LEU  10          2HD2      LEU  10 -13.785  11.397  -8.719
   75    H    MET  11             H      MET  11 -15.965  13.925 -11.818
   76    HA   MET  11            HA      MET  11 -17.110  13.639 -14.495
   77   1HB   MET  11           2HB      MET  11 -18.066  15.298 -12.118
   78   2HB   MET  11           1HB      MET  11 -19.053  14.625 -13.419
   79   1HG   MET  11           2HG      MET  11 -17.431  12.541 -11.800
   80   2HG   MET  11           1HG      MET  11 -18.791  13.339 -10.966
   81   1HE   MET  11           3HE      MET  11 -17.450  10.915 -12.996
   82   2HE   MET  11           2HE      MET  11 -18.743   9.966 -13.725
   83   3HE   MET  11           1HE      MET  11 -18.095  11.361 -14.582
   84    H    ALA  12             H      ALA  12 -15.844  16.233 -12.539
   85    HA   ALA  12            HA      ALA  12 -15.840  18.375 -14.524
   86   1HB   ALA  12           1HB      ALA  12 -14.823  18.148 -11.648
   87   2HB   ALA  12           3HB      ALA  12 -14.764  19.643 -12.623
   88   3HB   ALA  12           2HB      ALA  12 -16.329  18.935 -12.208
   89    H    ASP  13             H      ASP  13 -13.822  15.805 -14.056
   90    HA   ASP  13            HA      ASP  13 -11.164  16.996 -13.873
   91   1HB   ASP  13           2HB      ASP  13 -10.512  14.601 -14.048
   92   2HB   ASP  13           1HB      ASP  13 -11.857  14.820 -12.934
   93    H    GLY  14             H      GLY  14 -13.096  16.339 -16.624
   94   1HA   GLY  14           2HA      GLY  14 -12.421  15.525 -18.819
   95   2HA   GLY  14           1HA      GLY  14 -11.552  17.037 -18.766
   96    H    THR  15             H      THR  15 -10.875  14.032 -16.970
   97    HA   THR  15            HA      THR  15  -8.488  13.329 -18.500
   98    HB   THR  15            HB      THR  15  -8.504  14.537 -15.754
   99    HG1  THR  15           HG1      THR  15  -8.090  15.968 -17.371
  100   1HG2  THR  15          2HG2      THR  15  -6.877  12.387 -16.776
  101   2HG2  THR  15          1HG2      THR  15  -5.923  13.765 -16.269
  102   3HG2  THR  15          3HG2      THR  15  -7.030  13.010 -15.141
  103    H    CYS  16             H      CYS  16 -10.080  12.908 -15.354
  104    HA   CYS  16            HA      CYS  16  -9.586   9.957 -15.503
  105   1HB   CYS  16           2HB      CYS  16 -11.069  10.131 -13.212
  106   2HB   CYS  16           1HB      CYS  16  -9.336  10.263 -13.249
  107    HG   CYS  16            HG      CYS  16  -9.545  12.611 -12.542
  108    H    GLN  17             H      GLN  17 -11.699   8.811 -14.572
  109    HA   GLN  17            HA      GLN  17 -13.812   9.304 -16.491
  110   1HB   GLN  17           2HB      GLN  17 -11.759   7.786 -17.052
  111   2HB   GLN  17           1HB      GLN  17 -12.666   6.593 -16.155
  112   1HG   GLN  17           2HG      GLN  17 -14.206   8.091 -18.143
  113   2HG   GLN  17           1HG      GLN  17 -12.864   7.142 -18.821
  114   1HE2  GLN  17          2HE2      GLN  17 -16.227   5.225 -17.845
  115   2HE2  GLN  17          1HE2      GLN  17 -16.118   6.903 -18.084
  116    H    ASP  18             H      ASP  18 -12.554   7.241 -13.903
  117    HA   ASP  18            HA      ASP  18 -15.141   7.237 -12.497
  118   1HB   ASP  18           2HB      ASP  18 -14.265   5.018 -13.613
  119   2HB   ASP  18           1HB      ASP  18 -13.376   4.936 -12.103
  120    H    ALA  19             H      ALA  19 -14.607   6.336 -10.102
  121    HA   ALA  19            HA      ALA  19 -12.088   7.403  -8.903
  122   1HB   ALA  19           3HB      ALA  19 -14.637   8.844  -9.136
  123   2HB   ALA  19           2HB      ALA  19 -13.856   8.869  -7.538
  124   3HB   ALA  19           1HB      ALA  19 -12.991   9.398  -8.949
  125    H    ALA  20             H      ALA  20 -11.875   6.115  -6.955
  126    HA   ALA  20            HA      ALA  20 -14.493   5.365  -5.665
  127   1HB   ALA  20           2HB      ALA  20 -12.600   3.463  -6.739
  128   2HB   ALA  20           1HB      ALA  20 -13.010   3.153  -5.042
  129   3HB   ALA  20           3HB      ALA  20 -14.275   3.275  -6.252
  130    H    ILE  21             H      ILE  21 -14.478   6.422  -3.916
  131    HA   ILE  21            HA      ILE  21 -12.072   6.430  -2.161
  132    HB   ILE  21            HB      ILE  21 -14.850   7.528  -1.581
  133   1HG1  ILE  21          2HG1      ILE  21 -12.472   8.733  -3.028
  134   2HG1  ILE  21          1HG1      ILE  21 -14.157   8.711  -3.536
  135   1HG2  ILE  21          2HG2      ILE  21 -12.911   7.038   0.199
  136   2HG2  ILE  21          1HG2      ILE  21 -12.285   8.571  -0.410
  137   3HG2  ILE  21          3HG2      ILE  21 -13.893   8.498   0.312
  138   1HD1  ILE  21          3HD1      ILE  21 -14.417  10.074  -1.232
  139   2HD1  ILE  21          2HD1      ILE  21 -12.763  10.520  -1.651
  140   3HD1  ILE  21          1HD1      ILE  21 -14.081  10.869  -2.772
  141    H    VAL  22             H      VAL  22 -11.913   4.508  -0.952
  142    HA   VAL  22            HA      VAL  22 -14.488   3.095  -0.396
  143    HB   VAL  22            HB      VAL  22 -11.820   1.805  -1.079
  144   1HG1  VAL  22          1HG1      VAL  22 -13.691   0.607   0.348
  145   2HG1  VAL  22          3HG1      VAL  22 -14.490   0.435  -1.215
  146   3HG1  VAL  22          2HG1      VAL  22 -12.887  -0.262  -0.958
  147   1HG2  VAL  22          1HG2      VAL  22 -13.094   3.146  -2.930
  148   2HG2  VAL  22          3HG2      VAL  22 -12.569   1.498  -3.292
  149   3HG2  VAL  22          2HG2      VAL  22 -14.255   1.819  -2.864
  150    H    GLY  23             H      GLY  23 -14.781   3.141   1.878
  151   1HA   GLY  23           2HA      GLY  23 -12.640   3.307   3.824
  152   2HA   GLY  23           1HA      GLY  23 -14.302   2.814   4.184
  153    OH   TYR  24            OH      TYR  24  -5.265   1.040   5.300
  154    H    TYR  24             H      TYR  24 -11.215   1.681   3.105
  155    HA   TYR  24            HA      TYR  24 -11.864  -1.095   2.806
  156   1HB   TYR  24           2HB      TYR  24  -9.728  -1.226   1.787
  157   2HB   TYR  24           1HB      TYR  24 -10.130   0.438   1.587
  158    HD1  TYR  24           HD2      TYR  24  -9.565   1.821   4.019
  159    HD2  TYR  24           HD1      TYR  24  -7.562  -1.561   2.378
  160    HE1  TYR  24           HE2      TYR  24  -7.552   2.399   5.328
  161    HE2  TYR  24           HE1      TYR  24  -5.534  -1.010   3.644
  162    HH   TYR  24            HH      TYR  24  -4.908   0.223   5.659
  163    H    LYS  25             H      LYS  25 -12.219  -0.007   5.596
  164    HA   LYS  25            HA      LYS  25 -10.143  -0.822   7.321
  165   1HB   LYS  25           2HB      LYS  25 -13.040  -0.340   7.684
  166   2HB   LYS  25           1HB      LYS  25 -12.052  -0.865   9.014
  167   1HG   LYS  25           2HG      LYS  25 -12.019   1.489   9.174
  168   2HG   LYS  25           1HG      LYS  25 -10.490   1.073   8.405
  169   1HD   LYS  25           2HD      LYS  25 -11.171   1.797   6.331
  170   2HD   LYS  25           1HD      LYS  25 -12.885   1.588   6.703
  171   1HE   LYS  25           2HE      LYS  25 -11.053   3.682   7.877
  172   2HE   LYS  25           1HE      LYS  25 -12.297   3.961   6.669
  173   1HZ   LYS  25           1HZ      LYS  25 -13.796   2.812   8.468
  174   2HZ   LYS  25           3HZ      LYS  25 -12.589   3.366   9.525
  175   3HZ   LYS  25           2HZ      LYS  25 -13.445   4.470   8.563
  176    H    ASP  26             H      ASP  26 -11.580  -2.580   9.080
  177    HA   ASP  26            HA      ASP  26 -10.844  -5.169   8.324
  178   1HB   ASP  26           2HB      ASP  26 -12.955  -5.888   9.705
  179   2HB   ASP  26           1HB      ASP  26 -11.575  -5.189  10.518
  180    H    SER  27             H      SER  27 -14.088  -3.827   8.007
  181    HA   SER  27            HA      SER  27 -14.659  -5.654   5.772
  182   1HB   SER  27           2HB      SER  27 -17.008  -4.755   6.245
  183   2HB   SER  27           1HB      SER  27 -16.364  -5.895   7.387
  184    HG   SER  27            HG      SER  27 -16.641  -4.391   8.816
  185    HA   PRO  28            HA      PRO  28 -13.916  -1.868   3.609
  186   1HB   PRO  28           2HB      PRO  28 -14.042  -2.881   1.067
  187   2HB   PRO  28           1HB      PRO  28 -12.615  -2.980   2.120
  188   1HG   PRO  28           2HG      PRO  28 -14.476  -5.126   1.345
  189   2HG   PRO  28           1HG      PRO  28 -12.871  -5.230   2.033
  190   1HD   PRO  28           2HD      PRO  28 -15.358  -5.584   3.373
  191   2HD   PRO  28           1HD      PRO  28 -13.719  -5.664   4.058
  192    H    SER  29             H      SER  29 -15.027  -0.422   2.139
  193    HA   SER  29            HA      SER  29 -17.659  -1.042   1.197
  194   1HB   SER  29           2HB      SER  29 -18.772   0.704   2.612
  195   2HB   SER  29           1HB      SER  29 -18.247  -0.708   3.524
  196    HG   SER  29            HG      SER  29 -17.674   1.619   4.201
  197    H    VAL  30             H      VAL  30 -18.487   0.697  -0.080
  198    HA   VAL  30            HA      VAL  30 -16.358   2.367  -1.137
  199    HB   VAL  30            HB      VAL  30 -19.152   1.672  -2.001
  200   1HG1  VAL  30          2HG1      VAL  30 -18.334   4.073  -2.617
  201   2HG1  VAL  30          1HG1      VAL  30 -17.161   3.239  -3.633
  202   3HG1  VAL  30          3HG1      VAL  30 -18.884   3.030  -3.909
  203   1HG2  VAL  30          1HG2      VAL  30 -17.318  -0.007  -2.140
  204   2HG2  VAL  30          3HG2      VAL  30 -17.911   0.468  -3.714
  205   3HG2  VAL  30          2HG2      VAL  30 -16.401   1.126  -3.132
  206    CH2  TRP  31           CH2      TRP  31 -13.665   5.995   6.492
  207    H    TRP  31             H      TRP  31 -16.057   4.122   0.128
  208    HA   TRP  31            HA      TRP  31 -18.118   5.487   1.564
  209   1HB   TRP  31           2HB      TRP  31 -15.208   5.954   0.993
  210   2HB   TRP  31           1HB      TRP  31 -16.162   7.274   1.669
  211    HD1  TRP  31           HD1      TRP  31 -17.580   4.075   2.850
  212    HE1  TRP  31           HE1      TRP  31 -16.859   3.567   5.220
  213    HE3  TRP  31           HE3      TRP  31 -13.727   7.431   3.410
  214    HZ2  TRP  31           HZ2      TRP  31 -14.965   4.422   7.151
  215    HZ3  TRP  31           HZ3      TRP  31 -12.523   7.551   5.568
  216    HH2  TRP  31           HH2      TRP  31 -13.125   6.047   7.423
  217    H    ALA  32             H      ALA  32 -16.818   5.756  -1.653
  218    HA   ALA  32            HA      ALA  32 -18.984   7.315  -2.626
  219   1HB   ALA  32           2HB      ALA  32 -17.980   9.162  -1.316
  220   2HB   ALA  32           1HB      ALA  32 -16.444   8.934  -2.169
  221   3HB   ALA  32           3HB      ALA  32 -17.876   9.506  -3.058
  222    H    ALA  33             H      ALA  33 -18.737   5.634  -4.232
  223    HA   ALA  33            HA      ALA  33 -16.517   6.071  -6.158
  224   1HB   ALA  33           3HB      ALA  33 -18.205   3.581  -5.658
  225   2HB   ALA  33           2HB      ALA  33 -17.093   3.765  -7.017
  226   3HB   ALA  33           1HB      ALA  33 -16.465   3.759  -5.372
  227    H    VAL  34             H      VAL  34 -17.123   6.576  -8.237
  228    HA   VAL  34            HA      VAL  34 -19.642   7.705  -8.845
  229    HB   VAL  34            HB      VAL  34 -17.645   6.367 -10.738
  230   1HG1  VAL  34          1HG1      VAL  34 -20.067   8.119 -11.283
  231   2HG1  VAL  34          3HG1      VAL  34 -18.799   7.813 -12.469
  232   3HG1  VAL  34          2HG1      VAL  34 -19.791   6.472 -11.870
  233   1HG2  VAL  34          2HG2      VAL  34 -17.269   8.574  -9.200
  234   2HG2  VAL  34          1HG2      VAL  34 -16.571   8.405 -10.812
  235   3HG2  VAL  34          3HG2      VAL  34 -18.063   9.319 -10.587
  236    HA   PRO  35            HA      PRO  35 -21.774   3.705  -8.439
  237   1HB   PRO  35           2HB      PRO  35 -24.331   4.723  -8.346
  238   2HB   PRO  35           1HB      PRO  35 -23.242   4.630  -6.949
  239   1HG   PRO  35           2HG      PRO  35 -23.982   7.014  -8.603
  240   2HG   PRO  35           1HG      PRO  35 -23.522   6.935  -6.893
  241   1HD   PRO  35           2HD      PRO  35 -21.827   7.759  -8.972
  242   2HD   PRO  35           1HD      PRO  35 -21.287   7.220  -7.368
  243    H    GLY  36             H      GLY  36 -23.241   2.408  -9.653
  244   1HA   GLY  36           2HA      GLY  36 -24.501   1.757 -11.547
  245   2HA   GLY  36           1HA      GLY  36 -24.334   3.390 -12.186
  246    H    LYS  37             H      LYS  37 -21.211   2.493 -11.340
  247    HA   LYS  37            HA      LYS  37 -20.704   1.565 -14.135
  248   1HB   LYS  37           2HB      LYS  37 -18.688   2.847 -12.293
  249   2HB   LYS  37           1HB      LYS  37 -18.563   2.618 -14.036
  250   1HG   LYS  37           2HG      LYS  37 -20.473   4.480 -12.566
  251   2HG   LYS  37           1HG      LYS  37 -19.159   4.942 -13.646
  252   1HD   LYS  37           2HD      LYS  37 -20.667   3.246 -15.239
  253   2HD   LYS  37           1HD      LYS  37 -21.902   4.080 -14.301
  254   1HE   LYS  37           2HE      LYS  37 -21.624   5.957 -15.509
  255   2HE   LYS  37           1HE      LYS  37 -19.891   5.963 -15.188
  256   1HZ   LYS  37           1HZ      LYS  37 -21.152   4.214 -17.216
  257   2HZ   LYS  37           3HZ      LYS  37 -20.548   5.756 -17.576
  258   3HZ   LYS  37           2HZ      LYS  37 -19.497   4.547 -17.011
  259    H    THR  38             H      THR  38 -18.784   1.215 -11.085
  260    HA   THR  38            HA      THR  38 -18.925  -1.661 -11.038
  261    HB   THR  38            HB      THR  38 -16.893  -0.407 -12.787
  262    HG1  THR  38           HG1      THR  38 -17.315  -2.172 -14.019
  263   1HG2  THR  38          1HG2      THR  38 -16.210  -2.748 -11.007
  264   2HG2  THR  38          3HG2      THR  38 -15.406  -2.501 -12.557
  265   3HG2  THR  38          2HG2      THR  38 -15.256  -1.284 -11.283
  266    H    PHE  39             H      PHE  39 -16.995   1.158 -10.309
  267    HA   PHE  39            HA      PHE  39 -15.267   0.133  -8.329
  268   1HB   PHE  39           2HB      PHE  39 -16.437   2.804  -8.925
  269   2HB   PHE  39           1HB      PHE  39 -15.431   2.572  -7.512
  270    HD1  PHE  39           HD2      PHE  39 -14.916   0.607 -10.615
  271    HD2  PHE  39           HD1      PHE  39 -13.600   3.975  -8.328
  272    HE1  PHE  39           HE2      PHE  39 -12.901   0.736 -11.986
  273    HE2  PHE  39           HE1      PHE  39 -11.539   4.118  -9.695
  274    HZ   PHE  39            HZ      PHE  39 -11.233   2.439 -11.531
  275    H    VAL  40             H      VAL  40 -18.471   1.481  -7.960
  276    HA   VAL  40            HA      VAL  40 -18.523   1.575  -5.148
  277    HB   VAL  40            HB      VAL  40 -20.136   2.864  -6.333
  278   1HG1  VAL  40          3HG1      VAL  40 -20.760   0.245  -7.671
  279   2HG1  VAL  40          2HG1      VAL  40 -21.949   1.550  -7.651
  280   3HG1  VAL  40          1HG1      VAL  40 -20.366   1.808  -8.397
  281   1HG2  VAL  40          2HG2      VAL  40 -20.807   1.226  -4.246
  282   2HG2  VAL  40          1HG2      VAL  40 -21.859   2.481  -4.903
  283   3HG2  VAL  40          3HG2      VAL  40 -22.051   0.809  -5.428
  284    H    ASN  41             H      ASN  41 -18.668  -1.114  -7.284
  285    HA   ASN  41            HA      ASN  41 -19.978  -2.878  -5.353
  286   1HB   ASN  41           2HB      ASN  41 -18.979  -3.119  -8.161
  287   2HB   ASN  41           1HB      ASN  41 -19.241  -4.548  -7.192
  288   1HD2  ASN  41          2HD2      ASN  41 -22.827  -3.956  -6.926
  289   2HD2  ASN  41          1HD2      ASN  41 -21.525  -4.453  -5.956
  290    H    ILE  42             H      ILE  42 -17.211  -1.430  -4.965
  291    HA   ILE  42            HA      ILE  42 -15.215  -3.477  -5.103
  292    HB   ILE  42            HB      ILE  42 -15.422  -0.714  -3.913
  293   1HG1  ILE  42          2HG1      ILE  42 -13.258  -1.982  -5.614
  294   2HG1  ILE  42          1HG1      ILE  42 -14.754  -1.369  -6.315
  295   1HG2  ILE  42          3HG2      ILE  42 -13.367  -2.787  -3.126
  296   2HG2  ILE  42          2HG2      ILE  42 -12.962  -1.075  -3.146
  297   3HG2  ILE  42          1HG2      ILE  42 -14.243  -1.664  -2.097
  298   1HD1  ILE  42          1HD1      ILE  42 -13.851   0.693  -4.629
  299   2HD1  ILE  42          3HD1      ILE  42 -12.401   0.102  -5.445
  300   3HD1  ILE  42          2HD1      ILE  42 -13.781   0.674  -6.396
  301    H    THR  43             H      THR  43 -15.150  -5.193  -3.899
  302    HA   THR  43            HA      THR  43 -16.321  -5.438  -1.176
  303    HB   THR  43            HB      THR  43 -15.934  -7.951  -1.883
  304    HG1  THR  43           HG1      THR  43 -15.525  -8.359  -3.918
  305   1HG2  THR  43          1HG2      THR  43 -17.942  -6.040  -2.946
  306   2HG2  THR  43          3HG2      THR  43 -17.959  -7.702  -3.541
  307   3HG2  THR  43          2HG2      THR  43 -18.171  -7.383  -1.822
  308    HA   PRO  44            HA      PRO  44 -12.220  -6.199   0.509
  309   1HB   PRO  44           2HB      PRO  44 -12.324  -8.568   1.769
  310   2HB   PRO  44           1HB      PRO  44 -12.964  -7.096   2.444
  311   1HG   PRO  44           2HG      PRO  44 -14.429  -9.403   1.243
  312   2HG   PRO  44           1HG      PRO  44 -14.976  -8.250   2.475
  313   1HD   PRO  44           2HD      PRO  44 -15.712  -8.176  -0.192
  314   2HD   PRO  44           1HD      PRO  44 -15.839  -6.807   0.901
  315    H    ALA  45             H      ALA  45 -13.236  -8.031  -1.972
  316    HA   ALA  45            HA      ALA  45 -10.951  -9.825  -2.227
  317   1HB   ALA  45           3HB      ALA  45 -13.428  -9.259  -3.794
  318   2HB   ALA  45           2HB      ALA  45 -12.088 -10.119  -4.559
  319   3HB   ALA  45           1HB      ALA  45 -12.870 -10.801  -3.134
  320    H    GLU  46             H      GLU  46 -12.421  -7.419  -4.264
  321    HA   GLU  46            HA      GLU  46 -10.115  -6.809  -5.877
  322   1HB   GLU  46           2HB      GLU  46 -11.409  -4.450  -6.072
  323   2HB   GLU  46           1HB      GLU  46 -11.974  -5.875  -6.927
  324   1HG   GLU  46           2HG      GLU  46 -12.979  -5.566  -4.168
  325   2HG   GLU  46           1HG      GLU  46 -13.488  -4.318  -5.296
  326    H    VAL  47             H      VAL  47 -11.282  -5.547  -2.813
  327    HA   VAL  47            HA      VAL  47  -9.121  -3.645  -2.551
  328    HB   VAL  47            HB      VAL  47 -11.602  -4.182  -1.151
  329   1HG1  VAL  47          3HG1      VAL  47  -9.863  -4.617   0.643
  330   2HG1  VAL  47          2HG1      VAL  47  -9.407  -2.930   0.402
  331   3HG1  VAL  47          1HG1      VAL  47 -11.024  -3.335   0.950
  332   1HG2  VAL  47          1HG2      VAL  47 -10.702  -2.162  -2.566
  333   2HG2  VAL  47          3HG2      VAL  47 -11.733  -1.855  -1.163
  334   3HG2  VAL  47          2HG2      VAL  47  -9.956  -1.671  -1.007
  335    H    GLY  48             H      GLY  48  -9.724  -6.936  -1.702
  336   1HA   GLY  48           2HA      GLY  48  -7.814  -7.351   0.350
  337   2HA   GLY  48           1HA      GLY  48  -8.301  -8.565  -0.826
  338    H    VAL  49             H      VAL  49  -7.425  -6.884  -3.076
  339    HA   VAL  49            HA      VAL  49  -4.530  -7.500  -2.968
  340    HB   VAL  49            HB      VAL  49  -5.809  -8.477  -4.857
  341   1HG1  VAL  49          3HG1      VAL  49  -6.214  -5.562  -5.586
  342   2HG1  VAL  49          2HG1      VAL  49  -6.546  -6.912  -6.666
  343   3HG1  VAL  49          1HG1      VAL  49  -7.466  -6.732  -5.177
  344   1HG2  VAL  49          2HG2      VAL  49  -3.635  -6.442  -5.429
  345   2HG2  VAL  49          1HG2      VAL  49  -3.484  -8.195  -5.297
  346   3HG2  VAL  49          3HG2      VAL  49  -4.289  -7.479  -6.695
  347    H    LEU  50             H      LEU  50  -6.696  -4.854  -3.502
  348    HA   LEU  50            HA      LEU  50  -4.794  -2.873  -4.271
  349   1HB   LEU  50           2HB      LEU  50  -7.549  -2.993  -3.369
  350   2HB   LEU  50           1HB      LEU  50  -6.782  -1.487  -3.143
  351    HG   LEU  50            HG      LEU  50  -6.652  -2.785  -5.815
  352   1HD1  LEU  50          1HD1      LEU  50  -9.060  -1.333  -4.614
  353   2HD1  LEU  50          3HD1      LEU  50  -8.847  -1.629  -6.348
  354   3HD1  LEU  50          2HD1      LEU  50  -9.027  -2.984  -5.246
  355   1HD2  LEU  50          1HD2      LEU  50  -5.503  -0.599  -5.176
  356   2HD2  LEU  50          3HD2      LEU  50  -6.605  -0.477  -6.549
  357   3HD2  LEU  50          2HD2      LEU  50  -7.114   0.092  -4.953
  358    H    VAL  51             H      VAL  51  -5.479  -4.380  -1.300
  359    HA   VAL  51            HA      VAL  51  -3.812  -2.418   0.197
  360    HB   VAL  51            HB      VAL  51  -5.567  -2.029   1.818
  361   1HG1  VAL  51          1HG1      VAL  51  -5.950  -0.857  -0.290
  362   2HG1  VAL  51          3HG1      VAL  51  -6.940  -2.207  -0.835
  363   3HG1  VAL  51          2HG1      VAL  51  -7.460  -1.235   0.529
  364   1HG2  VAL  51          3HG2      VAL  51  -6.478  -4.678   1.012
  365   2HG2  VAL  51          2HG2      VAL  51  -6.837  -3.787   2.491
  366   3HG2  VAL  51          1HG2      VAL  51  -7.803  -3.529   1.054
  367    H    GLY  52             H      GLY  52  -4.754  -5.701  -0.277
  368   1HA   GLY  52           2HA      GLY  52  -4.390  -7.026   2.088
  369   2HA   GLY  52           1HA      GLY  52  -3.844  -7.677   0.550
  370    H    LYS  53             H      LYS  53  -2.744  -7.483   3.380
  371    HA   LYS  53            HA      LYS  53  -0.442  -5.959   3.578
  372   1HB   LYS  53           2HB      LYS  53   0.438  -7.626   5.144
  373   2HB   LYS  53           1HB      LYS  53  -1.277  -7.350   5.439
  374   1HG   LYS  53           2HG      LYS  53  -1.387  -9.634   5.366
  375   2HG   LYS  53           1HG      LYS  53  -1.418  -9.372   3.620
  376   1HD   LYS  53           2HD      LYS  53   0.292 -11.047   4.181
  377   2HD   LYS  53           1HD      LYS  53   1.068  -9.589   3.561
  378   1HE   LYS  53           2HE      LYS  53   0.721  -9.388   6.438
  379   2HE   LYS  53           1HE      LYS  53   1.583 -10.870   6.028
  380   1HZ   LYS  53           2HZ      LYS  53   2.884  -9.284   4.450
  381   2HZ   LYS  53           1HZ      LYS  53   2.341  -8.079   5.519
  382   3HZ   LYS  53           3HZ      LYS  53   3.284  -9.362   6.099
  383    H    ASP  54             H      ASP  54  -1.002  -8.727   1.633
  384    HA   ASP  54            HA      ASP  54   1.549  -9.551   0.941
  385   1HB   ASP  54           2HB      ASP  54  -0.722 -10.594   0.330
  386   2HB   ASP  54           1HB      ASP  54  -0.717  -9.465  -1.022
  387    NH1  ARG  55           NH2      ARG  55   7.435  -6.737   3.573
  388    NH2  ARG  55           NH1      ARG  55   6.805  -4.591   3.891
  389    H    ARG  55             H      ARG  55   3.040  -8.470  -0.171
  390    HA   ARG  55            HA      ARG  55   2.315  -6.317  -1.959
  391   1HB   ARG  55           2HB      ARG  55   4.225  -4.956  -1.037
  392   2HB   ARG  55           1HB      ARG  55   2.884  -5.187   0.084
  393   1HG   ARG  55           2HG      ARG  55   4.125  -7.181   1.019
  394   2HG   ARG  55           1HG      ARG  55   5.507  -6.692   0.037
  395   1HD   ARG  55           2HD      ARG  55   5.865  -4.749   1.264
  396   2HD   ARG  55           1HD      ARG  55   4.192  -4.672   1.818
  397    HE   ARG  55            HE      ARG  55   4.796  -6.709   3.252
  398   1HH1  ARG  55          1HH2      ARG  55   7.241  -7.654   3.226
  399   2HH1  ARG  55          2HH2      ARG  55   8.309  -6.546   4.020
  400   1HH2  ARG  55          2HH1      ARG  55   6.128  -3.863   3.786
  401   2HH2  ARG  55          1HH1      ARG  55   7.677  -4.402   4.343
  402    H    SER  56             H      SER  56   2.922  -8.688  -2.989
  403    HA   SER  56            HA      SER  56   5.391  -8.113  -4.458
  404   1HB   SER  56           2HB      SER  56   6.339  -9.291  -2.627
  405   2HB   SER  56           1HB      SER  56   5.148 -10.576  -2.749
  406    HG   SER  56            HG      SER  56   7.496 -10.343  -3.991
  407    H    SER  57             H      SER  57   2.327  -9.580  -4.408
  408    HA   SER  57            HA      SER  57   2.807 -11.196  -6.784
  409   1HB   SER  57           2HB      SER  57   0.310 -11.705  -6.452
  410   2HB   SER  57           1HB      SER  57   1.465 -12.403  -5.333
  411    HG   SER  57            HG      SER  57   0.549 -11.290  -3.808
  412    H    PHE  58             H      PHE  58  -0.135  -9.417  -6.257
  413    HA   PHE  58            HA      PHE  58  -0.797  -8.708  -8.777
  414   1HB   PHE  58           2HB      PHE  58  -1.912  -6.656  -7.902
  415   2HB   PHE  58           1HB      PHE  58  -2.305  -8.155  -7.090
  416    HD1  PHE  58           HD1      PHE  58  -1.376  -8.661  -4.847
  417    HD2  PHE  58           HD2      PHE  58  -0.710  -4.902  -6.809
  418    HE1  PHE  58           HE1      PHE  58  -0.715  -7.646  -2.685
  419    HE2  PHE  58           HE2      PHE  58  -0.078  -3.893  -4.641
  420    HZ   PHE  58            HZ      PHE  58  -0.064  -5.250  -2.589
  421    OH   TYR  59            OH      TYR  59   2.499  -3.160  -2.815
  422    H    TYR  59             H      TYR  59   1.989  -7.207  -7.230
  423    HA   TYR  59            HA      TYR  59   2.062  -4.866  -8.760
  424   1HB   TYR  59           2HB      TYR  59   4.390  -6.407  -7.669
  425   2HB   TYR  59           1HB      TYR  59   4.470  -4.775  -8.315
  426    HD1  TYR  59           HD1      TYR  59   2.073  -3.553  -7.315
  427    HD2  TYR  59           HD2      TYR  59   4.803  -6.179  -5.331
  428    HE1  TYR  59           HE1      TYR  59   1.482  -2.509  -5.154
  429    HE2  TYR  59           HE2      TYR  59   4.221  -5.098  -3.181
  430    HH   TYR  59            HH      TYR  59   1.544  -3.174  -2.722
  431    H    VAL  60             H      VAL  60   2.164  -7.847 -10.070
  432    HA   VAL  60            HA      VAL  60   3.639  -6.882 -12.420
  433    HB   VAL  60            HB      VAL  60   3.813  -9.516 -12.747
  434   1HG1  VAL  60          1HG1      VAL  60   5.608  -7.722 -12.513
  435   2HG1  VAL  60          3HG1      VAL  60   5.612  -8.104 -10.792
  436   3HG1  VAL  60          2HG1      VAL  60   6.062  -9.338 -11.971
  437   1HG2  VAL  60          1HG2      VAL  60   2.578 -10.052 -10.652
  438   2HG2  VAL  60          3HG2      VAL  60   4.235 -10.663 -10.610
  439   3HG2  VAL  60          2HG2      VAL  60   3.814  -9.184  -9.739
  440    H    ASN  61             H      ASN  61   0.735  -8.599 -11.265
  441    HA   ASN  61            HA      ASN  61  -0.148  -8.937 -14.007
  442   1HB   ASN  61           2HB      ASN  61  -1.778 -10.405 -13.175
  443   2HB   ASN  61           1HB      ASN  61  -0.337 -10.778 -12.296
  444   1HD2  ASN  61          2HD2      ASN  61  -1.925 -10.293  -9.223
  445   2HD2  ASN  61          1HD2      ASN  61  -0.684 -11.030 -10.113
  446    H    GLY  62             H      GLY  62  -1.285  -7.232 -11.050
  447   1HA   GLY  62           2HA      GLY  62  -2.047  -4.871 -11.636
  448   2HA   GLY  62           1HA      GLY  62  -3.139  -5.687 -12.755
  449    H    LEU  63             H      LEU  63  -3.835  -3.991 -10.432
  450    HA   LEU  63            HA      LEU  63  -4.866  -5.768  -8.332
  451   1HB   LEU  63           2HB      LEU  63  -5.838  -2.924  -8.700
  452   2HB   LEU  63           1HB      LEU  63  -5.721  -3.840  -7.200
  453    HG   LEU  63            HG      LEU  63  -3.395  -2.729  -8.834
  454   1HD1  LEU  63          3HD1      LEU  63  -4.896  -1.198  -7.440
  455   2HD1  LEU  63          2HD1      LEU  63  -4.336  -2.090  -6.027
  456   3HD1  LEU  63          1HD1      LEU  63  -3.185  -1.188  -7.019
  457   1HD2  LEU  63          2HD2      LEU  63  -3.522  -4.334  -6.260
  458   2HD2  LEU  63          1HD2      LEU  63  -2.799  -4.853  -7.787
  459   3HD2  LEU  63          3HD2      LEU  63  -2.082  -3.526  -6.876
  460    H    THR  64             H      THR  64  -7.459  -4.548  -7.981
  461    HA   THR  64            HA      THR  64  -8.998  -4.953 -10.390
  462    HB   THR  64            HB      THR  64 -10.360  -6.790  -9.318
  463    HG1  THR  64           HG1      THR  64  -9.530  -7.821  -7.592
  464   1HG2  THR  64          1HG2      THR  64  -8.600  -7.091 -11.096
  465   2HG2  THR  64          3HG2      THR  64  -7.489  -7.563  -9.808
  466   3HG2  THR  64          2HG2      THR  64  -8.945  -8.522 -10.123
  467    H    LEU  65             H      LEU  65 -10.661  -3.676 -10.167
  468    HA   LEU  65            HA      LEU  65 -11.661  -3.033  -7.465
  469   1HB   LEU  65           2HB      LEU  65 -12.060  -0.659  -8.528
  470   2HB   LEU  65           1HB      LEU  65 -10.585  -1.064  -7.704
  471    HG   LEU  65            HG      LEU  65  -9.604  -1.688  -9.956
  472   1HD1  LEU  65          1HD1      LEU  65 -12.283  -0.754 -10.744
  473   2HD1  LEU  65          3HD1      LEU  65 -10.956  -0.241 -11.761
  474   3HD1  LEU  65          2HD1      LEU  65 -11.257  -1.944 -11.487
  475   1HD2  LEU  65          1HD2      LEU  65 -10.309   1.016  -8.953
  476   2HD2  LEU  65          3HD2      LEU  65  -8.728   0.338  -9.359
  477   3HD2  LEU  65          2HD2      LEU  65  -9.775   0.952 -10.639
  478    H    GLY  66             H      GLY  66 -13.546  -4.021  -7.495
  479   1HA   GLY  66           2HA      GLY  66 -15.821  -4.343  -7.939
  480   2HA   GLY  66           1HA      GLY  66 -15.710  -3.039  -9.120
  481    H    GLY  67             H      GLY  67 -13.521  -5.769  -9.187
  482   1HA   GLY  67           2HA      GLY  67 -13.446  -7.665 -10.588
  483   2HA   GLY  67           1HA      GLY  67 -15.012  -7.204 -11.260
  484    H    GLN  68             H      GLN  68 -12.723  -4.573 -11.146
  485    HA   GLN  68            HA      GLN  68 -12.190  -5.012 -14.073
  486   1HB   GLN  68           2HB      GLN  68 -13.522  -3.106 -13.963
  487   2HB   GLN  68           1HB      GLN  68 -12.676  -2.556 -12.576
  488   1HG   GLN  68           2HG      GLN  68 -12.153  -1.298 -14.756
  489   2HG   GLN  68           1HG      GLN  68 -10.762  -1.837 -13.824
  490   1HE2  GLN  68          2HE2      GLN  68  -9.527  -3.543 -16.667
  491   2HE2  GLN  68          1HE2      GLN  68  -9.202  -2.531 -15.341
  492    H    LYS  69             H      LYS  69 -10.276  -5.999 -14.044
  493    HA   LYS  69            HA      LYS  69  -8.122  -5.616 -12.325
  494   1HB   LYS  69           2HB      LYS  69  -8.671  -7.476 -14.058
  495   2HB   LYS  69           1HB      LYS  69  -7.801  -6.437 -15.187
  496   1HG   LYS  69           2HG      LYS  69  -5.920  -7.365 -14.423
  497   2HG   LYS  69           1HG      LYS  69  -6.186  -6.473 -12.937
  498   1HD   LYS  69           2HD      LYS  69  -6.886  -8.312 -11.792
  499   2HD   LYS  69           1HD      LYS  69  -7.720  -8.988 -13.192
  500   1HE   LYS  69           2HE      LYS  69  -4.750  -8.872 -13.351
  501   2HE   LYS  69           1HE      LYS  69  -5.423 -10.032 -12.206
  502   1HZ   LYS  69           1HZ      LYS  69  -6.823 -10.892 -14.011
  503   2HZ   LYS  69           3HZ      LYS  69  -6.072  -9.830 -15.097
  504   3HZ   LYS  69           2HZ      LYS  69  -5.166 -11.060 -14.350
  505    H    CYS  70             H      CYS  70  -6.929  -3.787 -12.075
  506    HA   CYS  70            HA      CYS  70  -6.247  -2.185 -14.520
  507   1HB   CYS  70           2HB      CYS  70  -5.651  -0.409 -12.822
  508   2HB   CYS  70           1HB      CYS  70  -7.359  -0.770 -12.918
  509    HG   CYS  70            HG      CYS  70  -5.812  -2.250 -10.695
  510    H    SER  71             H      SER  71  -3.899  -1.281 -14.074
  511    HA   SER  71            HA      SER  71  -2.260  -3.510 -12.969
  512   1HB   SER  71           2HB      SER  71  -0.801  -3.373 -14.865
  513   2HB   SER  71           1HB      SER  71  -2.463  -3.636 -15.382
  514    HG   SER  71            HG      SER  71  -0.826  -1.425 -15.659
  515    H    VAL  72             H      VAL  72  -1.227  -2.707 -11.324
  516    HA   VAL  72            HA      VAL  72  -0.427  -0.128 -10.668
  517    HB   VAL  72            HB      VAL  72   1.246  -2.556 -10.192
  518   1HG1  VAL  72          3HG1      VAL  72   1.952  -0.113  -9.579
  519   2HG1  VAL  72          2HG1      VAL  72   0.821  -0.357  -8.257
  520   3HG1  VAL  72          1HG1      VAL  72   2.210  -1.421  -8.428
  521   1HG2  VAL  72          2HG2      VAL  72  -1.244  -1.628  -8.866
  522   2HG2  VAL  72          1HG2      VAL  72  -0.866  -3.234  -9.477
  523   3HG2  VAL  72          3HG2      VAL  72  -0.072  -2.637  -8.030
  524    H    ILE  73             H      ILE  73   0.722   1.233 -11.604
  525    HA   ILE  73            HA      ILE  73   3.122   0.449 -13.012
  526    HB   ILE  73            HB      ILE  73   1.097   2.395 -13.980
  527   1HG1  ILE  73          2HG1      ILE  73   2.172   0.179 -15.670
  528   2HG1  ILE  73          1HG1      ILE  73   1.085  -0.288 -14.374
  529   1HG2  ILE  73          1HG2      ILE  73   3.553   3.070 -14.242
  530   2HG2  ILE  73          3HG2      ILE  73   3.634   1.740 -15.398
  531   3HG2  ILE  73          2HG2      ILE  73   2.544   3.098 -15.688
  532   1HD1  ILE  73          3HD1      ILE  73   0.361   1.788 -16.494
  533   2HD1  ILE  73          2HD1      ILE  73  -0.071   0.065 -16.653
  534   3HD1  ILE  73          1HD1      ILE  73  -0.730   1.049 -15.320
  535    NH1  ARG  74           NH1      ARG  74   6.585   5.635 -14.470
  536    NH2  ARG  74           NH2      ARG  74   6.117   7.663 -13.589
  537    H    ARG  74             H      ARG  74   3.689   0.936 -10.813
  538    HA   ARG  74            HA      ARG  74   5.374   2.271  -9.676
  539   1HB   ARG  74           2HB      ARG  74   3.487   4.499 -10.426
  540   2HB   ARG  74           1HB      ARG  74   4.766   4.675  -9.249
  541   1HG   ARG  74           2HG      ARG  74   6.284   3.687 -11.124
  542   2HG   ARG  74           1HG      ARG  74   4.987   4.213 -12.200
  543   1HD   ARG  74           2HD      ARG  74   5.153   6.502 -11.284
  544   2HD   ARG  74           1HD      ARG  74   6.461   5.977 -10.221
  545    HE   ARG  74            HE      ARG  74   7.914   5.872 -12.116
  546   1HH1  ARG  74          2HH1      ARG  74   6.921   4.699 -14.359
  547   2HH1  ARG  74          1HH1      ARG  74   6.272   5.951 -15.367
  548   1HH2  ARG  74          1HH2      ARG  74   6.092   8.282 -12.806
  549   2HH2  ARG  74          2HH2      ARG  74   5.807   7.978 -14.486
  550    H    ASP  75             H      ASP  75   4.943   1.190  -7.834
  551    HA   ASP  75            HA      ASP  75   2.380   1.677  -6.507
  552   1HB   ASP  75           2HB      ASP  75   2.386  -0.595  -6.574
  553   2HB   ASP  75           1HB      ASP  75   4.110  -0.677  -6.610
  554    H    SER  76             H      SER  76   2.247   3.190  -5.095
  555    HA   SER  76            HA      SER  76   4.398   3.317  -2.996
  556   1HB   SER  76           2HB      SER  76   4.285   5.303  -4.849
  557   2HB   SER  76           1HB      SER  76   3.085   5.892  -3.711
  558    HG   SER  76            HG      SER  76   5.670   4.993  -2.959
  559    H    LEU  77             H      LEU  77   1.340   2.481  -3.536
  560    HA   LEU  77            HA      LEU  77  -0.626   3.749  -2.138
  561   1HB   LEU  77           2HB      LEU  77  -0.342   1.315  -3.131
  562   2HB   LEU  77           1HB      LEU  77  -0.177   0.883  -1.448
  563    HG   LEU  77            HG      LEU  77  -2.379   2.624  -1.536
  564   1HD1  LEU  77          3HD1      LEU  77  -2.434   0.621  -3.835
  565   2HD1  LEU  77          2HD1      LEU  77  -3.827   1.546  -3.266
  566   3HD1  LEU  77          1HD1      LEU  77  -2.454   2.381  -3.992
  567   1HD2  LEU  77          3HD2      LEU  77  -2.032  -0.373  -1.335
  568   2HD2  LEU  77          2HD2      LEU  77  -2.422   0.773  -0.050
  569   3HD2  LEU  77          1HD2      LEU  77  -3.633   0.357  -1.263
  570    H    LEU  78             H      LEU  78   2.159   2.213  -0.618
  571    HA   LEU  78            HA      LEU  78   0.989   2.902   1.954
  572   1HB   LEU  78           2HB      LEU  78   3.220   1.181   1.293
  573   2HB   LEU  78           1HB      LEU  78   2.723   1.484   2.925
  574    HG   LEU  78            HG      LEU  78   0.584   0.699   0.987
  575   1HD1  LEU  78          1HD1      LEU  78   2.524  -0.864   0.509
  576   2HD1  LEU  78          3HD1      LEU  78   2.333  -1.454   2.162
  577   3HD1  LEU  78          2HD1      LEU  78   0.999  -1.627   1.004
  578   1HD2  LEU  78          2HD2      LEU  78   0.381   1.186   3.512
  579   2HD2  LEU  78          1HD2      LEU  78  -0.433  -0.253   2.881
  580   3HD2  LEU  78          3HD2      LEU  78   1.104  -0.407   3.739
  581    H    GLN  79             H      GLN  79   1.546   4.644   2.914
  582    HA   GLN  79            HA      GLN  79   2.755   6.768   2.037
  583   1HB   GLN  79           2HB      GLN  79   2.559   7.722   4.268
  584   2HB   GLN  79           1HB      GLN  79   1.135   6.755   3.901
  585   1HG   GLN  79           2HG      GLN  79   2.572   4.834   5.055
  586   2HG   GLN  79           1HG      GLN  79   3.365   6.207   5.821
  587   1HE2  GLN  79          2HE2      GLN  79  -0.621   5.586   6.631
  588   2HE2  GLN  79          1HE2      GLN  79   0.011   5.055   5.149
  589    H    ASP  80             H      ASP  80   4.581   6.026   1.192
  590    HA   ASP  80            HA      ASP  80   6.956   6.083   3.005
  591   1HB   ASP  80           2HB      ASP  80   6.969   4.234   1.315
  592   2HB   ASP  80           1HB      ASP  80   6.757   5.425   0.030
  593    H    GLY  81             H      GLY  81   5.007   8.278   2.422
  594   1HA   GLY  81           2HA      GLY  81   5.282  10.619   2.180
  595   2HA   GLY  81           1HA      GLY  81   6.789  10.320   1.297
  596    H    GLU  82             H      GLU  82   3.837   8.444   0.591
  597    HA   GLU  82            HA      GLU  82   3.266   9.992  -1.812
  598   1HB   GLU  82           2HB      GLU  82   4.655   7.428  -1.659
  599   2HB   GLU  82           1HB      GLU  82   3.498   7.646  -2.922
  600   1HG   GLU  82           2HG      GLU  82   5.262   8.475  -4.061
  601   2HG   GLU  82           1HG      GLU  82   4.828   9.960  -3.187
  602    H    PHE  83             H      PHE  83   2.587   6.675  -0.685
  603    HA   PHE  83            HA      PHE  83   0.644   5.377  -0.710
  604   1HB   PHE  83           2HB      PHE  83  -1.568   6.981  -0.687
  605   2HB   PHE  83           1HB      PHE  83  -0.859   6.164   0.649
  606    HD1  PHE  83           HD1      PHE  83   1.007   7.423   1.951
  607    HD2  PHE  83           HD2      PHE  83  -1.725   9.329  -0.730
  608    HE1  PHE  83           HE1      PHE  83   1.505   9.600   3.020
  609    HE2  PHE  83           HE2      PHE  83  -1.245  11.513   0.336
  610    HZ   PHE  83            HZ      PHE  83   0.370  11.650   2.213
  611    H    SER  84             H      SER  84   1.358   7.390  -3.301
  612    HA   SER  84            HA      SER  84  -1.084   6.953  -4.795
  613   1HB   SER  84           2HB      SER  84   0.223   8.197  -6.590
  614   2HB   SER  84           1HB      SER  84  -0.160   9.094  -5.119
  615    HG   SER  84            HG      SER  84   2.137   9.022  -6.035
  616    H    MET  85             H      MET  85  -1.317   5.677  -6.533
  617    HA   MET  85            HA      MET  85   0.963   3.933  -7.403
  618   1HB   MET  85           2HB      MET  85  -0.636   3.006  -5.564
  619   2HB   MET  85           1HB      MET  85  -1.734   2.848  -6.885
  620   1HG   MET  85           2HG      MET  85  -0.707   1.032  -7.697
  621   2HG   MET  85           1HG      MET  85   0.861   1.774  -7.530
  622   1HE   MET  85           3HE      MET  85  -1.076  -0.835  -6.982
  623   2HE   MET  85           2HE      MET  85   0.492  -1.554  -6.546
  624   3HE   MET  85           1HE      MET  85  -0.825  -1.537  -5.362
  625    H    ASP  86             H      ASP  86   1.016   3.857  -9.748
  626    HA   ASP  86            HA      ASP  86  -1.379   4.980 -11.124
  627   1HB   ASP  86           2HB      ASP  86   1.417   4.446 -11.759
  628   2HB   ASP  86           1HB      ASP  86   0.286   4.415 -13.081
  629    H    LEU  87             H      LEU  87  -2.748   2.991 -10.600
  630    HA   LEU  87            HA      LEU  87  -1.958   0.713 -12.294
  631   1HB   LEU  87           2HB      LEU  87  -4.063  -0.417 -11.167
  632   2HB   LEU  87           1HB      LEU  87  -2.494  -0.428 -10.436
  633    HG   LEU  87            HG      LEU  87  -4.238   0.038  -8.793
  634   1HD1  LEU  87          2HD1      LEU  87  -1.905   1.548  -9.175
  635   2HD1  LEU  87          1HD1      LEU  87  -3.149   2.671  -8.618
  636   3HD1  LEU  87          3HD1      LEU  87  -2.766   1.231  -7.672
  637   1HD2  LEU  87          1HD2      LEU  87  -5.496   1.416 -10.729
  638   2HD2  LEU  87          3HD2      LEU  87  -5.852   1.600  -9.016
  639   3HD2  LEU  87          2HD2      LEU  87  -4.779   2.744  -9.817
  640    NH1  ARG  88           NH2      ARG  88   0.551   3.330 -19.183
  641    NH2  ARG  88           NH1      ARG  88   0.034   1.875 -20.830
  642    H    ARG  88             H      ARG  88  -2.608   0.593 -14.237
  643    HA   ARG  88            HA      ARG  88  -5.169   2.059 -14.917
  644   1HB   ARG  88           2HB      ARG  88  -4.265   2.855 -16.904
  645   2HB   ARG  88           1HB      ARG  88  -2.817   2.764 -15.935
  646   1HG   ARG  88           2HG      ARG  88  -2.241   0.591 -17.040
  647   2HG   ARG  88           1HG      ARG  88  -3.741   0.683 -18.010
  648   1HD   ARG  88           2HD      ARG  88  -2.837   2.164 -19.432
  649   2HD   ARG  88           1HD      ARG  88  -2.198   3.195 -18.115
  650    HE   ARG  88            HE      ARG  88  -0.594   0.819 -18.368
  651   1HH1  ARG  88          1HH2      ARG  88   0.445   3.641 -18.238
  652   2HH1  ARG  88          2HH2      ARG  88   1.160   3.819 -19.805
  653   1HH2  ARG  88          2HH1      ARG  88  -0.465   1.069 -21.148
  654   2HH2  ARG  88          1HH1      ARG  88   0.638   2.369 -21.456
  655    H    THR  89             H      THR  89  -6.766   1.140 -15.930
  656    HA   THR  89            HA      THR  89  -7.154  -1.660 -16.218
  657    HB   THR  89            HB      THR  89  -9.310  -1.092 -17.034
  658    HG1  THR  89           HG1      THR  89  -9.083  -0.314 -18.976
  659   1HG2  THR  89          2HG2      THR  89  -8.775   0.431 -15.051
  660   2HG2  THR  89          1HG2      THR  89  -8.618   1.723 -16.266
  661   3HG2  THR  89          3HG2      THR  89 -10.160   0.876 -16.047
  662    H    LYS  90             H      LYS  90  -5.263  -2.447 -17.458
  663    HA   LYS  90            HA      LYS  90  -4.640  -1.225 -19.942
  664   1HB   LYS  90           2HB      LYS  90  -3.596  -3.968 -19.436
  665   2HB   LYS  90           1HB      LYS  90  -2.811  -2.512 -20.014
  666   1HG   LYS  90           2HG      LYS  90  -3.082  -1.642 -17.617
  667   2HG   LYS  90           1HG      LYS  90  -3.198  -3.353 -17.201
  668   1HD   LYS  90           2HD      LYS  90  -1.038  -2.743 -19.155
  669   2HD   LYS  90           1HD      LYS  90  -0.795  -1.977 -17.597
  670   1HE   LYS  90           2HE      LYS  90  -0.221  -3.938 -16.646
  671   2HE   LYS  90           1HE      LYS  90  -1.656  -4.737 -17.278
  672   1HZ   LYS  90           2HZ      LYS  90   0.682  -4.138 -18.992
  673   2HZ   LYS  90           1HZ      LYS  90   0.594  -5.567 -18.076
  674   3HZ   LYS  90           3HZ      LYS  90  -0.570  -5.253 -19.267
  675    H    SER  91             H      SER  91  -5.068  -2.147 -21.954
  676    HA   SER  91            HA      SER  91  -7.574  -3.699 -22.079
  677   1HB   SER  91           2HB      SER  91  -7.945  -1.840 -23.366
  678   2HB   SER  91           1HB      SER  91  -6.286  -1.654 -23.778
  679    HG   SER  91            HG      SER  91  -6.780  -2.538 -25.615
  680    H    THR  92             H      THR  92  -7.853  -5.038 -24.187
  681    HA   THR  92            HA      THR  92  -5.384  -6.566 -24.884
  682    HB   THR  92            HB      THR  92  -6.414  -8.739 -24.342
  683    HG1  THR  92           HG1      THR  92  -8.488  -8.723 -24.155
  684   1HG2  THR  92          3HG2      THR  92  -5.034  -7.638 -22.626
  685   2HG2  THR  92          2HG2      THR  92  -6.467  -6.817 -21.999
  686   3HG2  THR  92          1HG2      THR  92  -6.334  -8.576 -21.890
  687    H    GLY  93             H      GLY  93  -5.583  -5.981 -27.055
  688   1HA   GLY  93           2HA      GLY  93  -6.238  -6.409 -29.276
  689   2HA   GLY  93           1HA      GLY  93  -7.458  -7.513 -28.661
  690    H    GLY  94             H      GLY  94  -6.762  -4.108 -29.335
  691   1HA   GLY  94           2HA      GLY  94  -8.166  -2.381 -30.066
  692   2HA   GLY  94           1HA      GLY  94  -9.378  -3.608 -30.393
  693    H    ALA  95             H      ALA  95  -8.522  -3.803 -27.086
  694    HA   ALA  95            HA      ALA  95 -11.097  -2.574 -26.345
  695   1HB   ALA  95           3HB      ALA  95  -9.531  -4.541 -25.150
  696   2HB   ALA  95           2HB      ALA  95  -9.310  -3.142 -24.085
  697   3HB   ALA  95           1HB      ALA  95 -10.937  -3.749 -24.427
  698    HA   PRO  96            HA      PRO  96  -9.509   1.339 -25.181
  699   1HB   PRO  96           2HB      PRO  96 -11.511   2.142 -23.535
  700   2HB   PRO  96           1HB      PRO  96 -11.768   1.914 -25.276
  701   1HG   PRO  96           2HG      PRO  96 -12.689   0.194 -23.023
  702   2HG   PRO  96           1HG      PRO  96 -13.358   0.355 -24.642
  703   1HD   PRO  96           2HD      PRO  96 -11.642  -1.730 -23.698
  704   2HD   PRO  96           1HD      PRO  96 -12.241  -1.468 -25.346
  705    H    THR  97             H      THR  97  -8.027   2.006 -23.636
  706    HA   THR  97            HA      THR  97  -7.944   0.530 -21.046
  707    HB   THR  97            HB      THR  97  -5.758   1.927 -20.794
  708    HG1  THR  97           HG1      THR  97  -6.056   1.991 -23.632
  709   1HG2  THR  97          2HG2      THR  97  -6.290  -0.564 -21.690
  710   2HG2  THR  97          1HG2      THR  97  -5.433   0.096 -23.080
  711   3HG2  THR  97          3HG2      THR  97  -4.658   0.091 -21.491
  712    H    PHE  98             H      PHE  98  -7.476   1.830 -19.141
  713    HA   PHE  98            HA      PHE  98  -8.384   4.611 -19.069
  714   1HB   PHE  98           2HB      PHE  98  -9.881   2.316 -17.806
  715   2HB   PHE  98           1HB      PHE  98 -10.013   3.991 -17.225
  716    HD1  PHE  98           HD1      PHE  98 -10.258   5.789 -19.275
  717    HD2  PHE  98           HD2      PHE  98 -11.486   1.711 -19.487
  718    HE1  PHE  98           HE1      PHE  98 -11.793   6.515 -21.124
  719    HE2  PHE  98           HE2      PHE  98 -13.031   2.290 -21.350
  720    HZ   PHE  98            HZ      PHE  98 -13.193   4.621 -22.178
  721    H    ASN  99             H      ASN  99  -7.186   5.659 -17.334
  722    HA   ASN  99            HA      ASN  99  -5.355   3.860 -15.880
  723   1HB   ASN  99           2HB      ASN  99  -4.706   6.744 -16.496
  724   2HB   ASN  99           1HB      ASN  99  -3.621   5.501 -15.878
  725   1HD2  ASN  99          2HD2      ASN  99  -2.779   5.762 -19.421
  726   2HD2  ASN  99          1HD2      ASN  99  -2.624   6.718 -18.023
  727    H    VAL 100             H      VAL 100  -4.791   4.349 -13.860
  728    HA   VAL 100            HA      VAL 100  -6.672   6.075 -12.417
  729    HB   VAL 100            HB      VAL 100  -5.761   3.367 -11.400
  730   1HG1  VAL 100          2HG1      VAL 100  -6.694   5.189  -9.879
  731   2HG1  VAL 100          1HG1      VAL 100  -8.233   4.782 -10.591
  732   3HG1  VAL 100          3HG1      VAL 100  -7.320   3.564  -9.728
  733   1HG2  VAL 100          2HG2      VAL 100  -7.294   3.483 -13.591
  734   2HG2  VAL 100          1HG2      VAL 100  -7.522   2.263 -12.345
  735   3HG2  VAL 100          3HG2      VAL 100  -8.515   3.703 -12.358
  736    H    THR 101             H      THR 101  -5.828   6.835 -10.499
  737    HA   THR 101            HA      THR 101  -3.077   6.103  -9.740
  738    HB   THR 101            HB      THR 101  -4.347   8.894  -9.585
  739    HG1  THR 101           HG1      THR 101  -2.504   9.370 -10.962
  740   1HG2  THR 101          2HG2      THR 101  -2.147   7.622  -8.146
  741   2HG2  THR 101          1HG2      THR 101  -1.622   9.059  -9.022
  742   3HG2  THR 101          3HG2      THR 101  -2.935   9.175  -7.854
  743    H    VAL 102             H      VAL 102  -3.263   5.275  -7.744
  744    HA   VAL 102            HA      VAL 102  -5.736   5.704  -6.204
  745    HB   VAL 102            HB      VAL 102  -3.966   3.333  -6.756
  746   1HG1  VAL 102          1HG1      VAL 102  -4.121   3.426  -4.257
  747   2HG1  VAL 102          3HG1      VAL 102  -5.874   3.517  -4.376
  748   3HG1  VAL 102          2HG1      VAL 102  -5.031   2.065  -4.911
  749   1HG2  VAL 102          3HG2      VAL 102  -6.899   3.960  -6.792
  750   2HG2  VAL 102          2HG2      VAL 102  -5.858   3.528  -8.128
  751   3HG2  VAL 102          1HG2      VAL 102  -6.293   2.320  -6.934
  752    H    THR 103             H      THR 103  -5.535   6.717  -4.315
  753    HA   THR 103            HA      THR 103  -2.874   6.901  -2.995
  754    HB   THR 103            HB      THR 103  -3.795   8.993  -1.936
  755    HG1  THR 103           HG1      THR 103  -5.513   9.902  -3.236
  756   1HG2  THR 103          2HG2      THR 103  -2.960   8.567  -4.726
  757   2HG2  THR 103          1HG2      THR 103  -3.774  10.113  -4.441
  758   3HG2  THR 103          3HG2      THR 103  -2.325   9.683  -3.515
  759    H    LYS 104             H      LYS 104  -2.855   5.567  -1.213
  760    HA   LYS 104            HA      LYS 104  -5.387   5.031   0.249
  761   1HB   LYS 104           2HB      LYS 104  -4.030   3.075  -0.253
  762   2HB   LYS 104           1HB      LYS 104  -2.604   3.833   0.430
  763   1HG   LYS 104           2HG      LYS 104  -3.206   2.494   2.222
  764   2HG   LYS 104           1HG      LYS 104  -4.138   3.922   2.629
  765   1HD   LYS 104           2HD      LYS 104  -5.769   2.299   2.780
  766   2HD   LYS 104           1HD      LYS 104  -5.965   2.792   1.110
  767   1HE   LYS 104           2HE      LYS 104  -5.884   0.320   1.359
  768   2HE   LYS 104           1HE      LYS 104  -4.572   0.935   0.363
  769   1HZ   LYS 104           3HZ      LYS 104  -4.145   0.649   3.249
  770   2HZ   LYS 104           2HZ      LYS 104  -4.099  -0.745   2.276
  771   3HZ   LYS 104           1HZ      LYS 104  -3.025   0.538   1.980
  772    H    THR 105             H      THR 105  -5.907   6.476   1.826
  773    HA   THR 105            HA      THR 105  -3.921   8.183   3.141
  774    HB   THR 105            HB      THR 105  -5.808   8.943   4.549
  775    HG1  THR 105           HG1      THR 105  -7.157   7.433   4.980
  776   1HG2  THR 105          2HG2      THR 105  -5.805   9.028   1.676
  777   2HG2  THR 105          1HG2      THR 105  -7.480   8.942   2.243
  778   3HG2  THR 105          3HG2      THR 105  -6.415  10.237   2.813
  779    H    ASP 106             H      ASP 106  -5.259   7.659   5.917
  780    HA   ASP 106            HA      ASP 106  -3.478   5.422   6.664
  781   1HB   ASP 106           2HB      ASP 106  -3.557   7.626   7.920
  782   2HB   ASP 106           1HB      ASP 106  -5.127   7.118   8.521
  783    H    LYS 107             H      LYS 107  -6.925   6.208   6.490
  784    HA   LYS 107            HA      LYS 107  -7.549   3.357   7.163
  785   1HB   LYS 107           2HB      LYS 107  -9.377   5.579   8.097
  786   2HB   LYS 107           1HB      LYS 107  -9.288   3.915   8.664
  787   1HG   LYS 107           2HG      LYS 107  -6.929   4.485   9.506
  788   2HG   LYS 107           1HG      LYS 107  -7.362   6.172   9.231
  789   1HD   LYS 107           2HD      LYS 107  -9.480   5.649  10.635
  790   2HD   LYS 107           1HD      LYS 107  -8.600   4.214  11.161
  791   1HE   LYS 107           2HE      LYS 107  -7.270   6.907  11.276
  792   2HE   LYS 107           1HE      LYS 107  -8.383   6.426  12.555
  793   1HZ   LYS 107           3HZ      LYS 107  -6.405   4.429  11.804
  794   2HZ   LYS 107           2HZ      LYS 107  -5.779   5.829  12.540
  795   3HZ   LYS 107           1HZ      LYS 107  -6.951   4.896  13.342
  796    H    THR 108             H      THR 108  -7.597   5.377   4.671
  797    HA   THR 108            HA      THR 108 -10.204   4.392   3.643
  798    HB   THR 108            HB      THR 108 -10.841   6.466   2.762
  799    HG1  THR 108           HG1      THR 108  -8.960   7.043   1.721
  800   1HG2  THR 108          2HG2      THR 108 -10.686   6.363   5.345
  801   2HG2  THR 108          1HG2      THR 108  -9.310   7.462   5.161
  802   3HG2  THR 108          3HG2      THR 108 -10.905   7.950   4.594
  803    H    LEU 109             H      LEU 109 -10.156   4.068   1.367
  804    HA   LEU 109            HA      LEU 109  -7.461   3.724   0.162
  805   1HB   LEU 109           2HB      LEU 109  -9.181   1.769   0.828
  806   2HB   LEU 109           1HB      LEU 109  -9.827   2.109  -0.753
  807    HG   LEU 109            HG      LEU 109  -7.389   0.665   0.021
  808   1HD1  LEU 109          2HD1      LEU 109  -9.566   0.202  -1.525
  809   2HD1  LEU 109          1HD1      LEU 109  -8.389   0.644  -2.760
  810   3HD1  LEU 109          3HD1      LEU 109  -8.063  -0.691  -1.665
  811   1HD2  LEU 109          1HD2      LEU 109  -7.248   2.880  -1.947
  812   2HD2  LEU 109          3HD2      LEU 109  -6.061   2.351  -0.775
  813   3HD2  LEU 109          2HD2      LEU 109  -6.335   1.403  -2.225
  814    H    VAL 110             H      VAL 110  -7.676   5.962  -0.873
  815    HA   VAL 110            HA      VAL 110 -10.067   6.462  -2.457
  816    HB   VAL 110            HB      VAL 110  -7.543   8.013  -1.765
  817   1HG1  VAL 110          3HG1      VAL 110  -9.075   8.291  -4.311
  818   2HG1  VAL 110          2HG1      VAL 110  -8.748   9.780  -3.438
  819   3HG1  VAL 110          1HG1      VAL 110  -7.423   8.748  -3.947
  820   1HG2  VAL 110          2HG2      VAL 110 -10.232   7.971  -0.926
  821   2HG2  VAL 110          1HG2      VAL 110  -9.044   9.222  -0.556
  822   3HG2  VAL 110          3HG2      VAL 110 -10.134   9.423  -1.944
  823    H    LEU 111             H      LEU 111 -10.199   6.365  -4.615
  824    HA   LEU 111            HA      LEU 111  -7.884   5.409  -6.138
  825   1HB   LEU 111           2HB      LEU 111 -10.712   4.526  -6.780
  826   2HB   LEU 111           1HB      LEU 111  -9.206   3.852  -7.388
  827    HG   LEU 111            HG      LEU 111 -10.127   3.677  -4.531
  828   1HD1  LEU 111          2HD1      LEU 111 -11.049   2.212  -6.733
  829   2HD1  LEU 111          1HD1      LEU 111  -9.871   1.147  -5.954
  830   3HD1  LEU 111          3HD1      LEU 111 -11.246   1.776  -5.036
  831   1HD2  LEU 111          2HD2      LEU 111  -7.682   3.667  -5.004
  832   2HD2  LEU 111          1HD2      LEU 111  -8.298   2.291  -4.113
  833   3HD2  LEU 111          3HD2      LEU 111  -7.945   2.136  -5.829
  834    H    LEU 112             H      LEU 112  -7.790   6.309  -8.183
  835    HA   LEU 112            HA      LEU 112  -9.791   8.371  -8.838
  836   1HB   LEU 112           2HB      LEU 112  -7.367   8.948  -7.871
  837   2HB   LEU 112           1HB      LEU 112  -6.911   8.723  -9.524
  838    HG   LEU 112            HG      LEU 112  -7.287  11.035  -9.265
  839   1HD1  LEU 112          2HD1      LEU 112  -8.440   9.982 -11.248
  840   2HD1  LEU 112          1HD1      LEU 112  -9.937  10.004 -10.302
  841   3HD1  LEU 112          3HD1      LEU 112  -9.118  11.513 -10.710
  842   1HD2  LEU 112          1HD2      LEU 112  -8.481  10.636  -7.061
  843   2HD2  LEU 112          3HD2      LEU 112  -9.086  11.972  -8.041
  844   3HD2  LEU 112          2HD2      LEU 112  -9.958  10.436  -8.003
  845    H    MET 113             H      MET 113 -10.702   7.029 -10.440
  846    HA   MET 113            HA      MET 113  -8.746   5.648 -12.239
  847   1HB   MET 113           2HB      MET 113 -10.215   4.034 -11.434
  848   2HB   MET 113           1HB      MET 113 -11.547   5.157 -11.349
  849   1HG   MET 113           2HG      MET 113 -12.298   3.843 -13.130
  850   2HG   MET 113           1HG      MET 113 -11.404   4.999 -14.055
  851   1HE   MET 113           3HE      MET 113 -12.508   1.959 -13.563
  852   2HE   MET 113           2HE      MET 113 -11.877   1.437 -15.119
  853   3HE   MET 113           1HE      MET 113 -11.276   0.695 -13.642
  854    H    GLY 114             H      GLY 114  -9.051   5.542 -14.408
  855   1HA   GLY 114           2HA      GLY 114 -10.646   6.304 -16.181
  856   2HA   GLY 114           1HA      GLY 114 -10.450   7.831 -15.476
  857    H    LYS 115             H      LYS 115 -10.262   7.138 -18.116
  858    HA   LYS 115            HA      LYS 115  -7.994   8.562 -18.742
  859   1HB   LYS 115           2HB      LYS 115  -8.495   6.058 -20.242
  860   2HB   LYS 115           1HB      LYS 115  -7.534   7.313 -20.929
  861   1HG   LYS 115           2HG      LYS 115  -6.081   6.594 -18.673
  862   2HG   LYS 115           1HG      LYS 115  -6.745   5.160 -19.185
  863   1HD   LYS 115           2HD      LYS 115  -5.763   6.641 -21.429
  864   2HD   LYS 115           1HD      LYS 115  -4.521   6.179 -20.273
  865   1HE   LYS 115           2HE      LYS 115  -5.804   3.838 -20.302
  866   2HE   LYS 115           1HE      LYS 115  -6.320   4.432 -21.895
  867   1HZ   LYS 115           2HZ      LYS 115  -3.480   4.730 -21.303
  868   2HZ   LYS 115           1HZ      LYS 115  -4.035   3.137 -21.507
  869   3HZ   LYS 115           3HZ      LYS 115  -4.254   4.269 -22.745
  870    H    GLU 116             H      GLU 116  -8.795  10.122 -19.865
  871    HA   GLU 116            HA      GLU 116 -10.608   9.379 -22.060
  872   1HB   GLU 116           2HB      GLU 116 -11.209  10.998 -20.104
  873   2HB   GLU 116           1HB      GLU 116 -10.330  12.033 -21.070
  874   1HG   GLU 116           2HG      GLU 116 -11.948  12.306 -22.621
  875   2HG   GLU 116           1HG      GLU 116 -12.166  10.559 -22.706
  876    H    GLY 117             H      GLY 117  -8.497   8.900 -23.373
  877   1HA   GLY 117           2HA      GLY 117  -6.468   9.631 -24.472
  878   2HA   GLY 117           1HA      GLY 117  -7.154  11.256 -24.390
  879    H    VAL 118             H      VAL 118  -7.044  10.316 -21.118
  880    HA   VAL 118            HA      VAL 118  -5.549  12.090 -19.910
  881    HB   VAL 118            HB      VAL 118  -6.981  10.488 -18.713
  882   1HG1  VAL 118          1HG1      VAL 118  -6.330   8.658 -20.165
  883   2HG1  VAL 118          3HG1      VAL 118  -4.763   8.555 -19.375
  884   3HG1  VAL 118          2HG1      VAL 118  -6.242   8.259 -18.453
  885   1HG2  VAL 118          2HG2      VAL 118  -4.059  10.681 -17.817
  886   2HG2  VAL 118          1HG2      VAL 118  -5.507  11.065 -16.922
  887   3HG2  VAL 118          3HG2      VAL 118  -4.991   9.344 -17.044
  888    H    HIS 119             H      HIS 119  -3.646  12.544 -19.395
  889    HA   HIS 119            HA      HIS 119  -1.337  11.371 -20.756
  890   1HB   HIS 119           2HB      HIS 119  -1.540  13.826 -20.402
  891   2HB   HIS 119           1HB      HIS 119  -1.546  13.567 -18.660
  892    HD1  HIS 119           HD1      HIS 119   0.674  14.709 -18.149
  893    HD2  HIS 119           HD2      HIS 119   1.011  11.730 -21.039
  894    HE1  HIS 119           HE1      HIS 119   3.153  14.356 -18.523
  895    H    GLY 120             H      GLY 120  -2.473  11.816 -17.378
  896   1HA   GLY 120           2HA      GLY 120  -2.399   9.727 -15.940
  897   2HA   GLY 120           1HA      GLY 120  -0.745   9.519 -16.531
  898    H    GLY 121             H      GLY 121  -0.641  12.703 -16.240
  899   1HA   GLY 121           2HA      GLY 121   0.369  12.587 -13.435
  900   2HA   GLY 121           1HA      GLY 121   0.752  13.848 -14.610
  901    H    LEU 122             H      LEU 122  -2.327  13.902 -15.190
  902    HA   LEU 122            HA      LEU 122  -2.938  15.977 -13.211
  903   1HB   LEU 122           2HB      LEU 122  -4.989  15.041 -15.199
  904   2HB   LEU 122           1HB      LEU 122  -4.756  16.641 -14.540
  905    HG   LEU 122            HG      LEU 122  -3.983  16.952 -16.718
  906   1HD1  LEU 122          1HD1      LEU 122  -2.030  17.027 -14.806
  907   2HD1  LEU 122          3HD1      LEU 122  -1.306  15.930 -15.981
  908   3HD1  LEU 122          2HD1      LEU 122  -1.798  17.550 -16.474
  909   1HD2  LEU 122          3HD2      LEU 122  -3.949  14.161 -16.788
  910   2HD2  LEU 122          2HD2      LEU 122  -3.599  15.246 -18.136
  911   3HD2  LEU 122          1HD2      LEU 122  -2.283  14.622 -17.145
  912    H    ILE 123             H      ILE 123  -3.823  12.656 -13.960
  913    HA   ILE 123            HA      ILE 123  -6.049  12.513 -12.087
  914    HB   ILE 123            HB      ILE 123  -4.251  10.355 -13.189
  915   1HG1  ILE 123          2HG1      ILE 123  -6.996  11.354 -14.069
  916   2HG1  ILE 123          1HG1      ILE 123  -5.492  11.524 -14.975
  917   1HG2  ILE 123          2HG2      ILE 123  -6.420  10.302 -11.192
  918   2HG2  ILE 123          1HG2      ILE 123  -6.755   9.220 -12.536
  919   3HG2  ILE 123          3HG2      ILE 123  -5.273   9.033 -11.600
  920   1HD1  ILE 123          1HD1      ILE 123  -5.327   9.052 -15.121
  921   2HD1  ILE 123          3HD1      ILE 123  -6.877   8.918 -14.277
  922   3HD1  ILE 123          2HD1      ILE 123  -6.809   9.673 -15.870
  923    H    ASN 124             H      ASN 124  -2.560  11.911 -12.056
  924    HA   ASN 124            HA      ASN 124  -2.355  10.871  -9.400
  925   1HB   ASN 124           2HB      ASN 124  -0.484  10.826 -11.087
  926   2HB   ASN 124           1HB      ASN 124  -0.305  12.563 -10.859
  927   1HD2  ASN 124          2HD2      ASN 124   2.113  11.624  -8.397
  928   2HD2  ASN 124          1HD2      ASN 124   1.898  12.215  -9.975
  929    H    LYS 125             H      LYS 125  -2.670  14.087 -10.783
  930    HA   LYS 125            HA      LYS 125  -2.154  15.479  -8.124
  931   1HB   LYS 125           2HB      LYS 125  -2.864  16.334 -10.948
  932   2HB   LYS 125           1HB      LYS 125  -3.180  17.443  -9.613
  933   1HG   LYS 125           2HG      LYS 125  -0.533  16.266  -9.341
  934   2HG   LYS 125           1HG      LYS 125  -0.708  17.025 -10.924
  935   1HD   LYS 125           2HD      LYS 125  -1.158  19.142 -10.000
  936   2HD   LYS 125           1HD      LYS 125  -1.603  18.469  -8.431
  937   1HE   LYS 125           2HE      LYS 125   1.188  18.361  -9.605
  938   2HE   LYS 125           1HE      LYS 125   0.652  19.561  -8.428
  939   1HZ   LYS 125           2HZ      LYS 125  -0.075  17.483  -7.099
  940   2HZ   LYS 125           1HZ      LYS 125   1.041  16.667  -8.087
  941   3HZ   LYS 125           3HZ      LYS 125   1.560  17.943  -7.099
  942    H    LYS 126             H      LYS 126  -4.861  14.120  -9.929
  943    HA   LYS 126            HA      LYS 126  -6.894  15.554  -8.350
  944   1HB   LYS 126           2HB      LYS 126  -6.934  13.755 -10.724
  945   2HB   LYS 126           1HB      LYS 126  -8.368  13.779  -9.691
  946   1HG   LYS 126           2HG      LYS 126  -8.563  16.187  -9.918
  947   2HG   LYS 126           1HG      LYS 126  -7.036  16.268 -10.796
  948   1HD   LYS 126           2HD      LYS 126  -9.245  14.529 -11.827
  949   2HD   LYS 126           1HD      LYS 126  -9.286  16.266 -12.126
  950   1HE   LYS 126           2HE      LYS 126  -6.825  14.635 -12.698
  951   2HE   LYS 126           1HE      LYS 126  -8.110  14.799 -13.880
  952   1HZ   LYS 126           3HZ      LYS 126  -7.864  17.305 -13.356
  953   2HZ   LYS 126           2HZ      LYS 126  -6.325  16.865 -12.789
  954   3HZ   LYS 126           1HZ      LYS 126  -6.756  16.565 -14.404
  955    H    CYS 127             H      CYS 127  -5.024  12.721  -8.090
  956    HA   CYS 127            HA      CYS 127  -6.871  11.303  -6.291
  957   1HB   CYS 127           2HB      CYS 127  -5.185  10.178  -7.967
  958   2HB   CYS 127           1HB      CYS 127  -3.998  10.538  -6.732
  959    HG   CYS 127            HG      CYS 127  -6.557   8.929  -5.975
  960    OH   TYR 128            OH      TYR 128   1.820  15.932  -1.644
  961    H    TYR 128             H      TYR 128  -4.042  13.278  -6.449
  962    HA   TYR 128            HA      TYR 128  -3.227  13.149  -3.698
  963   1HB   TYR 128           2HB      TYR 128  -2.031  13.940  -5.924
  964   2HB   TYR 128           1HB      TYR 128  -2.803  15.477  -5.583
  965    HD1  TYR 128           HD1      TYR 128  -1.369  13.028  -3.115
  966    HD2  TYR 128           HD2      TYR 128  -1.037  16.811  -5.122
  967    HE1  TYR 128           HE1      TYR 128   0.498  13.635  -1.599
  968    HE2  TYR 128           HE2      TYR 128   0.829  17.447  -3.578
  969    HH   TYR 128            HH      TYR 128   2.422  15.186  -1.591
  970    H    GLU 129             H      GLU 129  -5.556  15.016  -5.624
  971    HA   GLU 129            HA      GLU 129  -6.173  16.964  -3.506
  972   1HB   GLU 129           2HB      GLU 129  -7.302  16.379  -6.243
  973   2HB   GLU 129           1HB      GLU 129  -8.115  17.495  -5.145
  974   1HG   GLU 129           2HG      GLU 129  -5.204  17.946  -5.401
  975   2HG   GLU 129           1HG      GLU 129  -6.116  18.222  -6.884
  976    H    MET 130             H      MET 130  -7.764  14.174  -5.009
  977    HA   MET 130            HA      MET 130 -10.223  14.097  -3.591
  978   1HB   MET 130           2HB      MET 130  -9.113  12.608  -5.570
  979   2HB   MET 130           1HB      MET 130  -8.771  11.534  -4.242
  980   1HG   MET 130           2HG      MET 130 -11.334  11.874  -3.710
  981   2HG   MET 130           1HG      MET 130 -11.425  12.347  -5.431
  982   1HE   MET 130           1HE      MET 130 -13.187  10.509  -4.857
  983   2HE   MET 130           3HE      MET 130 -12.770  10.303  -6.565
  984   3HE   MET 130           2HE      MET 130 -12.921   8.896  -5.516
  985    H    ALA 131             H      ALA 131  -7.082  12.633  -2.889
  986    HA   ALA 131            HA      ALA 131  -7.787  11.662  -0.233
  987   1HB   ALA 131           2HB      ALA 131  -5.168  11.806  -1.772
  988   2HB   ALA 131           1HB      ALA 131  -5.303  11.159  -0.127
  989   3HB   ALA 131           3HB      ALA 131  -6.162  10.377  -1.452
  990    H    SER 132             H      SER 132  -6.479  14.625  -1.603
  991    HA   SER 132            HA      SER 132  -5.075  15.622   0.688
  992   1HB   SER 132           2HB      SER 132  -6.472  16.918  -1.607
  993   2HB   SER 132           1HB      SER 132  -6.076  17.915  -0.223
  994    HG   SER 132            HG      SER 132  -3.911  17.207  -0.446
  995    H    HIS 133             H      HIS 133  -8.515  15.401  -0.116
  996    HA   HIS 133            HA      HIS 133  -9.300  16.919   2.254
  997   1HB   HIS 133           2HB      HIS 133 -10.702  16.717   0.120
  998   2HB   HIS 133           1HB      HIS 133 -11.173  15.115   0.728
  999    HD1  HIS 133           HD1      HIS 133 -13.011  15.102   2.422
 1000    HD2  HIS 133           HD2      HIS 133 -11.205  18.842   2.167
 1001    HE1  HIS 133           HE1      HIS 133 -14.337  16.637   3.938
 1002    H    LEU 134             H      LEU 134  -9.043  13.477   1.244
 1003    HA   LEU 134            HA      LEU 134 -10.131  12.447   3.732
 1004   1HB   LEU 134           2HB      LEU 134  -8.412  11.265   1.590
 1005   2HB   LEU 134           1HB      LEU 134  -8.801  10.362   3.054
 1006    HG   LEU 134            HG      LEU 134 -11.238  11.361   2.348
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.604  11.114  -0.088
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.243  10.490  -0.160
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.958  12.176   0.252
 1010   1HD2  LEU 134          1HD2      LEU 134 -10.505   9.011   2.988
 1011   2HD2  LEU 134          3HD2      LEU 134 -11.817   9.107   1.819
 1012   3HD2  LEU 134          2HD2      LEU 134 -10.175   8.756   1.284
 1013    NH1  ARG 135           NH2      ARG 135  -1.893  10.816   5.986
 1014    NH2  ARG 135           NH1      ARG 135  -1.654  12.940   6.726
 1015    H    ARG 135             H      ARG 135  -7.215  13.957   3.092
 1016    HA   ARG 135            HA      ARG 135  -5.802  12.781   5.405
 1017   1HB   ARG 135           2HB      ARG 135  -5.001  14.974   3.455
 1018   2HB   ARG 135           1HB      ARG 135  -3.973  14.348   4.744
 1019   1HG   ARG 135           2HG      ARG 135  -5.183  12.499   2.699
 1020   2HG   ARG 135           1HG      ARG 135  -3.672  13.339   2.371
 1021   1HD   ARG 135           2HD      ARG 135  -4.228  11.499   4.711
 1022   2HD   ARG 135           1HD      ARG 135  -3.216  11.129   3.314
 1023    HE   ARG 135            HE      ARG 135  -1.961  13.322   4.219
 1024   1HH1  ARG 135          1HH2      ARG 135  -2.150  10.177   5.260
 1025   2HH1  ARG 135          2HH2      ARG 135  -1.566  10.469   6.865
 1026   1HH2  ARG 135          2HH1      ARG 135  -1.724  13.924   6.567
 1027   2HH2  ARG 135          1HH1      ARG 135  -1.334  12.598   7.609
 1028    NH1  ARG 136           NH1      ARG 136  -7.664  22.855   6.811
 1029    NH2  ARG 136           NH2      ARG 136  -9.752  22.000   6.698
 1030    H    ARG 136             H      ARG 136  -7.406  15.694   4.241
 1031    HA   ARG 136            HA      ARG 136  -7.126  17.103   6.788
 1032   1HB   ARG 136           2HB      ARG 136  -8.437  17.640   4.156
 1033   2HB   ARG 136           1HB      ARG 136  -8.970  18.553   5.567
 1034   1HG   ARG 136           2HG      ARG 136  -6.029  18.343   5.208
 1035   2HG   ARG 136           1HG      ARG 136  -6.880  19.318   4.009
 1036   1HD   ARG 136           2HD      ARG 136  -7.324  19.663   6.978
 1037   2HD   ARG 136           1HD      ARG 136  -6.083  20.557   6.099
 1038    HE   ARG 136            HE      ARG 136  -8.424  20.961   4.636
 1039   1HH1  ARG 136          2HH1      ARG 136  -6.700  22.820   6.550
 1040   2HH1  ARG 136          1HH1      ARG 136  -7.991  23.577   7.421
 1041   1HH2  ARG 136          1HH2      ARG 136 -10.389  21.314   6.347
 1042   2HH2  ARG 136          2HH2      ARG 136 -10.079  22.714   7.318
 1043    H    SER 137             H      SER 137  -8.928  14.506   5.741
 1044    HA   SER 137            HA      SER 137 -11.462  15.119   7.046
 1045   1HB   SER 137           2HB      SER 137 -12.180  13.019   6.146
 1046   2HB   SER 137           1HB      SER 137 -11.104  13.645   4.924
 1047    HG   SER 137            HG      SER 137 -10.692  11.439   5.466
 1048    H    GLN 138             H      GLN 138  -8.339  13.792   7.877
 1049    HA   GLN 138            HA      GLN 138  -7.504  13.121   9.976
 1050   1HB   GLN 138           2HB      GLN 138  -9.364  14.698  10.881
 1051   2HB   GLN 138           1HB      GLN 138 -10.302  13.223  11.128
 1052   1HG   GLN 138           2HG      GLN 138  -8.129  12.355  12.308
 1053   2HG   GLN 138           1HG      GLN 138  -7.739  14.069  12.446
 1054   1HE2  GLN 138          2HE2      GLN 138 -11.202  12.853  14.318
 1055   2HE2  GLN 138          1HE2      GLN 138 -10.805  12.183  12.809
 1056    OH   TYR 139            OH      TYR 139 -15.104   9.514  10.269
 1057    H    TYR 139             H      TYR 139  -8.512  11.377   7.880
 1058    HA   TYR 139            HA      TYR 139  -9.287   8.983   9.498
 1059   1HB   TYR 139           2HB      TYR 139 -10.087   9.909   6.747
 1060   2HB   TYR 139           1HB      TYR 139 -10.029   8.174   7.083
 1061    HD1  TYR 139           HD2      TYR 139 -11.577  11.386   8.076
 1062    HD2  TYR 139           HD1      TYR 139 -11.611   7.120   8.577
 1063    HE1  TYR 139           HE2      TYR 139 -13.740  11.544   9.272
 1064    HE2  TYR 139           HE1      TYR 139 -13.777   7.279   9.780
 1065    HH   TYR 139            HH      TYR 139 -15.038   8.996  11.073
   
  Start of MODEL          13
 Raw file had 1065 H/Q atoms
  Start of MODEL   13
    1   1H    ALA   1            2H      ALA   1 -19.772  18.425  -0.940
    2   2H    ALA   1            1H      ALA   1 -21.179  19.375  -0.986
    3   3H    ALA   1            3H      ALA   1 -19.679  20.105  -0.686
    4    HA   ALA   1            HA      ALA   1 -20.629  19.991   1.414
    5   1HB   ALA   1           2HB      ALA   1 -21.771  17.475   0.301
    6   2HB   ALA   1           1HB      ALA   1 -21.448  17.500   2.036
    7   3HB   ALA   1           3HB      ALA   1 -22.528  18.697   1.323
    8    H    GLY   2             H      GLY   2 -19.509  16.709   0.520
    9   1HA   GLY   2           2HA      GLY   2 -16.892  17.149   1.801
   10   2HA   GLY   2           1HA      GLY   2 -17.939  15.992   2.621
   11    CH2  TRP   3           CH2      TRP   3 -13.141  11.222   3.666
   12    H    TRP   3             H      TRP   3 -17.974  13.916   1.875
   13    HA   TRP   3            HA      TRP   3 -16.136  12.808   0.150
   14   1HB   TRP   3           2HB      TRP   3 -18.719  11.976   1.076
   15   2HB   TRP   3           1HB      TRP   3 -18.002  11.056  -0.211
   16    HD1  TRP   3           HD1      TRP   3 -18.245   9.366   1.990
   17    HE1  TRP   3           HE1      TRP   3 -16.423   8.590   3.604
   18    HE3  TRP   3           HE3      TRP   3 -14.741  13.162   1.374
   19    HZ2  TRP   3           HZ2      TRP   3 -13.882   9.401   4.513
   20    HZ3  TRP   3           HZ3      TRP   3 -12.649  13.046   2.659
   21    HH2  TRP   3           HH2      TRP   3 -12.216  11.193   4.223
   22    H    ASN   4             H      ASN   4 -19.462  13.716  -0.752
   23    HA   ASN   4            HA      ASN   4 -19.345  12.912  -3.475
   24   1HB   ASN   4           2HB      ASN   4 -20.983  15.111  -2.174
   25   2HB   ASN   4           1HB      ASN   4 -21.255  14.514  -3.814
   26   1HD2  ASN   4          2HD2      ASN   4 -22.425  12.266  -0.620
   27   2HD2  ASN   4          1HD2      ASN   4 -21.493  13.663  -0.385
   28    H    ALA   5             H      ALA   5 -18.019  15.698  -1.968
   29    HA   ALA   5            HA      ALA   5 -17.661  17.340  -4.369
   30   1HB   ALA   5           2HB      ALA   5 -17.633  18.084  -1.844
   31   2HB   ALA   5           1HB      ALA   5 -15.939  17.591  -1.891
   32   3HB   ALA   5           3HB      ALA   5 -16.524  18.857  -2.973
   33    OH   TYR   6            OH      TYR   6 -13.531  17.770   1.356
   34    H    TYR   6             H      TYR   6 -15.754  14.985  -2.495
   35    HA   TYR   6            HA      TYR   6 -13.408  15.251  -4.240
   36   1HB   TYR   6           2HB      TYR   6 -13.977  12.953  -2.353
   37   2HB   TYR   6           1HB      TYR   6 -12.401  13.515  -2.939
   38    HD1  TYR   6           HD1      TYR   6 -11.850  16.041  -2.508
   39    HD2  TYR   6           HD2      TYR   6 -14.801  13.827  -0.458
   40    HE1  TYR   6           HE1      TYR   6 -11.939  17.808  -0.761
   41    HE2  TYR   6           HE2      TYR   6 -14.901  15.533   1.330
   42    HH   TYR   6            HH      TYR   6 -14.461  17.886   1.576
   43    H    ILE   7             H      ILE   7 -16.460  13.876  -4.496
   44    HA   ILE   7            HA      ILE   7 -15.699  11.955  -6.603
   45    HB   ILE   7            HB      ILE   7 -18.312  12.615  -5.288
   46   1HG1  ILE   7          2HG1      ILE   7 -16.645  11.045  -4.248
   47   2HG1  ILE   7          1HG1      ILE   7 -18.208  10.318  -4.563
   48   1HG2  ILE   7          2HG2      ILE   7 -17.794  11.158  -7.858
   49   2HG2  ILE   7          1HG2      ILE   7 -19.168  10.710  -6.838
   50   3HG2  ILE   7          3HG2      ILE   7 -19.051  12.345  -7.503
   51   1HD1  ILE   7          1HD1      ILE   7 -16.497  10.029  -6.860
   52   2HD1  ILE   7          3HD1      ILE   7 -15.684   9.409  -5.427
   53   3HD1  ILE   7          2HD1      ILE   7 -17.258   8.773  -5.891
   54    H    ASP   8             H      ASP   8 -16.869  15.191  -6.001
   55    HA   ASP   8            HA      ASP   8 -17.758  15.913  -8.565
   56   1HB   ASP   8           2HB      ASP   8 -17.059  17.343  -6.124
   57   2HB   ASP   8           1HB      ASP   8 -17.055  18.276  -7.563
   58    H    ASN   9             H      ASN   9 -14.711  15.304  -7.202
   59    HA   ASN   9            HA      ASN   9 -12.864  16.735  -8.669
   60   1HB   ASN   9           2HB      ASN   9 -11.792  15.404  -7.138
   61   2HB   ASN   9           1HB      ASN   9 -13.059  14.323  -7.097
   62   1HD2  ASN   9          2HD2      ASN   9 -11.154  11.617  -8.667
   63   2HD2  ASN   9          1HD2      ASN   9 -12.357  12.078  -7.512
   64    H    LEU  10             H      LEU  10 -14.124  13.708  -9.319
   65    HA   LEU  10            HA      LEU  10 -13.280  12.994 -11.813
   66   1HB   LEU  10           2HB      LEU  10 -15.937  12.616 -10.546
   67   2HB   LEU  10           1HB      LEU  10 -15.410  11.742 -11.956
   68    HG   LEU  10            HG      LEU  10 -14.817  10.243 -10.456
   69   1HD1  LEU  10          2HD1      LEU  10 -12.461  12.115 -10.299
   70   2HD1  LEU  10          1HD1      LEU  10 -12.457  10.568  -9.491
   71   3HD1  LEU  10          3HD1      LEU  10 -12.626  10.642 -11.241
   72   1HD2  LEU  10          3HD2      LEU  10 -14.855  12.457  -8.461
   73   2HD2  LEU  10          2HD2      LEU  10 -15.777  11.006  -8.446
   74   3HD2  LEU  10          1HD2      LEU  10 -14.072  10.994  -8.015
   75    H    MET  11             H      MET  11 -15.951  14.803 -10.819
   76    HA   MET  11            HA      MET  11 -16.855  15.016 -13.580
   77   1HB   MET  11           2HB      MET  11 -17.748  16.370 -11.016
   78   2HB   MET  11           1HB      MET  11 -18.681  16.242 -12.518
   79   1HG   MET  11           2HG      MET  11 -17.584  13.581 -11.231
   80   2HG   MET  11           1HG      MET  11 -19.077  14.352 -10.590
   81   1HE   MET  11           2HE      MET  11 -17.820  11.782 -12.720
   82   2HE   MET  11           1HE      MET  11 -18.538  11.894 -14.325
   83   3HE   MET  11           3HE      MET  11 -17.288  13.044 -13.825
   84    H    ALA  12             H      ALA  12 -14.973  16.965 -11.382
   85    HA   ALA  12            HA      ALA  12 -14.736  19.274 -13.106
   86   1HB   ALA  12           1HB      ALA  12 -13.744  18.565 -10.373
   87   2HB   ALA  12           3HB      ALA  12 -13.009  19.910 -11.244
   88   3HB   ALA  12           2HB      ALA  12 -14.733  19.937 -10.872
   89    H    ASP  13             H      ASP  13 -13.126  16.254 -13.142
   90    HA   ASP  13            HA      ASP  13 -10.462  17.394 -13.849
   91   1HB   ASP  13           2HB      ASP  13  -9.911  14.763 -13.962
   92   2HB   ASP  13           1HB      ASP  13  -9.889  15.675 -12.470
   93    H    GLY  14             H      GLY  14 -13.092  16.542 -15.718
   94   1HA   GLY  14           2HA      GLY  14 -13.258  15.671 -17.993
   95   2HA   GLY  14           1HA      GLY  14 -12.139  17.002 -18.239
   96    H    THR  15             H      THR  15 -11.330  14.061 -16.507
   97    HA   THR  15            HA      THR  15  -9.686  12.914 -18.634
   98    HB   THR  15            HB      THR  15  -8.680  13.831 -15.970
   99    HG1  THR  15           HG1      THR  15  -8.210  15.416 -17.290
  100   1HG2  THR  15          2HG2      THR  15  -7.565  11.886 -17.977
  101   2HG2  THR  15          1HG2      THR  15  -6.555  12.700 -16.762
  102   3HG2  THR  15          3HG2      THR  15  -7.879  11.647 -16.254
  103    H    CYS  16             H      CYS  16 -11.069  12.709 -15.454
  104    HA   CYS  16            HA      CYS  16 -10.503   9.996 -14.961
  105   1HB   CYS  16           2HB      CYS  16 -11.700  10.447 -12.969
  106   2HB   CYS  16           1HB      CYS  16 -11.410  12.060 -13.472
  107    HG   CYS  16            HG      CYS  16 -14.116  10.654 -14.160
  108    H    GLN  17             H      GLN  17 -12.763   8.753 -14.477
  109    HA   GLN  17            HA      GLN  17 -14.739   8.940 -16.554
  110   1HB   GLN  17           2HB      GLN  17 -12.866   7.459 -17.424
  111   2HB   GLN  17           1HB      GLN  17 -13.336   6.309 -16.176
  112   1HG   GLN  17           2HG      GLN  17 -15.690   7.268 -17.599
  113   2HG   GLN  17           1HG      GLN  17 -14.514   6.607 -18.734
  114   1HE2  GLN  17          2HE2      GLN  17 -16.766   3.919 -17.159
  115   2HE2  GLN  17          1HE2      GLN  17 -17.156   5.459 -17.761
  116    H    ASP  18             H      ASP  18 -13.336   7.175 -13.805
  117    HA   ASP  18            HA      ASP  18 -15.985   7.103 -12.511
  118   1HB   ASP  18           2HB      ASP  18 -15.325   4.887 -13.628
  119   2HB   ASP  18           1HB      ASP  18 -14.170   4.741 -12.348
  120    H    ALA  19             H      ALA  19 -15.372   6.172 -10.034
  121    HA   ALA  19            HA      ALA  19 -12.873   7.398  -8.948
  122   1HB   ALA  19           2HB      ALA  19 -15.396   8.839  -9.349
  123   2HB   ALA  19           1HB      ALA  19 -14.756   8.883  -7.681
  124   3HB   ALA  19           3HB      ALA  19 -13.745   9.317  -9.018
  125    H    ALA  20             H      ALA  20 -12.523   6.176  -6.992
  126    HA   ALA  20            HA      ALA  20 -15.054   5.490  -5.477
  127   1HB   ALA  20           3HB      ALA  20 -13.947   3.553  -6.876
  128   2HB   ALA  20           2HB      ALA  20 -13.022   3.369  -5.406
  129   3HB   ALA  20           1HB      ALA  20 -14.787   3.286  -5.361
  130    H    ILE  21             H      ILE  21 -14.901   6.493  -3.660
  131    HA   ILE  21            HA      ILE  21 -12.385   6.431  -2.087
  132    HB   ILE  21            HB      ILE  21 -15.075   7.728  -1.470
  133   1HG1  ILE  21          2HG1      ILE  21 -12.442   8.815  -2.532
  134   2HG1  ILE  21          1HG1      ILE  21 -14.016   8.868  -3.320
  135   1HG2  ILE  21          3HG2      ILE  21 -12.820   7.062   0.215
  136   2HG2  ILE  21          2HG2      ILE  21 -12.903   8.818   0.073
  137   3HG2  ILE  21          1HG2      ILE  21 -14.298   7.913   0.661
  138   1HD1  ILE  21          3HD1      ILE  21 -14.439  10.103  -0.857
  139   2HD1  ILE  21          2HD1      ILE  21 -12.861  10.686  -1.384
  140   3HD1  ILE  21          1HD1      ILE  21 -14.269  10.909  -2.416
  141    H    VAL  22             H      VAL  22 -12.254   4.487  -0.924
  142    HA   VAL  22            HA      VAL  22 -14.815   3.127  -0.273
  143    HB   VAL  22            HB      VAL  22 -12.171   1.814  -0.971
  144   1HG1  VAL  22          2HG1      VAL  22 -14.095   0.673   0.443
  145   2HG1  VAL  22          1HG1      VAL  22 -14.839   0.476  -1.142
  146   3HG1  VAL  22          3HG1      VAL  22 -13.251  -0.231  -0.814
  147   1HG2  VAL  22          3HG2      VAL  22 -13.320   3.158  -2.847
  148   2HG2  VAL  22          2HG2      VAL  22 -12.990   1.456  -3.181
  149   3HG2  VAL  22          1HG2      VAL  22 -14.621   1.968  -2.739
  150    H    GLY  23             H      GLY  23 -15.062   3.187   2.011
  151   1HA   GLY  23           2HA      GLY  23 -12.878   3.335   3.915
  152   2HA   GLY  23           1HA      GLY  23 -14.544   2.882   4.307
  153    OH   TYR  24            OH      TYR  24  -5.516   1.582   4.701
  154    H    TYR  24             H      TYR  24 -11.506   1.664   3.181
  155    HA   TYR  24            HA      TYR  24 -12.276  -1.097   2.982
  156   1HB   TYR  24           2HB      TYR  24 -10.123  -1.417   2.037
  157   2HB   TYR  24           1HB      TYR  24 -10.611   0.179   1.508
  158    HD1  TYR  24           HD1      TYR  24 -10.040   1.521   4.390
  159    HD2  TYR  24           HD2      TYR  24  -7.811  -1.019   1.792
  160    HE1  TYR  24           HE1      TYR  24  -7.942   2.351   5.380
  161    HE2  TYR  24           HE2      TYR  24  -5.712  -0.199   2.756
  162    HH   TYR  24            HH      TYR  24  -4.949   0.821   4.856
  163    H    LYS  25             H      LYS  25 -12.474   0.042   5.754
  164    HA   LYS  25            HA      LYS  25 -10.297  -0.815   7.364
  165   1HB   LYS  25           2HB      LYS  25 -13.120  -0.142   7.865
  166   2HB   LYS  25           1HB      LYS  25 -12.166  -0.829   9.142
  167   1HG   LYS  25           2HG      LYS  25 -11.843   1.476   9.436
  168   2HG   LYS  25           1HG      LYS  25 -10.418   0.970   8.532
  169   1HD   LYS  25           2HD      LYS  25 -11.133   1.932   6.585
  170   2HD   LYS  25           1HD      LYS  25 -12.838   1.781   7.012
  171   1HE   LYS  25           2HE      LYS  25 -10.893   3.662   8.365
  172   2HE   LYS  25           1HE      LYS  25 -12.029   4.137   7.118
  173   1HZ   LYS  25           3HZ      LYS  25 -13.643   2.864   8.840
  174   2HZ   LYS  25           2HZ      LYS  25 -12.500   3.523   9.908
  175   3HZ   LYS  25           1HZ      LYS  25 -13.370   4.537   8.864
  176    H    ASP  26             H      ASP  26 -11.709  -2.529   9.220
  177    HA   ASP  26            HA      ASP  26 -11.058  -5.139   8.480
  178   1HB   ASP  26           2HB      ASP  26 -13.183  -5.813   9.864
  179   2HB   ASP  26           1HB      ASP  26 -11.789  -5.132  10.672
  180    H    SER  27             H      SER  27 -14.291  -3.766   8.158
  181    HA   SER  27            HA      SER  27 -14.885  -5.606   5.934
  182   1HB   SER  27           2HB      SER  27 -17.231  -4.724   6.424
  183   2HB   SER  27           1HB      SER  27 -16.564  -5.826   7.599
  184    HG   SER  27            HG      SER  27 -17.256  -3.190   7.824
  185    HA   PRO  28            HA      PRO  28 -14.195  -1.820   3.719
  186   1HB   PRO  28           2HB      PRO  28 -14.327  -2.873   1.195
  187   2HB   PRO  28           1HB      PRO  28 -12.884  -2.927   2.229
  188   1HG   PRO  28           2HG      PRO  28 -14.729  -5.119   1.530
  189   2HG   PRO  28           1HG      PRO  28 -13.100  -5.179   2.157
  190   1HD   PRO  28           2HD      PRO  28 -15.502  -5.603   3.596
  191   2HD   PRO  28           1HD      PRO  28 -13.846  -5.573   4.237
  192    H    SER  29             H      SER  29 -15.359  -0.400   2.343
  193    HA   SER  29            HA      SER  29 -17.945  -1.079   1.336
  194   1HB   SER  29           2HB      SER  29 -19.212   0.470   2.763
  195   2HB   SER  29           1HB      SER  29 -18.486  -0.813   3.727
  196    HG   SER  29            HG      SER  29 -18.227   1.528   4.383
  197    H    VAL  30             H      VAL  30 -18.833   0.690   0.136
  198    HA   VAL  30            HA      VAL  30 -16.746   2.397  -0.922
  199    HB   VAL  30            HB      VAL  30 -19.569   1.720  -1.693
  200   1HG1  VAL  30          3HG1      VAL  30 -19.030   4.114  -2.282
  201   2HG1  VAL  30          2HG1      VAL  30 -17.658   3.509  -3.202
  202   3HG1  VAL  30          1HG1      VAL  30 -19.294   3.075  -3.682
  203   1HG2  VAL  30          1HG2      VAL  30 -17.030   0.514  -2.070
  204   2HG2  VAL  30          3HG2      VAL  30 -18.539   0.086  -2.867
  205   3HG2  VAL  30          2HG2      VAL  30 -17.445   1.241  -3.617
  206    CH2  TRP  31           CH2      TRP  31 -13.634   5.925   6.657
  207    H    TRP  31             H      TRP  31 -16.348   4.078   0.377
  208    HA   TRP  31            HA      TRP  31 -18.280   5.464   1.955
  209   1HB   TRP  31           2HB      TRP  31 -15.389   5.832   1.241
  210   2HB   TRP  31           1HB      TRP  31 -16.251   7.190   1.966
  211    HD1  TRP  31           HD1      TRP  31 -17.680   3.997   3.168
  212    HE1  TRP  31           HE1      TRP  31 -16.879   3.480   5.516
  213    HE3  TRP  31           HE3      TRP  31 -13.830   7.343   3.584
  214    HZ2  TRP  31           HZ2      TRP  31 -14.904   4.347   7.377
  215    HZ3  TRP  31           HZ3      TRP  31 -12.539   7.484   5.677
  216    HH2  TRP  31           HH2      TRP  31 -13.055   5.981   7.563
  217    H    ALA  32             H      ALA  32 -17.242   5.761  -1.347
  218    HA   ALA  32            HA      ALA  32 -19.353   7.446  -2.139
  219   1HB   ALA  32           3HB      ALA  32 -16.788   8.953  -1.510
  220   2HB   ALA  32           2HB      ALA  32 -18.052   9.609  -2.576
  221   3HB   ALA  32           1HB      ALA  32 -18.408   9.270  -0.874
  222    H    ALA  33             H      ALA  33 -19.215   5.877  -3.831
  223    HA   ALA  33            HA      ALA  33 -17.037   6.348  -5.799
  224   1HB   ALA  33           3HB      ALA  33 -18.789   3.878  -5.452
  225   2HB   ALA  33           2HB      ALA  33 -17.561   4.098  -6.701
  226   3HB   ALA  33           1HB      ALA  33 -17.081   3.999  -5.013
  227    H    VAL  34             H      VAL  34 -17.694   7.111  -7.764
  228    HA   VAL  34            HA      VAL  34 -20.213   8.262  -8.271
  229    HB   VAL  34            HB      VAL  34 -18.338   7.033 -10.361
  230   1HG1  VAL  34          2HG1      VAL  34 -20.642   7.623 -11.175
  231   2HG1  VAL  34          1HG1      VAL  34 -20.381   9.282 -10.603
  232   3HG1  VAL  34          3HG1      VAL  34 -19.374   8.625 -11.899
  233   1HG2  VAL  34          2HG2      VAL  34 -17.474   8.823  -8.634
  234   2HG2  VAL  34          1HG2      VAL  34 -17.158   9.077 -10.349
  235   3HG2  VAL  34          3HG2      VAL  34 -18.470   9.943  -9.556
  236    HA   PRO  35            HA      PRO  35 -22.329   4.235  -8.126
  237   1HB   PRO  35           2HB      PRO  35 -24.896   5.245  -8.021
  238   2HB   PRO  35           1HB      PRO  35 -23.840   5.041  -6.609
  239   1HG   PRO  35           2HG      PRO  35 -24.487   7.551  -8.135
  240   2HG   PRO  35           1HG      PRO  35 -24.162   7.344  -6.402
  241   1HD   PRO  35           2HD      PRO  35 -22.289   8.327  -8.201
  242   2HD   PRO  35           1HD      PRO  35 -21.868   7.516  -6.679
  243    H    GLY  36             H      GLY  36 -23.426   2.956  -9.570
  244   1HA   GLY  36           2HA      GLY  36 -24.727   2.508 -11.545
  245   2HA   GLY  36           1HA      GLY  36 -24.438   4.165 -12.080
  246    H    LYS  37             H      LYS  37 -21.438   3.446 -11.092
  247    HA   LYS  37            HA      LYS  37 -20.611   2.631 -13.800
  248   1HB   LYS  37           2HB      LYS  37 -18.917   3.569 -11.469
  249   2HB   LYS  37           1HB      LYS  37 -18.383   3.378 -13.139
  250   1HG   LYS  37           2HG      LYS  37 -20.517   5.304 -12.144
  251   2HG   LYS  37           1HG      LYS  37 -18.905   5.739 -12.708
  252   1HD   LYS  37           2HD      LYS  37 -19.609   4.513 -14.907
  253   2HD   LYS  37           1HD      LYS  37 -21.252   4.725 -14.298
  254   1HE   LYS  37           2HE      LYS  37 -21.009   6.698 -15.495
  255   2HE   LYS  37           1HE      LYS  37 -20.422   7.223 -13.915
  256   1HZ   LYS  37           1HZ      LYS  37 -18.696   6.186 -16.094
  257   2HZ   LYS  37           3HZ      LYS  37 -18.932   7.832 -15.754
  258   3HZ   LYS  37           2HZ      LYS  37 -18.183   6.826 -14.609
  259    H    THR  38             H      THR  38 -18.733   1.751 -10.851
  260    HA   THR  38            HA      THR  38 -19.348  -1.092 -11.067
  261    HB   THR  38            HB      THR  38 -16.974   0.069 -12.427
  262    HG1  THR  38           HG1      THR  38 -18.187  -0.506 -13.997
  263   1HG2  THR  38          1HG2      THR  38 -16.909  -2.383 -10.866
  264   2HG2  THR  38          3HG2      THR  38 -16.564  -2.684 -12.566
  265   3HG2  THR  38          2HG2      THR  38 -15.578  -1.536 -11.655
  266    H    PHE  39             H      PHE  39 -17.063   1.336  -9.900
  267    HA   PHE  39            HA      PHE  39 -15.612  -0.194  -7.998
  268   1HB   PHE  39           2HB      PHE  39 -16.418   2.684  -7.857
  269   2HB   PHE  39           1HB      PHE  39 -15.075   1.925  -7.005
  270    HD1  PHE  39           HD2      PHE  39 -14.868   0.123  -9.901
  271    HD2  PHE  39           HD1      PHE  39 -14.438   4.196  -8.602
  272    HE1  PHE  39           HE2      PHE  39 -13.414   0.582 -11.828
  273    HE2  PHE  39           HE1      PHE  39 -12.971   4.649 -10.489
  274    HZ   PHE  39            HZ      PHE  39 -12.466   2.822 -12.132
  275    H    VAL  40             H      VAL  40 -18.642   1.483  -7.624
  276    HA   VAL  40            HA      VAL  40 -18.884   1.458  -4.841
  277    HB   VAL  40            HB      VAL  40 -20.380   2.818  -6.096
  278   1HG1  VAL  40          2HG1      VAL  40 -21.033   0.252  -7.513
  279   2HG1  VAL  40          1HG1      VAL  40 -22.123   1.640  -7.575
  280   3HG1  VAL  40          3HG1      VAL  40 -20.466   1.793  -8.188
  281   1HG2  VAL  40          2HG2      VAL  40 -21.371   0.842  -4.256
  282   2HG2  VAL  40          1HG2      VAL  40 -21.942   2.484  -4.523
  283   3HG2  VAL  40          3HG2      VAL  40 -22.610   1.156  -5.471
  284    H    ASN  41             H      ASN  41 -19.062  -1.125  -7.131
  285    HA   ASN  41            HA      ASN  41 -20.351  -2.981  -5.286
  286   1HB   ASN  41           2HB      ASN  41 -19.342  -3.104  -8.118
  287   2HB   ASN  41           1HB      ASN  41 -19.742  -4.553  -7.224
  288   1HD2  ASN  41          2HD2      ASN  41 -23.265  -3.991  -7.299
  289   2HD2  ASN  41          1HD2      ASN  41 -22.021  -4.871  -6.549
  290    H    ILE  42             H      ILE  42 -17.697  -1.632  -4.647
  291    HA   ILE  42            HA      ILE  42 -15.635  -3.646  -4.977
  292    HB   ILE  42            HB      ILE  42 -15.817  -0.874  -3.813
  293   1HG1  ILE  42          2HG1      ILE  42 -13.544  -2.172  -5.316
  294   2HG1  ILE  42          1HG1      ILE  42 -15.019  -1.704  -6.154
  295   1HG2  ILE  42          3HG2      ILE  42 -13.732  -2.900  -2.920
  296   2HG2  ILE  42          2HG2      ILE  42 -13.484  -1.159  -2.824
  297   3HG2  ILE  42          1HG2      ILE  42 -14.779  -1.914  -1.904
  298   1HD1  ILE  42          3HD1      ILE  42 -14.588   0.594  -4.861
  299   2HD1  ILE  42          2HD1      ILE  42 -12.923   0.016  -4.901
  300   3HD1  ILE  42          1HD1      ILE  42 -13.813   0.252  -6.413
  301    H    THR  43             H      THR  43 -15.124  -5.150  -3.572
  302    HA   THR  43            HA      THR  43 -16.453  -5.490  -0.934
  303    HB   THR  43            HB      THR  43 -16.283  -7.939  -1.567
  304    HG1  THR  43           HG1      THR  43 -15.379  -8.519  -3.341
  305   1HG2  THR  43          1HG2      THR  43 -18.300  -6.451  -2.035
  306   2HG2  THR  43          3HG2      THR  43 -17.698  -6.373  -3.692
  307   3HG2  THR  43          2HG2      THR  43 -18.180  -7.924  -3.001
  308    HA   PRO  44            HA      PRO  44 -12.314  -6.164   0.694
  309   1HB   PRO  44           2HB      PRO  44 -12.403  -8.474   2.070
  310   2HB   PRO  44           1HB      PRO  44 -13.038  -6.974   2.688
  311   1HG   PRO  44           2HG      PRO  44 -14.510  -9.334   1.627
  312   2HG   PRO  44           1HG      PRO  44 -15.054  -8.105   2.785
  313   1HD   PRO  44           2HD      PRO  44 -15.773  -8.213   0.090
  314   2HD   PRO  44           1HD      PRO  44 -15.960  -6.794   1.118
  315    H    ALA  45             H      ALA  45 -13.421  -8.150  -1.641
  316    HA   ALA  45            HA      ALA  45 -11.142  -9.947  -1.825
  317   1HB   ALA  45           1HB      ALA  45 -13.759  -9.653  -3.122
  318   2HB   ALA  45           3HB      ALA  45 -12.465 -10.162  -4.207
  319   3HB   ALA  45           2HB      ALA  45 -12.846 -11.126  -2.780
  320    H    GLU  46             H      GLU  46 -12.678  -7.693  -3.990
  321    HA   GLU  46            HA      GLU  46 -10.345  -7.233  -5.624
  322   1HB   GLU  46           2HB      GLU  46 -11.639  -5.050  -6.227
  323   2HB   GLU  46           1HB      GLU  46 -12.329  -6.572  -6.696
  324   1HG   GLU  46           2HG      GLU  46 -13.167  -5.813  -4.030
  325   2HG   GLU  46           1HG      GLU  46 -13.519  -4.532  -5.185
  326    H    VAL  47             H      VAL  47 -11.428  -5.853  -2.583
  327    HA   VAL  47            HA      VAL  47  -9.404  -3.782  -2.571
  328    HB   VAL  47            HB      VAL  47 -11.772  -4.326  -0.996
  329   1HG1  VAL  47          3HG1      VAL  47  -9.451  -2.984   0.237
  330   2HG1  VAL  47          2HG1      VAL  47 -11.073  -3.061   0.914
  331   3HG1  VAL  47          1HG1      VAL  47 -10.098  -4.534   0.770
  332   1HG2  VAL  47          2HG2      VAL  47 -11.204  -2.402  -2.618
  333   2HG2  VAL  47          1HG2      VAL  47 -12.017  -1.997  -1.103
  334   3HG2  VAL  47          3HG2      VAL  47 -10.251  -1.759  -1.240
  335    H    GLY  48             H      GLY  48  -9.744  -7.041  -1.512
  336   1HA   GLY  48           2HA      GLY  48  -7.754  -7.143   0.538
  337   2HA   GLY  48           1HA      GLY  48  -8.242  -8.501  -0.473
  338    H    VAL  49             H      VAL  49  -7.558  -7.063  -2.931
  339    HA   VAL  49            HA      VAL  49  -4.643  -7.560  -2.924
  340    HB   VAL  49            HB      VAL  49  -5.963  -8.722  -4.669
  341   1HG1  VAL  49          1HG1      VAL  49  -6.567  -5.891  -5.574
  342   2HG1  VAL  49          3HG1      VAL  49  -6.913  -7.336  -6.521
  343   3HG1  VAL  49          2HG1      VAL  49  -7.732  -7.073  -4.979
  344   1HG2  VAL  49          2HG2      VAL  49  -3.946  -6.624  -5.528
  345   2HG2  VAL  49          1HG2      VAL  49  -3.696  -8.356  -5.304
  346   3HG2  VAL  49          3HG2      VAL  49  -4.631  -7.772  -6.677
  347    H    LEU  50             H      LEU  50  -6.939  -5.037  -3.551
  348    HA   LEU  50            HA      LEU  50  -5.188  -3.022  -4.557
  349   1HB   LEU  50           2HB      LEU  50  -7.825  -3.189  -3.338
  350   2HB   LEU  50           1HB      LEU  50  -7.108  -1.652  -3.306
  351    HG   LEU  50            HG      LEU  50  -7.453  -3.193  -5.843
  352   1HD1  LEU  50          1HD1      LEU  50  -9.388  -1.330  -4.368
  353   2HD1  LEU  50          3HD1      LEU  50  -9.563  -1.788  -6.077
  354   3HD1  LEU  50          2HD1      LEU  50  -9.671  -3.026  -4.829
  355   1HD2  LEU  50          2HD2      LEU  50  -5.980  -1.073  -5.565
  356   2HD2  LEU  50          1HD2      LEU  50  -7.178  -1.060  -6.858
  357   3HD2  LEU  50          3HD2      LEU  50  -7.504  -0.214  -5.342
  358    H    VAL  51             H      VAL  51  -5.709  -4.345  -1.429
  359    HA   VAL  51            HA      VAL  51  -4.085  -2.208  -0.139
  360    HB   VAL  51            HB      VAL  51  -5.874  -1.516   1.274
  361   1HG1  VAL  51          2HG1      VAL  51  -7.257  -2.539  -1.215
  362   2HG1  VAL  51          1HG1      VAL  51  -8.067  -1.585  -0.004
  363   3HG1  VAL  51          3HG1      VAL  51  -6.711  -0.896  -0.886
  364   1HG2  VAL  51          2HG2      VAL  51  -6.738  -4.375   1.106
  365   2HG2  VAL  51          1HG2      VAL  51  -6.652  -3.314   2.512
  366   3HG2  VAL  51          3HG2      VAL  51  -8.009  -3.176   1.388
  367    H    GLY  52             H      GLY  52  -4.839  -5.541  -0.269
  368   1HA   GLY  52           2HA      GLY  52  -4.389  -6.377   2.431
  369   2HA   GLY  52           1HA      GLY  52  -4.063  -7.383   1.025
  370    H    LYS  53             H      LYS  53  -2.068  -8.115   1.077
  371    HA   LYS  53            HA      LYS  53   0.077  -7.063   2.607
  372   1HB   LYS  53           2HB      LYS  53   1.376  -8.897   1.680
  373   2HB   LYS  53           1HB      LYS  53  -0.203  -9.464   2.190
  374   1HG   LYS  53           2HG      LYS  53  -0.472 -10.324   0.117
  375   2HG   LYS  53           1HG      LYS  53  -0.573  -8.664  -0.474
  376   1HD   LYS  53           2HD      LYS  53   1.170  -9.743  -1.734
  377   2HD   LYS  53           1HD      LYS  53   1.964  -8.659  -0.590
  378   1HE   LYS  53           2HE      LYS  53   2.413 -10.515   0.930
  379   2HE   LYS  53           1HE      LYS  53   1.507 -11.622  -0.103
  380   1HZ   LYS  53           1HZ      LYS  53   3.259 -10.627  -1.851
  381   2HZ   LYS  53           3HZ      LYS  53   4.186 -10.547  -0.433
  382   3HZ   LYS  53           2HZ      LYS  53   3.540 -12.032  -0.939
  383    H    ASP  54             H      ASP  54  -1.076  -5.915  -0.223
  384    HA   ASP  54            HA      ASP  54   0.352  -5.409  -2.297
  385   1HB   ASP  54           2HB      ASP  54  -1.365  -3.845  -1.735
  386   2HB   ASP  54           1HB      ASP  54  -0.509  -3.301  -0.304
  387    NH1  ARG  55           NH2      ARG  55   7.913  -5.172   3.804
  388    NH2  ARG  55           NH1      ARG  55   8.431  -2.993   3.489
  389    H    ARG  55             H      ARG  55   2.482  -5.924  -2.445
  390    HA   ARG  55            HA      ARG  55   4.409  -3.974  -1.823
  391   1HB   ARG  55           2HB      ARG  55   4.027  -5.473   0.325
  392   2HB   ARG  55           1HB      ARG  55   5.160  -6.528  -0.525
  393   1HG   ARG  55           2HG      ARG  55   6.739  -4.617  -0.754
  394   2HG   ARG  55           1HG      ARG  55   5.619  -3.606   0.157
  395   1HD   ARG  55           2HD      ARG  55   5.808  -5.139   2.086
  396   2HD   ARG  55           1HD      ARG  55   6.948  -6.130   1.173
  397    HE   ARG  55            HE      ARG  55   8.190  -3.720   1.078
  398   1HH1  ARG  55          1HH2      ARG  55   7.597  -6.048   3.440
  399   2HH1  ARG  55          2HH2      ARG  55   8.158  -5.092   4.770
  400   1HH2  ARG  55          2HH1      ARG  55   8.515  -2.202   2.883
  401   2HH2  ARG  55          1HH1      ARG  55   8.664  -2.909   4.456
  402    H    SER  56             H      SER  56   3.500  -6.760  -3.634
  403    HA   SER  56            HA      SER  56   5.670  -6.391  -5.465
  404   1HB   SER  56           2HB      SER  56   7.024  -7.487  -3.845
  405   2HB   SER  56           1HB      SER  56   5.847  -8.773  -3.659
  406    HG   SER  56            HG      SER  56   7.299  -9.597  -5.056
  407    H    SER  57             H      SER  57   3.742  -9.039  -4.318
  408    HA   SER  57            HA      SER  57   3.331 -10.583  -6.479
  409   1HB   SER  57           2HB      SER  57   1.010 -11.040  -5.564
  410   2HB   SER  57           1HB      SER  57   2.355 -11.258  -4.457
  411    HG   SER  57            HG      SER  57   1.885  -9.290  -3.535
  412    H    PHE  58             H      PHE  58   0.249  -9.138  -6.132
  413    HA   PHE  58            HA      PHE  58  -0.536  -9.090  -8.726
  414   1HB   PHE  58           2HB      PHE  58  -2.148  -7.284  -8.250
  415   2HB   PHE  58           1HB      PHE  58  -2.133  -8.567  -7.065
  416    HD1  PHE  58           HD2      PHE  58  -0.761  -5.216  -7.791
  417    HD2  PHE  58           HD1      PHE  58  -1.778  -8.117  -4.803
  418    HE1  PHE  58           HE2      PHE  58  -0.336  -3.556  -6.028
  419    HE2  PHE  58           HE1      PHE  58  -1.346  -6.446  -3.035
  420    HZ   PHE  58            HZ      PHE  58  -0.635  -4.179  -3.677
  421    OH   TYR  59            OH      TYR  59   3.346  -3.124  -3.670
  422    H    TYR  59             H      TYR  59   1.950  -6.790  -7.781
  423    HA   TYR  59            HA      TYR  59   1.333  -4.776  -9.593
  424   1HB   TYR  59           2HB      TYR  59   4.150  -5.636  -9.180
  425   2HB   TYR  59           1HB      TYR  59   3.551  -4.052  -9.630
  426    HD1  TYR  59           HD1      TYR  59   1.366  -3.715  -7.737
  427    HD2  TYR  59           HD2      TYR  59   5.327  -5.199  -7.191
  428    HE1  TYR  59           HE1      TYR  59   1.354  -2.880  -5.385
  429    HE2  TYR  59           HE2      TYR  59   5.331  -4.370  -4.884
  430    HH   TYR  59            HH      TYR  59   4.128  -2.585  -3.548
  431    H    VAL  60             H      VAL  60   2.063  -7.915 -10.356
  432    HA   VAL  60            HA      VAL  60   2.852  -7.276 -13.080
  433    HB   VAL  60            HB      VAL  60   3.285  -9.689 -13.192
  434   1HG1  VAL  60          2HG1      VAL  60   4.536  -7.893 -11.174
  435   2HG1  VAL  60          1HG1      VAL  60   5.168  -9.533 -11.402
  436   3HG1  VAL  60          3HG1      VAL  60   5.166  -8.394 -12.750
  437   1HG2  VAL  60          2HG2      VAL  60   1.672 -10.370 -11.390
  438   2HG2  VAL  60          1HG2      VAL  60   3.275 -11.070 -11.217
  439   3HG2  VAL  60          3HG2      VAL  60   2.803  -9.696 -10.234
  440    H    ASN  61             H      ASN  61   0.265  -9.000 -11.274
  441    HA   ASN  61            HA      ASN  61  -1.069  -9.628 -13.762
  442   1HB   ASN  61           2HB      ASN  61  -2.887 -10.472 -12.175
  443   2HB   ASN  61           1HB      ASN  61  -1.415 -11.359 -12.273
  444   1HD2  ASN  61          2HD2      ASN  61  -0.646 -11.007  -8.918
  445   2HD2  ASN  61          1HD2      ASN  61  -0.223 -11.664 -10.420
  446    H    GLY  62             H      GLY  62  -2.019  -7.703 -10.868
  447   1HA   GLY  62           2HA      GLY  62  -2.663  -5.337 -11.553
  448   2HA   GLY  62           1HA      GLY  62  -3.788  -6.126 -12.653
  449    H    LEU  63             H      LEU  63  -4.277  -4.298 -10.344
  450    HA   LEU  63            HA      LEU  63  -5.511  -5.871  -8.225
  451   1HB   LEU  63           2HB      LEU  63  -6.093  -2.944  -8.782
  452   2HB   LEU  63           1HB      LEU  63  -6.229  -3.786  -7.243
  453    HG   LEU  63            HG      LEU  63  -3.612  -3.311  -8.698
  454   1HD1  LEU  63          2HD1      LEU  63  -5.218  -1.395  -7.488
  455   2HD1  LEU  63          1HD1      LEU  63  -4.188  -1.919  -6.149
  456   3HD1  LEU  63          3HD1      LEU  63  -3.467  -1.297  -7.635
  457   1HD2  LEU  63          2HD2      LEU  63  -4.522  -4.579  -6.127
  458   2HD2  LEU  63          1HD2      LEU  63  -3.293  -5.127  -7.275
  459   3HD2  LEU  63          3HD2      LEU  63  -2.951  -3.780  -6.192
  460    H    THR  64             H      THR  64  -7.931  -4.440  -7.928
  461    HA   THR  64            HA      THR  64  -9.531  -4.702 -10.292
  462    HB   THR  64            HB      THR  64 -11.038  -6.388  -9.148
  463    HG1  THR  64           HG1      THR  64  -8.683  -6.817  -7.636
  464   1HG2  THR  64          3HG2      THR  64  -9.374  -6.840 -10.995
  465   2HG2  THR  64          2HG2      THR  64  -8.288  -7.448  -9.736
  466   3HG2  THR  64          1HG2      THR  64  -9.846  -8.233 -10.024
  467    H    LEU  65             H      LEU  65 -10.953  -3.146 -10.062
  468    HA   LEU  65            HA      LEU  65 -11.891  -2.477  -7.302
  469   1HB   LEU  65           2HB      LEU  65 -12.107  -0.094  -8.086
  470   2HB   LEU  65           1HB      LEU  65 -10.475  -0.639  -7.819
  471    HG   LEU  65            HG      LEU  65 -11.768  -0.693 -10.541
  472   1HD1  LEU  65          2HD1      LEU  65 -11.716   1.608  -9.387
  473   2HD1  LEU  65          1HD1      LEU  65  -9.958   1.484  -9.498
  474   3HD1  LEU  65          3HD1      LEU  65 -10.930   1.485 -10.966
  475   1HD2  LEU  65          3HD2      LEU  65  -9.280  -1.602  -9.465
  476   2HD2  LEU  65          2HD2      LEU  65  -9.785  -1.580 -11.151
  477   3HD2  LEU  65          1HD2      LEU  65  -8.930  -0.199 -10.475
  478    H    GLY  66             H      GLY  66 -13.819  -3.443  -7.368
  479   1HA   GLY  66           2HA      GLY  66 -16.128  -3.595  -7.836
  480   2HA   GLY  66           1HA      GLY  66 -15.908  -2.381  -9.099
  481    H    GLY  67             H      GLY  67 -13.701  -5.070  -9.039
  482   1HA   GLY  67           2HA      GLY  67 -13.691  -7.097 -10.271
  483   2HA   GLY  67           1HA      GLY  67 -15.207  -6.616 -11.038
  484    H    GLN  68             H      GLN  68 -13.015  -3.952 -11.017
  485    HA   GLN  68            HA      GLN  68 -12.483  -4.401 -13.911
  486   1HB   GLN  68           2HB      GLN  68 -13.368  -2.235 -13.055
  487   2HB   GLN  68           1HB      GLN  68 -11.769  -1.989 -12.416
  488   1HG   GLN  68           2HG      GLN  68 -12.098  -2.754 -15.291
  489   2HG   GLN  68           1HG      GLN  68 -12.290  -1.071 -14.808
  490   1HE2  GLN  68          2HE2      GLN  68  -8.578  -2.285 -15.513
  491   2HE2  GLN  68          1HE2      GLN  68 -10.001  -2.932 -16.199
  492    H    LYS  69             H      LYS  69 -10.752  -5.793 -14.130
  493    HA   LYS  69            HA      LYS  69  -8.487  -5.872 -12.489
  494   1HB   LYS  69           2HB      LYS  69  -9.393  -7.531 -14.257
  495   2HB   LYS  69           1HB      LYS  69  -8.502  -6.546 -15.417
  496   1HG   LYS  69           2HG      LYS  69  -6.761  -7.857 -14.893
  497   2HG   LYS  69           1HG      LYS  69  -6.658  -6.870 -13.447
  498   1HD   LYS  69           2HD      LYS  69  -7.840  -8.438 -12.141
  499   2HD   LYS  69           1HD      LYS  69  -8.445  -9.281 -13.566
  500   1HE   LYS  69           2HE      LYS  69  -5.529  -9.234 -13.564
  501   2HE   LYS  69           1HE      LYS  69  -6.146  -9.950 -12.074
  502   1HZ   LYS  69           3HZ      LYS  69  -7.557 -11.403 -13.435
  503   2HZ   LYS  69           2HZ      LYS  69  -6.871 -10.749 -14.845
  504   3HZ   LYS  69           1HZ      LYS  69  -5.908 -11.632 -13.759
  505    H    CYS  70             H      CYS  70  -7.302  -3.937 -12.144
  506    HA   CYS  70            HA      CYS  70  -6.352  -2.492 -14.640
  507   1HB   CYS  70           2HB      CYS  70  -5.834  -0.650 -13.022
  508   2HB   CYS  70           1HB      CYS  70  -7.548  -0.989 -13.158
  509    HG   CYS  70            HG      CYS  70  -6.433  -2.586 -10.873
  510    H    SER  71             H      SER  71  -3.998  -1.786 -14.271
  511    HA   SER  71            HA      SER  71  -2.555  -3.773 -12.597
  512   1HB   SER  71           2HB      SER  71  -1.212  -4.496 -14.285
  513   2HB   SER  71           1HB      SER  71  -2.646  -4.074 -15.182
  514    HG   SER  71            HG      SER  71  -0.255  -2.639 -14.908
  515    H    VAL  72             H      VAL  72  -1.427  -2.856 -11.167
  516    HA   VAL  72            HA      VAL  72  -0.765  -0.240 -10.705
  517    HB   VAL  72            HB      VAL  72   1.265  -2.298 -10.059
  518   1HG1  VAL  72          1HG1      VAL  72   0.917   0.343  -9.403
  519   2HG1  VAL  72          3HG1      VAL  72   0.267  -0.499  -8.006
  520   3HG1  VAL  72          2HG1      VAL  72   1.913  -0.807  -8.525
  521   1HG2  VAL  72          3HG2      VAL  72  -1.542  -2.209  -9.059
  522   2HG2  VAL  72          2HG2      VAL  72  -0.525  -3.611  -9.383
  523   3HG2  VAL  72          1HG2      VAL  72  -0.257  -2.638  -7.938
  524    H    ILE  73             H      ILE  73   0.586   1.135 -11.353
  525    HA   ILE  73            HA      ILE  73   2.947   0.410 -12.858
  526    HB   ILE  73            HB      ILE  73   0.867   2.288 -13.776
  527   1HG1  ILE  73          2HG1      ILE  73   2.119   0.861 -15.890
  528   2HG1  ILE  73          1HG1      ILE  73   1.808  -0.283 -14.587
  529   1HG2  ILE  73          2HG2      ILE  73   3.764   2.540 -14.187
  530   2HG2  ILE  73          1HG2      ILE  73   2.747   2.778 -15.609
  531   3HG2  ILE  73          3HG2      ILE  73   2.529   3.798 -14.185
  532   1HD1  ILE  73          1HD1      ILE  73  -0.568   1.086 -14.666
  533   2HD1  ILE  73          3HD1      ILE  73  -0.100   1.111 -16.367
  534   3HD1  ILE  73          2HD1      ILE  73  -0.270  -0.432 -15.524
  535    NH1  ARG  74           NH1      ARG  74   9.253   3.602 -12.004
  536    NH2  ARG  74           NH2      ARG  74  10.276   4.640 -10.278
  537    H    ARG  74             H      ARG  74   3.604   0.783 -10.710
  538    HA   ARG  74            HA      ARG  74   5.266   1.980  -9.447
  539   1HB   ARG  74           2HB      ARG  74   4.709   4.029 -11.082
  540   2HB   ARG  74           1HB      ARG  74   3.750   4.553  -9.699
  541   1HG   ARG  74           2HG      ARG  74   5.964   5.497  -9.459
  542   2HG   ARG  74           1HG      ARG  74   5.781   4.225  -8.253
  543   1HD   ARG  74           2HD      ARG  74   7.578   3.161  -9.097
  544   2HD   ARG  74           1HD      ARG  74   6.772   3.020 -10.659
  545    HE   ARG  74            HE      ARG  74   7.774   5.653 -10.493
  546   1HH1  ARG  74          2HH1      ARG  74   8.417   3.345 -12.486
  547   2HH1  ARG  74          1HH1      ARG  74  10.144   3.316 -12.359
  548   1HH2  ARG  74          1HH2      ARG  74  10.224   5.179  -9.438
  549   2HH2  ARG  74          2HH2      ARG  74  11.165   4.351 -10.633
  550    H    ASP  75             H      ASP  75   4.324   0.654  -7.854
  551    HA   ASP  75            HA      ASP  75   1.919   1.552  -6.555
  552   1HB   ASP  75           2HB      ASP  75   2.028  -0.794  -6.637
  553   2HB   ASP  75           1HB      ASP  75   3.664  -0.796  -6.108
  554    H    SER  76             H      SER  76   2.019   3.335  -5.460
  555    HA   SER  76            HA      SER  76   4.166   3.503  -3.355
  556   1HB   SER  76           2HB      SER  76   3.668   5.438  -5.330
  557   2HB   SER  76           1HB      SER  76   2.887   6.058  -3.889
  558    HG   SER  76            HG      SER  76   5.534   5.053  -4.009
  559    H    LEU  77             H      LEU  77   0.968   2.826  -3.909
  560    HA   LEU  77            HA      LEU  77  -0.884   3.987  -2.326
  561   1HB   LEU  77           2HB      LEU  77  -0.837   1.688  -3.546
  562   2HB   LEU  77           1HB      LEU  77  -0.300   1.041  -1.997
  563    HG   LEU  77            HG      LEU  77  -2.314   1.994  -0.921
  564   1HD1  LEU  77          3HD1      LEU  77  -2.807   2.933  -3.743
  565   2HD1  LEU  77          2HD1      LEU  77  -4.157   2.653  -2.639
  566   3HD1  LEU  77          1HD1      LEU  77  -2.922   3.847  -2.237
  567   1HD2  LEU  77          2HD2      LEU  77  -2.295  -0.085  -3.031
  568   2HD2  LEU  77          1HD2      LEU  77  -2.915  -0.162  -1.374
  569   3HD2  LEU  77          3HD2      LEU  77  -3.905   0.543  -2.655
  570    H    LEU  78             H      LEU  78   1.811   2.061  -1.048
  571    HA   LEU  78            HA      LEU  78   0.903   2.795   1.597
  572   1HB   LEU  78           2HB      LEU  78   2.954   0.933   0.717
  573   2HB   LEU  78           1HB      LEU  78   2.657   1.243   2.392
  574    HG   LEU  78            HG      LEU  78   0.430   0.443   0.498
  575   1HD1  LEU  78          1HD1      LEU  78   2.208  -1.439   2.084
  576   2HD1  LEU  78          3HD1      LEU  78   0.613  -1.899   1.449
  577   3HD1  LEU  78          2HD1      LEU  78   1.923  -1.445   0.343
  578   1HD2  LEU  78          1HD2      LEU  78  -0.109   1.470   2.698
  579   2HD2  LEU  78          3HD2      LEU  78  -0.714  -0.181   2.554
  580   3HD2  LEU  78          2HD2      LEU  78   0.742   0.147   3.496
  581    H    GLN  79             H      GLN  79   1.580   4.531   2.453
  582    HA   GLN  79            HA      GLN  79   2.829   6.557   1.454
  583   1HB   GLN  79           2HB      GLN  79   2.846   7.562   3.681
  584   2HB   GLN  79           1HB      GLN  79   1.354   6.651   3.450
  585   1HG   GLN  79           2HG      GLN  79   3.073   4.742   4.501
  586   2HG   GLN  79           1HG      GLN  79   3.536   6.207   5.370
  587   1HE2  GLN  79          2HE2      GLN  79   0.226   6.609   6.841
  588   2HE2  GLN  79          1HE2      GLN  79   1.464   7.541   6.148
  589    H    ASP  80             H      ASP  80   4.526   5.762   0.480
  590    HA   ASP  80            HA      ASP  80   7.053   5.553   2.072
  591   1HB   ASP  80           2HB      ASP  80   6.759   3.801   0.317
  592   2HB   ASP  80           1HB      ASP  80   6.475   5.058  -0.887
  593    H    GLY  81             H      GLY  81   5.236   7.938   1.713
  594   1HA   GLY  81           2HA      GLY  81   5.768  10.256   1.575
  595   2HA   GLY  81           1HA      GLY  81   7.121   9.844   0.512
  596    H    GLU  82             H      GLU  82   3.963   8.286  -0.004
  597    HA   GLU  82            HA      GLU  82   3.263  10.080  -2.170
  598   1HB   GLU  82           2HB      GLU  82   4.377   7.378  -2.424
  599   2HB   GLU  82           1HB      GLU  82   3.216   7.927  -3.566
  600   1HG   GLU  82           2HG      GLU  82   5.882   9.179  -3.009
  601   2HG   GLU  82           1HG      GLU  82   5.388   8.316  -4.481
  602    H    PHE  83             H      PHE  83   2.552   6.761  -1.071
  603    HA   PHE  83            HA      PHE  83   0.554   5.543  -0.891
  604   1HB   PHE  83           2HB      PHE  83  -1.522   7.384  -0.935
  605   2HB   PHE  83           1HB      PHE  83  -0.974   6.445   0.372
  606    HD1  PHE  83           HD1      PHE  83   1.129   7.412   1.642
  607    HD2  PHE  83           HD2      PHE  83  -1.570   9.707  -0.780
  608    HE1  PHE  83           HE1      PHE  83   1.844   9.480   2.828
  609    HE2  PHE  83           HE2      PHE  83  -0.856  11.785   0.399
  610    HZ   PHE  83            HZ      PHE  83   0.849  11.671   2.205
  611    H    SER  84             H      SER  84   1.328   7.349  -3.593
  612    HA   SER  84            HA      SER  84  -1.225   6.944  -4.983
  613   1HB   SER  84           2HB      SER  84   0.072   8.108  -6.878
  614   2HB   SER  84           1HB      SER  84  -0.371   9.056  -5.458
  615    HG   SER  84            HG      SER  84   1.880   9.235  -6.180
  616    H    MET  85             H      MET  85  -1.590   5.425  -6.378
  617    HA   MET  85            HA      MET  85   0.613   3.564  -7.257
  618   1HB   MET  85           2HB      MET  85  -1.091   3.010  -5.386
  619   2HB   MET  85           1HB      MET  85  -2.211   2.926  -6.684
  620   1HG   MET  85           2HG      MET  85  -0.982   1.131  -7.710
  621   2HG   MET  85           1HG      MET  85   0.197   1.252  -6.438
  622   1HE   MET  85           3HE      MET  85  -0.077  -1.125  -6.217
  623   2HE   MET  85           2HE      MET  85  -1.401  -1.934  -5.367
  624   3HE   MET  85           1HE      MET  85  -1.613  -1.481  -7.061
  625    H    ASP  86             H      ASP  86   0.712   3.595  -9.594
  626    HA   ASP  86            HA      ASP  86  -1.699   4.715 -10.999
  627   1HB   ASP  86           2HB      ASP  86   1.124   4.235 -11.634
  628   2HB   ASP  86           1HB      ASP  86  -0.013   4.249 -12.960
  629    H    LEU  87             H      LEU  87  -3.088   2.738 -10.627
  630    HA   LEU  87            HA      LEU  87  -2.170   0.475 -12.275
  631   1HB   LEU  87           2HB      LEU  87  -4.367  -0.608 -11.310
  632   2HB   LEU  87           1HB      LEU  87  -2.858  -0.676 -10.479
  633    HG   LEU  87            HG      LEU  87  -4.700  -0.182  -8.954
  634   1HD1  LEU  87          1HD1      LEU  87  -2.300   1.245  -9.138
  635   2HD1  LEU  87          3HD1      LEU  87  -3.534   2.412  -8.668
  636   3HD1  LEU  87          2HD1      LEU  87  -3.288   0.957  -7.714
  637   1HD2  LEU  87          3HD2      LEU  87  -5.842   1.196 -10.912
  638   2HD2  LEU  87          2HD2      LEU  87  -6.204   1.512  -9.222
  639   3HD2  LEU  87          1HD2      LEU  87  -5.064   2.543 -10.085
  640    NH1  ARG  88           NH2      ARG  88  -1.070   0.737 -20.636
  641    NH2  ARG  88           NH1      ARG  88   0.510   2.353 -20.658
  642    H    ARG  88             H      ARG  88  -2.683   0.394 -14.224
  643    HA   ARG  88            HA      ARG  88  -5.209   1.879 -15.033
  644   1HB   ARG  88           2HB      ARG  88  -4.153   2.829 -16.882
  645   2HB   ARG  88           1HB      ARG  88  -2.811   2.761 -15.781
  646   1HG   ARG  88           2HG      ARG  88  -1.918   0.825 -16.960
  647   2HG   ARG  88           1HG      ARG  88  -3.367   0.664 -17.970
  648   1HD   ARG  88           2HD      ARG  88  -2.731   2.377 -19.327
  649   2HD   ARG  88           1HD      ARG  88  -2.125   3.371 -17.980
  650    HE   ARG  88            HE      ARG  88  -0.030   1.974 -18.107
  651   1HH1  ARG  88          1HH2      ARG  88  -1.787   0.233 -20.155
  652   2HH1  ARG  88          2HH2      ARG  88  -0.844   0.505 -21.581
  653   1HH2  ARG  88          2HH1      ARG  88   1.005   3.085 -20.191
  654   2HH2  ARG  88          1HH1      ARG  88   0.733   2.125 -21.608
  655    H    THR  89             H      THR  89  -6.677   0.965 -16.301
  656    HA   THR  89            HA      THR  89  -6.784  -1.885 -16.648
  657    HB   THR  89            HB      THR  89  -8.797  -1.522 -17.821
  658    HG1  THR  89           HG1      THR  89  -8.694  -0.400 -19.546
  659   1HG2  THR  89          2HG2      THR  89  -8.687  -0.237 -15.584
  660   2HG2  THR  89          1HG2      THR  89  -8.662   1.205 -16.593
  661   3HG2  THR  89          3HG2      THR  89 -10.037   0.099 -16.668
  662    H    LYS  90             H      LYS  90  -5.012  -2.732 -17.724
  663    HA   LYS  90            HA      LYS  90  -3.865  -1.338 -19.931
  664   1HB   LYS  90           2HB      LYS  90  -2.897  -4.073 -19.304
  665   2HB   LYS  90           1HB      LYS  90  -2.043  -2.605 -19.703
  666   1HG   LYS  90           2HG      LYS  90  -3.352  -2.661 -17.048
  667   2HG   LYS  90           1HG      LYS  90  -1.899  -3.606 -17.283
  668   1HD   LYS  90           2HD      LYS  90  -1.906  -0.825 -18.355
  669   2HD   LYS  90           1HD      LYS  90  -1.753  -1.052 -16.616
  670   1HE   LYS  90           2HE      LYS  90   0.372  -1.826 -16.794
  671   2HE   LYS  90           1HE      LYS  90  -0.053  -2.904 -18.123
  672   1HZ   LYS  90           1HZ      LYS  90   0.408   0.014 -18.374
  673   2HZ   LYS  90           3HZ      LYS  90   1.526  -1.184 -18.786
  674   3HZ   LYS  90           2HZ      LYS  90   0.068  -1.058 -19.646
  675    H    SER  91             H      SER  91  -3.278  -2.582 -21.857
  676    HA   SER  91            HA      SER  91  -5.437  -4.428 -22.764
  677   1HB   SER  91           2HB      SER  91  -6.136  -2.486 -23.847
  678   2HB   SER  91           1HB      SER  91  -4.550  -1.831 -23.922
  679    HG   SER  91            HG      SER  91  -4.483  -2.523 -25.886
  680    H    THR  92             H      THR  92  -4.668  -5.304 -25.095
  681    HA   THR  92            HA      THR  92  -1.762  -6.049 -24.847
  682    HB   THR  92            HB      THR  92  -2.338  -8.278 -25.673
  683    HG1  THR  92           HG1      THR  92  -4.048  -8.271 -26.898
  684   1HG2  THR  92          1HG2      THR  92  -4.124  -7.308 -23.423
  685   2HG2  THR  92          3HG2      THR  92  -3.846  -9.009 -23.794
  686   3HG2  THR  92          2HG2      THR  92  -2.505  -7.989 -23.270
  687    H    GLY  93             H      GLY  93  -2.746  -3.809 -26.357
  688   1HA   GLY  93           2HA      GLY  93  -1.848  -2.971 -28.453
  689   2HA   GLY  93           1HA      GLY  93  -1.885  -4.614 -29.095
  690    H    GLY  94             H      GLY  94  -4.105  -5.570 -29.386
  691   1HA   GLY  94           2HA      GLY  94  -5.795  -3.750 -30.890
  692   2HA   GLY  94           1HA      GLY  94  -6.120  -5.456 -30.600
  693    H    ALA  95             H      ALA  95  -5.608  -4.382 -27.552
  694    HA   ALA  95            HA      ALA  95  -8.516  -3.952 -27.097
  695   1HB   ALA  95           2HB      ALA  95  -6.565  -5.449 -25.726
  696   2HB   ALA  95           1HB      ALA  95  -6.910  -4.077 -24.681
  697   3HB   ALA  95           3HB      ALA  95  -8.218  -5.129 -25.201
  698    HA   PRO  96            HA      PRO  96  -7.927   0.225 -25.803
  699   1HB   PRO  96           2HB      PRO  96 -10.092   0.485 -24.183
  700   2HB   PRO  96           1HB      PRO  96 -10.253   0.216 -25.930
  701   1HG   PRO  96           2HG      PRO  96 -10.805  -1.696 -23.712
  702   2HG   PRO  96           1HG      PRO  96 -11.384  -1.735 -25.378
  703   1HD   PRO  96           2HD      PRO  96  -9.194  -3.220 -24.234
  704   2HD   PRO  96           1HD      PRO  96  -9.822  -3.265 -25.894
  705    H    THR  97             H      THR  97  -7.141   1.552 -24.052
  706    HA   THR  97            HA      THR  97  -6.729   0.143 -21.427
  707    HB   THR  97            HB      THR  97  -4.730   1.710 -21.132
  708    HG1  THR  97           HG1      THR  97  -5.112   1.916 -23.946
  709   1HG2  THR  97          2HG2      THR  97  -4.939  -0.813 -22.263
  710   2HG2  THR  97          1HG2      THR  97  -3.889   0.065 -23.375
  711   3HG2  THR  97          3HG2      THR  97  -3.467  -0.043 -21.667
  712    H    PHE  98             H      PHE  98  -6.781   1.510 -19.612
  713    HA   PHE  98            HA      PHE  98  -7.816   4.237 -19.814
  714   1HB   PHE  98           2HB      PHE  98  -9.201   2.021 -18.251
  715   2HB   PHE  98           1HB      PHE  98  -9.686   3.721 -18.307
  716    HD1  PHE  98           HD1      PHE  98  -9.767   4.636 -20.886
  717    HD2  PHE  98           HD2      PHE  98 -10.449   0.596 -19.617
  718    HE1  PHE  98           HE1      PHE  98 -11.056   4.214 -22.960
  719    HE2  PHE  98           HE2      PHE  98 -11.736   0.164 -21.699
  720    HZ   PHE  98            HZ      PHE  98 -12.035   1.974 -23.372
  721    H    ASN  99             H      ASN  99  -7.299   5.408 -17.809
  722    HA   ASN  99            HA      ASN  99  -5.387   3.842 -16.132
  723   1HB   ASN  99           2HB      ASN  99  -5.020   6.791 -16.610
  724   2HB   ASN  99           1HB      ASN  99  -3.840   5.619 -16.017
  725   1HD2  ASN  99          2HD2      ASN  99  -2.616   5.746 -19.366
  726   2HD2  ASN  99          1HD2      ASN  99  -2.377   6.312 -17.786
  727    H    VAL 100             H      VAL 100  -5.311   3.999 -14.036
  728    HA   VAL 100            HA      VAL 100  -7.270   5.711 -12.642
  729    HB   VAL 100            HB      VAL 100  -6.503   2.983 -11.587
  730   1HG1  VAL 100          1HG1      VAL 100  -8.018   4.946 -10.585
  731   2HG1  VAL 100          3HG1      VAL 100  -9.256   4.054 -11.452
  732   3HG1  VAL 100          2HG1      VAL 100  -8.286   3.248 -10.228
  733   1HG2  VAL 100          2HG2      VAL 100  -8.236   3.495 -13.980
  734   2HG2  VAL 100          1HG2      VAL 100  -7.290   2.066 -13.566
  735   3HG2  VAL 100          3HG2      VAL 100  -8.852   2.347 -12.789
  736    H    THR 101             H      THR 101  -6.478   6.535 -10.741
  737    HA   THR 101            HA      THR 101  -3.746   5.744  -9.898
  738    HB   THR 101            HB      THR 101  -5.166   8.461  -9.779
  739    HG1  THR 101           HG1      THR 101  -3.808   7.905 -11.572
  740   1HG2  THR 101          3HG2      THR 101  -2.685   7.609  -8.235
  741   2HG2  THR 101          2HG2      THR 101  -3.337   9.236  -8.303
  742   3HG2  THR 101          1HG2      THR 101  -4.261   7.967  -7.525
  743    H    VAL 102             H      VAL 102  -3.678   5.262  -7.706
  744    HA   VAL 102            HA      VAL 102  -6.240   5.358  -6.236
  745    HB   VAL 102            HB      VAL 102  -4.512   2.984  -6.922
  746   1HG1  VAL 102          3HG1      VAL 102  -6.129   3.430  -4.402
  747   2HG1  VAL 102          2HG1      VAL 102  -6.170   1.841  -5.164
  748   3HG1  VAL 102          1HG1      VAL 102  -4.638   2.513  -4.615
  749   1HG2  VAL 102          1HG2      VAL 102  -7.395   3.799  -7.017
  750   2HG2  VAL 102          3HG2      VAL 102  -6.337   3.276  -8.322
  751   3HG2  VAL 102          2HG2      VAL 102  -6.915   2.101  -7.147
  752    H    THR 103             H      THR 103  -5.906   6.634  -4.640
  753    HA   THR 103            HA      THR 103  -3.218   6.831  -3.381
  754    HB   THR 103            HB      THR 103  -4.230   8.929  -2.345
  755    HG1  THR 103           HG1      THR 103  -6.335   8.764  -2.661
  756   1HG2  THR 103          2HG2      THR 103  -2.986   8.463  -4.788
  757   2HG2  THR 103          1HG2      THR 103  -4.386   9.476  -5.225
  758   3HG2  THR 103          3HG2      THR 103  -3.212  10.033  -4.017
  759    H    LYS 104             H      LYS 104  -2.943   6.175  -1.323
  760    HA   LYS 104            HA      LYS 104  -5.313   5.235   0.201
  761   1HB   LYS 104           2HB      LYS 104  -3.704   3.473  -0.363
  762   2HB   LYS 104           1HB      LYS 104  -2.410   4.431   0.315
  763   1HG   LYS 104           2HG      LYS 104  -2.803   3.078   2.135
  764   2HG   LYS 104           1HG      LYS 104  -3.984   4.332   2.488
  765   1HD   LYS 104           2HD      LYS 104  -5.189   2.345   2.652
  766   2HD   LYS 104           1HD      LYS 104  -5.595   2.966   1.070
  767   1HE   LYS 104           2HE      LYS 104  -5.058   0.526   1.020
  768   2HE   LYS 104           1HE      LYS 104  -3.966   1.479   0.024
  769   1HZ   LYS 104           2HZ      LYS 104  -3.253   0.977   2.828
  770   2HZ   LYS 104           1HZ      LYS 104  -3.037  -0.271   1.693
  771   3HZ   LYS 104           3HZ      LYS 104  -2.243   1.213   1.484
  772    H    THR 105             H      THR 105  -5.753   6.210   2.081
  773    HA   THR 105            HA      THR 105  -3.913   8.311   3.110
  774    HB   THR 105            HB      THR 105  -5.835   8.972   4.507
  775    HG1  THR 105           HG1      THR 105  -7.514   7.714   4.749
  776   1HG2  THR 105          2HG2      THR 105  -5.992   8.741   1.582
  777   2HG2  THR 105          1HG2      THR 105  -7.556   8.948   2.360
  778   3HG2  THR 105          3HG2      THR 105  -6.285  10.143   2.616
  779    H    ASP 106             H      ASP 106  -5.197   7.739   5.898
  780    HA   ASP 106            HA      ASP 106  -3.322   5.565   6.620
  781   1HB   ASP 106           2HB      ASP 106  -3.286   7.785   7.842
  782   2HB   ASP 106           1HB      ASP 106  -4.872   7.366   8.491
  783    H    LYS 107             H      LYS 107  -6.738   6.277   6.267
  784    HA   LYS 107            HA      LYS 107  -7.390   3.503   7.086
  785   1HB   LYS 107           2HB      LYS 107  -9.015   5.778   8.256
  786   2HB   LYS 107           1HB      LYS 107  -9.012   4.084   8.732
  787   1HG   LYS 107           2HG      LYS 107  -6.738   4.301   9.614
  788   2HG   LYS 107           1HG      LYS 107  -6.674   5.978   9.074
  789   1HD   LYS 107           2HD      LYS 107  -8.571   6.525  10.551
  790   2HD   LYS 107           1HD      LYS 107  -8.610   4.856  11.110
  791   1HE   LYS 107           2HE      LYS 107  -6.019   5.373  11.580
  792   2HE   LYS 107           1HE      LYS 107  -6.652   7.014  11.723
  793   1HZ   LYS 107           2HZ      LYS 107  -7.720   4.650  13.167
  794   2HZ   LYS 107           1HZ      LYS 107  -6.675   5.807  13.841
  795   3HZ   LYS 107           3HZ      LYS 107  -8.233   6.260  13.350
  796    H    THR 108             H      THR 108  -7.478   5.156   4.509
  797    HA   THR 108            HA      THR 108 -10.240   4.377   3.724
  798    HB   THR 108            HB      THR 108 -10.870   6.486   2.855
  799    HG1  THR 108           HG1      THR 108  -9.093   7.221   1.851
  800   1HG2  THR 108          2HG2      THR 108 -10.848   6.276   5.385
  801   2HG2  THR 108          1HG2      THR 108  -9.343   7.208   5.373
  802   3HG2  THR 108          3HG2      THR 108 -10.837   7.936   4.773
  803    H    LEU 109             H      LEU 109 -10.358   3.971   1.458
  804    HA   LEU 109            HA      LEU 109  -7.773   3.652   0.024
  805   1HB   LEU 109           2HB      LEU 109  -9.512   1.721   0.800
  806   2HB   LEU 109           1HB      LEU 109 -10.235   2.097  -0.739
  807    HG   LEU 109            HG      LEU 109  -8.351   0.229  -0.330
  808   1HD1  LEU 109          2HD1      LEU 109  -9.559   1.512  -2.572
  809   2HD1  LEU 109          1HD1      LEU 109  -7.960   0.880  -2.973
  810   3HD1  LEU 109          3HD1      LEU 109  -9.189  -0.192  -2.296
  811   1HD2  LEU 109          2HD2      LEU 109  -6.847   2.626  -1.310
  812   2HD2  LEU 109          1HD2      LEU 109  -6.521   1.642   0.106
  813   3HD2  LEU 109          3HD2      LEU 109  -6.279   0.967  -1.494
  814    H    VAL 110             H      VAL 110  -7.968   5.895  -1.031
  815    HA   VAL 110            HA      VAL 110 -10.460   6.424  -2.477
  816    HB   VAL 110            HB      VAL 110  -7.928   7.996  -1.865
  817   1HG1  VAL 110          2HG1      VAL 110  -9.684   8.341  -4.231
  818   2HG1  VAL 110          1HG1      VAL 110  -9.378   9.805  -3.303
  819   3HG1  VAL 110          3HG1      VAL 110  -8.036   8.887  -3.970
  820   1HG2  VAL 110          2HG2      VAL 110 -10.418   7.846  -0.666
  821   2HG2  VAL 110          1HG2      VAL 110  -9.311   9.217  -0.500
  822   3HG2  VAL 110          3HG2      VAL 110 -10.613   9.266  -1.708
  823    H    LEU 111             H      LEU 111 -10.641   6.390  -4.658
  824    HA   LEU 111            HA      LEU 111  -8.313   5.572  -6.282
  825   1HB   LEU 111           2HB      LEU 111 -11.062   4.521  -6.955
  826   2HB   LEU 111           1HB      LEU 111  -9.492   3.895  -7.445
  827    HG   LEU 111            HG      LEU 111 -10.580   3.773  -4.648
  828   1HD1  LEU 111          3HD1      LEU 111 -11.305   2.207  -6.863
  829   2HD1  LEU 111          2HD1      LEU 111 -10.179   1.205  -5.935
  830   3HD1  LEU 111          1HD1      LEU 111 -11.637   1.848  -5.169
  831   1HD2  LEU 111          3HD2      LEU 111  -8.040   3.781  -5.161
  832   2HD2  LEU 111          2HD2      LEU 111  -8.696   2.653  -3.994
  833   3HD2  LEU 111          1HD2      LEU 111  -8.340   2.113  -5.633
  834    H    LEU 112             H      LEU 112  -8.492   6.331  -8.396
  835    HA   LEU 112            HA      LEU 112 -10.582   8.313  -9.007
  836   1HB   LEU 112           2HB      LEU 112  -8.531   9.457  -8.115
  837   2HB   LEU 112           1HB      LEU 112  -7.600   8.614  -9.311
  838    HG   LEU 112            HG      LEU 112  -7.966  10.200 -10.863
  839   1HD1  LEU 112          1HD1      LEU 112 -10.838   9.695 -10.310
  840   2HD1  LEU 112          3HD1      LEU 112 -10.419  11.223 -11.089
  841   3HD1  LEU 112          2HD1      LEU 112  -9.958   9.698 -11.842
  842   1HD2  LEU 112          3HD2      LEU 112  -8.789  11.414  -8.325
  843   2HD2  LEU 112          2HD2      LEU 112  -7.610  11.955  -9.520
  844   3HD2  LEU 112          1HD2      LEU 112  -9.323  12.290  -9.767
  845    H    MET 113             H      MET 113 -11.475   7.170 -10.642
  846    HA   MET 113            HA      MET 113  -9.668   5.663 -12.469
  847   1HB   MET 113           2HB      MET 113 -11.554   4.454 -11.837
  848   2HB   MET 113           1HB      MET 113 -12.619   5.762 -12.164
  849   1HG   MET 113           2HG      MET 113 -13.038   4.359 -13.990
  850   2HG   MET 113           1HG      MET 113 -11.854   5.457 -14.664
  851   1HE   MET 113           2HE      MET 113 -13.156   2.497 -14.574
  852   2HE   MET 113           1HE      MET 113 -12.077   1.916 -15.836
  853   3HE   MET 113           3HE      MET 113 -12.047   1.174 -14.230
  854    H    GLY 114             H      GLY 114  -9.576   5.910 -14.628
  855   1HA   GLY 114           2HA      GLY 114 -10.665   8.331 -15.803
  856   2HA   GLY 114           1HA      GLY 114  -8.942   8.127 -15.824
  857    H    LYS 115             H      LYS 115 -10.693   8.330 -18.017
  858    HA   LYS 115            HA      LYS 115 -10.077   5.885 -19.465
  859   1HB   LYS 115           2HB      LYS 115 -12.712   7.303 -19.351
  860   2HB   LYS 115           1HB      LYS 115 -12.196   6.513 -20.845
  861   1HG   LYS 115           2HG      LYS 115 -11.599   4.525 -19.190
  862   2HG   LYS 115           1HG      LYS 115 -12.839   5.272 -18.210
  863   1HD   LYS 115           2HD      LYS 115 -14.419   5.151 -20.121
  864   2HD   LYS 115           1HD      LYS 115 -13.169   4.361 -21.080
  865   1HE   LYS 115           2HE      LYS 115 -13.134   2.785 -18.858
  866   2HE   LYS 115           1HE      LYS 115 -14.828   3.267 -18.869
  867   1HZ   LYS 115           3HZ      LYS 115 -13.757   2.450 -21.445
  868   2HZ   LYS 115           2HZ      LYS 115 -13.840   1.218 -20.277
  869   3HZ   LYS 115           1HZ      LYS 115 -15.243   2.072 -20.714
  870    H    GLU 116             H      GLU 116 -10.045   6.406 -21.823
  871    HA   GLU 116            HA      GLU 116  -8.110   7.721 -22.909
  872   1HB   GLU 116           2HB      GLU 116  -9.950   6.839 -23.873
  873   2HB   GLU 116           1HB      GLU 116 -10.780   8.322 -23.750
  874   1HG   GLU 116           2HG      GLU 116  -9.213   9.395 -25.250
  875   2HG   GLU 116           1HG      GLU 116  -8.157   7.982 -25.213
  876    H    GLY 117             H      GLY 117  -7.384   9.545 -23.860
  877   1HA   GLY 117           2HA      GLY 117  -6.765  11.832 -23.884
  878   2HA   GLY 117           1HA      GLY 117  -8.315  12.227 -23.085
  879    H    VAL 118             H      VAL 118  -6.818   9.404 -21.904
  880    HA   VAL 118            HA      VAL 118  -6.248  10.606 -19.356
  881    HB   VAL 118            HB      VAL 118  -7.990   8.820 -20.099
  882   1HG1  VAL 118          1HG1      VAL 118  -6.340   7.274 -21.053
  883   2HG1  VAL 118          3HG1      VAL 118  -5.765   6.971 -19.412
  884   3HG1  VAL 118          2HG1      VAL 118  -7.448   6.596 -19.832
  885   1HG2  VAL 118          3HG2      VAL 118  -6.256   8.580 -17.601
  886   2HG2  VAL 118          2HG2      VAL 118  -7.731   9.543 -17.806
  887   3HG2  VAL 118          1HG2      VAL 118  -7.826   7.779 -17.798
  888    H    HIS 119             H      HIS 119  -4.147  11.181 -19.223
  889    HA   HIS 119            HA      HIS 119  -2.030   9.487 -20.357
  890   1HB   HIS 119           2HB      HIS 119  -2.049  12.061 -20.244
  891   2HB   HIS 119           1HB      HIS 119  -1.560  11.848 -18.562
  892    HD1  HIS 119           HD1      HIS 119   0.645  10.271 -18.235
  893    HD2  HIS 119           HD2      HIS 119   0.033  11.824 -22.054
  894    HE1  HIS 119           HE1      HIS 119   2.847  10.032 -19.470
  895    H    GLY 120             H      GLY 120  -3.398  10.393 -17.247
  896   1HA   GLY 120           2HA      GLY 120  -3.498   8.778 -15.424
  897   2HA   GLY 120           1HA      GLY 120  -1.965   8.107 -15.985
  898    H    GLY 121             H      GLY 121  -1.115  11.143 -16.349
  899   1HA   GLY 121           2HA      GLY 121   0.125  11.368 -13.682
  900   2HA   GLY 121           1HA      GLY 121   0.455  12.409 -15.064
  901    H    LEU 122             H      LEU 122  -2.452  12.929 -15.492
  902    HA   LEU 122            HA      LEU 122  -2.774  15.166 -13.640
  903   1HB   LEU 122           2HB      LEU 122  -5.047  14.319 -15.416
  904   2HB   LEU 122           1HB      LEU 122  -4.523  15.935 -14.995
  905    HG   LEU 122            HG      LEU 122  -3.927  15.857 -17.243
  906   1HD1  LEU 122          2HD1      LEU 122  -1.804  15.893 -15.554
  907   2HD1  LEU 122          1HD1      LEU 122  -1.373  14.515 -16.563
  908   3HD1  LEU 122          3HD1      LEU 122  -1.660  16.089 -17.302
  909   1HD2  LEU 122          1HD2      LEU 122  -4.021  12.982 -16.801
  910   2HD2  LEU 122          3HD2      LEU 122  -4.269  13.894 -18.289
  911   3HD2  LEU 122          2HD2      LEU 122  -2.640  13.419 -17.813
  912    H    ILE 123             H      ILE 123  -4.193  12.024 -14.293
  913    HA   ILE 123            HA      ILE 123  -6.261  12.142 -12.281
  914    HB   ILE 123            HB      ILE 123  -4.795   9.965 -13.726
  915   1HG1  ILE 123          2HG1      ILE 123  -7.669  10.939 -13.921
  916   2HG1  ILE 123          1HG1      ILE 123  -6.366  11.463 -14.994
  917   1HG2  ILE 123          1HG2      ILE 123  -6.197   9.543 -11.287
  918   2HG2  ILE 123          3HG2      ILE 123  -7.305   9.030 -12.558
  919   3HG2  ILE 123          2HG2      ILE 123  -5.703   8.309 -12.437
  920   1HD1  ILE 123          2HD1      ILE 123  -7.177   8.589 -14.576
  921   2HD1  ILE 123          1HD1      ILE 123  -7.727   9.615 -15.886
  922   3HD1  ILE 123          3HD1      ILE 123  -6.026   9.218 -15.754
  923    H    ASN 124             H      ASN 124  -2.863  11.170 -12.394
  924    HA   ASN 124            HA      ASN 124  -2.673  10.066  -9.776
  925   1HB   ASN 124           2HB      ASN 124  -0.921   9.850 -11.572
  926   2HB   ASN 124           1HB      ASN 124  -0.507  11.542 -11.286
  927   1HD2  ASN 124          2HD2      ASN 124   1.496   9.048  -9.113
  928   2HD2  ASN 124          1HD2      ASN 124   1.033   8.921 -10.739
  929    H    LYS 125             H      LYS 125  -2.755  13.294 -11.104
  930    HA   LYS 125            HA      LYS 125  -1.891  14.622  -8.551
  931   1HB   LYS 125           2HB      LYS 125  -2.767  15.544 -11.305
  932   2HB   LYS 125           1HB      LYS 125  -2.628  16.694  -9.967
  933   1HG   LYS 125           2HG      LYS 125  -0.285  15.006  -9.984
  934   2HG   LYS 125           1HG      LYS 125  -0.528  15.648 -11.605
  935   1HD   LYS 125           2HD      LYS 125  -0.996  17.772  -9.720
  936   2HD   LYS 125           1HD      LYS 125   0.534  16.999  -9.318
  937   1HE   LYS 125           2HE      LYS 125  -0.171  17.850 -12.138
  938   2HE   LYS 125           1HE      LYS 125   0.685  18.900 -11.009
  939   1HZ   LYS 125           1HZ      LYS 125   1.664  16.165 -11.467
  940   2HZ   LYS 125           3HZ      LYS 125   2.006  17.368 -12.612
  941   3HZ   LYS 125           2HZ      LYS 125   2.524  17.554 -11.003
  942    H    LYS 126             H      LYS 126  -4.966  13.904 -10.206
  943    HA   LYS 126            HA      LYS 126  -6.570  15.597  -8.411
  944   1HB   LYS 126           2HB      LYS 126  -7.122  13.864 -10.777
  945   2HB   LYS 126           1HB      LYS 126  -8.443  14.141  -9.644
  946   1HG   LYS 126           2HG      LYS 126  -8.763  16.020 -10.897
  947   2HG   LYS 126           1HG      LYS 126  -7.485  16.666  -9.873
  948   1HD   LYS 126           2HD      LYS 126  -6.905  17.140 -12.173
  949   2HD   LYS 126           1HD      LYS 126  -5.815  15.895 -11.585
  950   1HE   LYS 126           2HE      LYS 126  -6.509  14.466 -13.192
  951   2HE   LYS 126           1HE      LYS 126  -8.181  14.660 -12.698
  952   1HZ   LYS 126           2HZ      LYS 126  -7.991  16.898 -13.937
  953   2HZ   LYS 126           1HZ      LYS 126  -6.652  16.179 -14.703
  954   3HZ   LYS 126           3HZ      LYS 126  -8.188  15.472 -14.839
  955    H    CYS 127             H      CYS 127  -5.361  12.383  -8.429
  956    HA   CYS 127            HA      CYS 127  -7.334  11.315  -6.521
  957   1HB   CYS 127           2HB      CYS 127  -6.007   9.979  -8.377
  958   2HB   CYS 127           1HB      CYS 127  -4.739   9.988  -7.170
  959    HG   CYS 127            HG      CYS 127  -5.972   8.299  -5.849
  960    OH   TYR 128            OH      TYR 128   1.619  15.233  -1.570
  961    H    TYR 128             H      TYR 128  -4.057  12.551  -6.763
  962    HA   TYR 128            HA      TYR 128  -3.254  12.032  -4.045
  963   1HB   TYR 128           2HB      TYR 128  -1.691  12.512  -5.917
  964   2HB   TYR 128           1HB      TYR 128  -2.367  14.127  -6.073
  965    HD1  TYR 128           HD1      TYR 128  -1.620  12.307  -2.879
  966    HD2  TYR 128           HD2      TYR 128  -0.523  15.443  -5.610
  967    HE1  TYR 128           HE1      TYR 128   0.035  13.139  -1.233
  968    HE2  TYR 128           HE2      TYR 128   1.136  16.288  -3.947
  969    HH   TYR 128            HH      TYR 128   2.424  14.716  -1.672
  970    H    GLU 129             H      GLU 129  -5.127  14.524  -5.735
  971    HA   GLU 129            HA      GLU 129  -5.253  16.323  -3.397
  972   1HB   GLU 129           2HB      GLU 129  -6.430  16.359  -6.171
  973   2HB   GLU 129           1HB      GLU 129  -7.034  17.456  -4.930
  974   1HG   GLU 129           2HG      GLU 129  -4.344  17.790  -4.623
  975   2HG   GLU 129           1HG      GLU 129  -4.436  17.469  -6.354
  976    H    MET 130             H      MET 130  -7.123  13.760  -4.883
  977    HA   MET 130            HA      MET 130  -9.658  14.138  -3.585
  978   1HB   MET 130           2HB      MET 130  -8.741  12.454  -5.522
  979   2HB   MET 130           1HB      MET 130  -8.595  11.371  -4.152
  980   1HG   MET 130           2HG      MET 130 -11.042  11.836  -3.635
  981   2HG   MET 130           1HG      MET 130 -11.130  12.731  -5.171
  982   1HE   MET 130           2HE      MET 130 -12.758  10.647  -4.076
  983   2HE   MET 130           1HE      MET 130 -13.256  10.339  -5.740
  984   3HE   MET 130           3HE      MET 130 -12.660   9.013  -4.731
  985    H    ALA 131             H      ALA 131  -6.712  12.340  -2.771
  986    HA   ALA 131            HA      ALA 131  -7.566  11.548  -0.089
  987   1HB   ALA 131           1HB      ALA 131  -4.937  11.340  -1.615
  988   2HB   ALA 131           3HB      ALA 131  -5.115  10.829   0.072
  989   3HB   ALA 131           2HB      ALA 131  -6.053  10.033  -1.190
  990    H    SER 132             H      SER 132  -6.085  14.333  -1.582
  991    HA   SER 132            HA      SER 132  -4.540  15.321   0.603
  992   1HB   SER 132           2HB      SER 132  -5.991  16.738  -1.626
  993   2HB   SER 132           1HB      SER 132  -5.155  17.628  -0.376
  994    HG   SER 132            HG      SER 132  -3.398  17.217  -1.433
  995    H    HIS 133             H      HIS 133  -8.039  15.268  -0.135
  996    HA   HIS 133            HA      HIS 133  -8.626  16.948   2.217
  997   1HB   HIS 133           2HB      HIS 133 -10.217  16.790   0.212
  998   2HB   HIS 133           1HB      HIS 133 -10.733  15.210   0.889
  999    HD1  HIS 133           HD1      HIS 133 -12.201  15.261   2.919
 1000    HD2  HIS 133           HD2      HIS 133 -10.563  19.011   2.127
 1001    HE1  HIS 133           HE1      HIS 133 -13.273  16.869   4.557
 1002    H    LEU 134             H      LEU 134  -8.653  13.465   1.299
 1003    HA   LEU 134            HA      LEU 134  -9.635  12.656   3.936
 1004   1HB   LEU 134           2HB      LEU 134  -8.209  11.184   1.730
 1005   2HB   LEU 134           1HB      LEU 134  -8.692  10.403   3.239
 1006    HG   LEU 134            HG      LEU 134 -10.971  11.732   2.578
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.479  11.162   0.073
 1008   2HD1  LEU 134          1HD1      LEU 134 -11.221  10.920   0.088
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.549  12.504   0.459
 1010   1HD2  LEU 134          3HD2      LEU 134 -10.127   8.957   1.740
 1011   2HD2  LEU 134          2HD2      LEU 134 -10.884   9.404   3.266
 1012   3HD2  LEU 134          1HD2      LEU 134 -11.798   9.520   1.762
 1013    NH1  ARG 135           NH1      ARG 135  -1.691  15.003   6.175
 1014    NH2  ARG 135           NH2      ARG 135  -1.384  12.882   6.892
 1015    H    ARG 135             H      ARG 135  -6.747  14.022   3.059
 1016    HA   ARG 135            HA      ARG 135  -5.137  12.755   5.180
 1017   1HB   ARG 135           2HB      ARG 135  -4.587  14.574   2.853
 1018   2HB   ARG 135           1HB      ARG 135  -3.501  14.635   4.239
 1019   1HG   ARG 135           2HG      ARG 135  -4.267  12.007   2.989
 1020   2HG   ARG 135           1HG      ARG 135  -2.942  12.970   2.335
 1021   1HD   ARG 135           2HD      ARG 135  -3.183  11.961   5.181
 1022   2HD   ARG 135           1HD      ARG 135  -2.059  11.371   3.954
 1023    HE   ARG 135            HE      ARG 135  -1.043  13.690   4.007
 1024   1HH1  ARG 135          2HH1      ARG 135  -1.834  15.653   5.426
 1025   2HH1  ARG 135          1HH1      ARG 135  -1.639  15.332   7.118
 1026   1HH2  ARG 135          1HH2      ARG 135  -1.290  11.905   6.694
 1027   2HH2  ARG 135          2HH2      ARG 135  -1.338  13.206   7.836
 1028    NH1  ARG 136           NH1      ARG 136  -5.065  20.070   1.179
 1029    NH2  ARG 136           NH2      ARG 136  -3.219  20.423   2.435
 1030    H    ARG 136             H      ARG 136  -6.673  15.762   4.155
 1031    HA   ARG 136            HA      ARG 136  -6.050  17.175   6.616
 1032   1HB   ARG 136           2HB      ARG 136  -7.849  17.760   4.265
 1033   2HB   ARG 136           1HB      ARG 136  -7.829  18.790   5.695
 1034   1HG   ARG 136           2HG      ARG 136  -5.414  19.179   5.389
 1035   2HG   ARG 136           1HG      ARG 136  -5.428  18.145   3.961
 1036   1HD   ARG 136           2HD      ARG 136  -6.948  19.650   2.812
 1037   2HD   ARG 136           1HD      ARG 136  -7.132  20.632   4.264
 1038    HE   ARG 136            HE      ARG 136  -5.039  21.638   3.797
 1039   1HH1  ARG 136          2HH1      ARG 136  -6.061  20.081   1.079
 1040   2HH1  ARG 136          1HH1      ARG 136  -4.489  19.778   0.413
 1041   1HH2  ARG 136          1HH2      ARG 136  -2.800  20.707   3.297
 1042   2HH2  ARG 136          2HH2      ARG 136  -2.644  20.129   1.672
 1043    H    SER 137             H      SER 137  -8.134  14.695   5.734
 1044    HA   SER 137            HA      SER 137 -10.420  15.382   7.373
 1045   1HB   SER 137           2HB      SER 137 -11.318  13.307   6.588
 1046   2HB   SER 137           1HB      SER 137 -10.398  13.904   5.229
 1047    HG   SER 137            HG      SER 137 -10.064  11.648   5.834
 1048    H    GLN 138             H      GLN 138  -7.240  14.133   7.917
 1049    HA   GLN 138            HA      GLN 138  -6.198  13.295   9.837
 1050   1HB   GLN 138           2HB      GLN 138  -8.721  14.489  10.936
 1051   2HB   GLN 138           1HB      GLN 138  -7.781  13.434  11.989
 1052   1HG   GLN 138           2HG      GLN 138  -5.803  14.989  10.926
 1053   2HG   GLN 138           1HG      GLN 138  -7.141  16.136  10.960
 1054   1HE2  GLN 138          2HE2      GLN 138  -7.256  16.313  14.512
 1055   2HE2  GLN 138          1HE2      GLN 138  -8.097  16.647  13.078
 1056    OH   TYR 139            OH      TYR 139 -14.639  10.142  10.354
 1057    H    TYR 139             H      TYR 139  -7.932  11.622   8.041
 1058    HA   TYR 139            HA      TYR 139  -8.837   9.480   9.901
 1059   1HB   TYR 139           2HB      TYR 139  -9.444  10.236   7.079
 1060   2HB   TYR 139           1HB      TYR 139  -9.472   8.516   7.465
 1061    HD1  TYR 139           HD2      TYR 139 -11.014  11.791   8.139
 1062    HD2  TYR 139           HD1      TYR 139 -11.091   7.595   9.049
 1063    HE1  TYR 139           HE2      TYR 139 -13.227  12.069   9.224
 1064    HE2  TYR 139           HE1      TYR 139 -13.304   7.870  10.131
 1065    HH   TYR 139            HH      TYR 139 -15.279   9.625   9.861
   
  Start of MODEL          14
 Raw file had 1065 H/Q atoms
  Start of MODEL   14
    1   1H    ALA   1            1H      ALA   1 -20.586  16.652   4.795
    2   2H    ALA   1            3H      ALA   1 -21.545  18.034   4.586
    3   3H    ALA   1            2H      ALA   1 -22.270  16.498   4.623
    4    HA   ALA   1            HA      ALA   1 -21.473  15.907   2.541
    5   1HB   ALA   1           2HB      ALA   1 -22.067  18.880   2.474
    6   2HB   ALA   1           1HB      ALA   1 -22.093  17.808   1.074
    7   3HB   ALA   1           3HB      ALA   1 -23.258  17.582   2.378
    8    H    GLY   2             H      GLY   2 -19.424  15.395   2.011
    9   1HA   GLY   2           2HA      GLY   2 -17.565  17.523   1.169
   10   2HA   GLY   2           1HA      GLY   2 -17.004  16.506   2.501
   11    CH2  TRP   3           CH2      TRP   3 -13.174  11.476   3.699
   12    H    TRP   3             H      TRP   3 -17.926  14.036   1.838
   13    HA   TRP   3            HA      TRP   3 -16.102  12.911   0.102
   14   1HB   TRP   3           2HB      TRP   3 -18.687  12.104   1.060
   15   2HB   TRP   3           1HB      TRP   3 -17.986  11.168  -0.220
   16    HD1  TRP   3           HD1      TRP   3 -18.149   9.410   1.911
   17    HE1  TRP   3           HE1      TRP   3 -16.326   8.688   3.562
   18    HE3  TRP   3           HE3      TRP   3 -14.841  13.362   1.413
   19    HZ2  TRP   3           HZ2      TRP   3 -13.829   9.609   4.520
   20    HZ3  TRP   3           HZ3      TRP   3 -12.769  13.336   2.715
   21    HH2  TRP   3           HH2      TRP   3 -12.252  11.484   4.261
   22    H    ASN   4             H      ASN   4 -19.425  13.843  -0.754
   23    HA   ASN   4            HA      ASN   4 -19.365  13.025  -3.471
   24   1HB   ASN   4           2HB      ASN   4 -21.176  14.845  -3.784
   25   2HB   ASN   4           1HB      ASN   4 -21.512  13.566  -2.620
   26   1HD2  ASN   4          2HD2      ASN   4 -21.529  15.751   0.178
   27   2HD2  ASN   4          1HD2      ASN   4 -21.599  14.140  -0.354
   28    H    ALA   5             H      ALA   5 -18.036  15.846  -1.993
   29    HA   ALA   5            HA      ALA   5 -17.621  17.441  -4.404
   30   1HB   ALA   5           1HB      ALA   5 -17.564  18.394  -2.064
   31   2HB   ALA   5           3HB      ALA   5 -16.046  17.536  -1.794
   32   3HB   ALA   5           2HB      ALA   5 -16.138  18.803  -3.018
   33    OH   TYR   6            OH      TYR   6 -13.428  17.934   1.108
   34    H    TYR   6             H      TYR   6 -15.732  15.045  -2.552
   35    HA   TYR   6            HA      TYR   6 -13.406  15.228  -4.342
   36   1HB   TYR   6           2HB      TYR   6 -14.017  12.996  -2.398
   37   2HB   TYR   6           1HB      TYR   6 -12.432  13.487  -3.014
   38    HD1  TYR   6           HD1      TYR   6 -11.853  16.045  -2.706
   39    HD2  TYR   6           HD2      TYR   6 -14.758  13.919  -0.492
   40    HE1  TYR   6           HE1      TYR   6 -11.900  17.874  -1.036
   41    HE2  TYR   6           HE2      TYR   6 -14.810  15.690   1.221
   42    HH   TYR   6            HH      TYR   6 -13.456  18.758   0.619
   43    H    ILE   7             H      ILE   7 -16.476  13.926  -4.550
   44    HA   ILE   7            HA      ILE   7 -15.792  11.952  -6.622
   45    HB   ILE   7            HB      ILE   7 -18.345  12.691  -5.248
   46   1HG1  ILE   7          2HG1      ILE   7 -16.616  11.052  -4.333
   47   2HG1  ILE   7          1HG1      ILE   7 -18.255  10.437  -4.464
   48   1HG2  ILE   7          2HG2      ILE   7 -17.961  11.225  -7.839
   49   2HG2  ILE   7          1HG2      ILE   7 -19.320  10.838  -6.777
   50   3HG2  ILE   7          3HG2      ILE   7 -19.153  12.465  -7.446
   51   1HD1  ILE   7          1HD1      ILE   7 -16.724  10.015  -6.906
   52   2HD1  ILE   7          3HD1      ILE   7 -15.950   9.259  -5.516
   53   3HD1  ILE   7          2HD1      ILE   7 -17.610   8.846  -5.938
   54    H    ASP   8             H      ASP   8 -16.845  15.219  -6.066
   55    HA   ASP   8            HA      ASP   8 -17.711  15.931  -8.654
   56   1HB   ASP   8           2HB      ASP   8 -17.110  17.333  -6.178
   57   2HB   ASP   8           1HB      ASP   8 -17.066  18.286  -7.607
   58    H    ASN   9             H      ASN   9 -14.700  15.229  -7.282
   59    HA   ASN   9            HA      ASN   9 -12.842  16.766  -8.665
   60   1HB   ASN   9           2HB      ASN   9 -11.736  15.438  -7.144
   61   2HB   ASN   9           1HB      ASN   9 -13.013  14.375  -7.057
   62   1HD2  ASN   9          2HD2      ASN   9 -11.146  11.599  -8.554
   63   2HD2  ASN   9          1HD2      ASN   9 -12.319  12.122  -7.402
   64    H    LEU  10             H      LEU  10 -14.101  13.753  -9.312
   65    HA   LEU  10            HA      LEU  10 -13.250  13.025 -11.800
   66   1HB   LEU  10           2HB      LEU  10 -15.880  12.607 -10.498
   67   2HB   LEU  10           1HB      LEU  10 -15.354  11.726 -11.901
   68    HG   LEU  10            HG      LEU  10 -14.711  10.262 -10.385
   69   1HD1  LEU  10          1HD1      LEU  10 -12.387  12.193 -10.252
   70   2HD1  LEU  10          3HD1      LEU  10 -12.339  10.609  -9.520
   71   3HD1  LEU  10          2HD1      LEU  10 -12.543  10.759 -11.245
   72   1HD2  LEU  10          1HD2      LEU  10 -14.836  12.517  -8.449
   73   2HD2  LEU  10          3HD2      LEU  10 -15.630  10.981  -8.360
   74   3HD2  LEU  10          2HD2      LEU  10 -13.926  11.151  -7.973
   75    H    MET  11             H      MET  11 -15.938  14.775 -10.770
   76    HA   MET  11            HA      MET  11 -16.927  14.978 -13.486
   77   1HB   MET  11           2HB      MET  11 -17.716  16.407 -10.917
   78   2HB   MET  11           1HB      MET  11 -18.720  16.206 -12.361
   79   1HG   MET  11           2HG      MET  11 -17.548  13.620 -10.980
   80   2HG   MET  11           1HG      MET  11 -19.038  14.414 -10.350
   81   1HE   MET  11           3HE      MET  11 -17.874  11.724 -12.067
   82   2HE   MET  11           2HE      MET  11 -18.634  11.523 -13.642
   83   3HE   MET  11           1HE      MET  11 -17.338  12.698 -13.443
   84    H    ALA  12             H      ALA  12 -14.963  16.942 -11.374
   85    HA   ALA  12            HA      ALA  12 -14.743  19.239 -13.122
   86   1HB   ALA  12           2HB      ALA  12 -13.773  18.546 -10.386
   87   2HB   ALA  12           1HB      ALA  12 -12.952  19.833 -11.269
   88   3HB   ALA  12           3HB      ALA  12 -14.679  19.963 -10.924
   89    H    ASP  13             H      ASP  13 -13.124  16.218 -13.146
   90    HA   ASP  13            HA      ASP  13 -10.474  17.367 -13.912
   91   1HB   ASP  13           2HB      ASP  13  -9.899  14.742 -13.991
   92   2HB   ASP  13           1HB      ASP  13  -9.882  15.669 -12.508
   93    H    GLY  14             H      GLY  14 -13.139  16.462 -15.721
   94   1HA   GLY  14           2HA      GLY  14 -13.345  15.548 -17.975
   95   2HA   GLY  14           1HA      GLY  14 -12.249  16.889 -18.272
   96    H    THR  15             H      THR  15 -11.371  13.989 -16.505
   97    HA   THR  15            HA      THR  15  -9.735  12.835 -18.641
   98    HB   THR  15            HB      THR  15  -8.725  13.778 -15.982
   99    HG1  THR  15           HG1      THR  15  -7.926  14.221 -18.663
  100   1HG2  THR  15          1HG2      THR  15  -7.591  11.826 -17.975
  101   2HG2  THR  15          3HG2      THR  15  -6.594  12.652 -16.757
  102   3HG2  THR  15          2HG2      THR  15  -7.919  11.590 -16.255
  103    H    CYS  16             H      CYS  16 -11.067  12.647 -15.451
  104    HA   CYS  16            HA      CYS  16 -10.531   9.926 -14.949
  105   1HB   CYS  16           2HB      CYS  16 -11.670  10.439 -12.939
  106   2HB   CYS  16           1HB      CYS  16 -11.368  12.037 -13.479
  107    HG   CYS  16            HG      CYS  16 -13.820  12.034 -14.559
  108    H    GLN  17             H      GLN  17 -12.816   8.741 -14.374
  109    HA   GLN  17            HA      GLN  17 -14.864   8.984 -16.356
  110   1HB   GLN  17           2HB      GLN  17 -13.037   7.323 -17.204
  111   2HB   GLN  17           1HB      GLN  17 -13.829   6.214 -16.088
  112   1HG   GLN  17           2HG      GLN  17 -15.262   7.823 -18.235
  113   2HG   GLN  17           1HG      GLN  17 -14.838   6.127 -18.391
  114   1HE2  GLN  17          2HE2      GLN  17 -18.344   6.811 -16.857
  115   2HE2  GLN  17          1HE2      GLN  17 -17.538   7.699 -18.057
  116    H    ASP  18             H      ASP  18 -13.405   7.135 -13.688
  117    HA   ASP  18            HA      ASP  18 -15.994   7.215 -12.288
  118   1HB   ASP  18           2HB      ASP  18 -15.288   4.905 -13.307
  119   2HB   ASP  18           1HB      ASP  18 -14.316   4.815 -11.860
  120    H    ALA  19             H      ALA  19 -15.292   6.278  -9.842
  121    HA   ALA  19            HA      ALA  19 -12.744   7.435  -8.863
  122   1HB   ALA  19           1HB      ALA  19 -15.198   8.999  -9.135
  123   2HB   ALA  19           3HB      ALA  19 -14.506   8.979  -7.492
  124   3HB   ALA  19           2HB      ALA  19 -13.512   9.408  -8.850
  125    H    ALA  20             H      ALA  20 -12.363   6.349  -6.855
  126    HA   ALA  20            HA      ALA  20 -14.883   5.689  -5.345
  127   1HB   ALA  20           1HB      ALA  20 -12.916   3.656  -6.231
  128   2HB   ALA  20           3HB      ALA  20 -13.892   3.414  -4.768
  129   3HB   ALA  20           2HB      ALA  20 -14.662   3.684  -6.324
  130    H    ILE  21             H      ILE  21 -14.725   6.671  -3.558
  131    HA   ILE  21            HA      ILE  21 -12.211   6.569  -1.976
  132    HB   ILE  21            HB      ILE  21 -14.905   7.824  -1.286
  133   1HG1  ILE  21          2HG1      ILE  21 -12.394   8.914  -2.598
  134   2HG1  ILE  21          1HG1      ILE  21 -14.046   8.979  -3.205
  135   1HG2  ILE  21          1HG2      ILE  21 -12.131   8.012  -0.021
  136   2HG2  ILE  21          3HG2      ILE  21 -13.485   9.050   0.436
  137   3HG2  ILE  21          2HG2      ILE  21 -13.570   7.308   0.709
  138   1HD1  ILE  21          2HD1      ILE  21 -14.257  10.253  -0.778
  139   2HD1  ILE  21          1HD1      ILE  21 -12.660  10.750  -1.340
  140   3HD1  ILE  21          3HD1      ILE  21 -14.080  11.056  -2.335
  141    H    VAL  22             H      VAL  22 -12.105   4.767  -0.531
  142    HA   VAL  22            HA      VAL  22 -14.682   3.336  -0.038
  143    HB   VAL  22            HB      VAL  22 -12.028   2.027  -0.722
  144   1HG1  VAL  22          2HG1      VAL  22 -13.940   0.843   0.646
  145   2HG1  VAL  22          1HG1      VAL  22 -14.726   0.731  -0.927
  146   3HG1  VAL  22          3HG1      VAL  22 -13.145  -0.015  -0.675
  147   1HG2  VAL  22          2HG2      VAL  22 -14.466   2.533  -2.476
  148   2HG2  VAL  22          1HG2      VAL  22 -12.882   3.294  -2.666
  149   3HG2  VAL  22          3HG2      VAL  22 -13.070   1.555  -2.937
  150    H    GLY  23             H      GLY  23 -14.989   3.311   2.237
  151   1HA   GLY  23           2HA      GLY  23 -12.830   3.424   4.183
  152   2HA   GLY  23           1HA      GLY  23 -14.497   2.951   4.543
  153    OH   TYR  24            OH      TYR  24  -5.392   1.403   5.009
  154    H    TYR  24             H      TYR  24 -11.428   1.788   3.443
  155    HA   TYR  24            HA      TYR  24 -12.172  -0.977   3.114
  156   1HB   TYR  24           2HB      TYR  24 -10.056  -1.221   2.080
  157   2HB   TYR  24           1HB      TYR  24 -10.497   0.430   1.722
  158    HD1  TYR  24           HD1      TYR  24  -9.883   1.681   4.489
  159    HD2  TYR  24           HD2      TYR  24  -7.757  -1.094   2.091
  160    HE1  TYR  24           HE1      TYR  24  -7.777   2.372   5.559
  161    HE2  TYR  24           HE2      TYR  24  -5.647  -0.420   3.120
  162    HH   TYR  24            HH      TYR  24  -5.016   0.631   5.433
  163    H    LYS  25             H      LYS  25 -12.377   0.021   5.923
  164    HA   LYS  25            HA      LYS  25 -10.158  -0.888   7.451
  165   1HB   LYS  25           2HB      LYS  25 -12.990  -0.343   8.126
  166   2HB   LYS  25           1HB      LYS  25 -11.860  -0.895   9.328
  167   1HG   LYS  25           2HG      LYS  25 -11.757   1.457   9.501
  168   2HG   LYS  25           1HG      LYS  25 -10.348   1.034   8.539
  169   1HD   LYS  25           2HD      LYS  25 -11.263   1.817   6.594
  170   2HD   LYS  25           1HD      LYS  25 -12.920   1.568   7.142
  171   1HE   LYS  25           2HE      LYS  25 -11.070   3.640   8.339
  172   2HE   LYS  25           1HE      LYS  25 -12.212   3.993   7.041
  173   1HZ   LYS  25           2HZ      LYS  25 -13.982   3.066   8.520
  174   2HZ   LYS  25           1HZ      LYS  25 -12.845   3.033   9.778
  175   3HZ   LYS  25           3HZ      LYS  25 -13.283   4.504   9.082
  176    H    ASP  26             H      ASP  26 -11.573  -2.672   9.265
  177    HA   ASP  26            HA      ASP  26 -10.940  -5.241   8.386
  178   1HB   ASP  26           2HB      ASP  26 -13.034  -5.968   9.795
  179   2HB   ASP  26           1HB      ASP  26 -11.615  -5.333  10.594
  180    H    SER  27             H      SER  27 -14.196  -3.872   8.210
  181    HA   SER  27            HA      SER  27 -14.835  -5.603   5.914
  182   1HB   SER  27           2HB      SER  27 -17.168  -4.729   6.482
  183   2HB   SER  27           1HB      SER  27 -16.490  -5.886   7.592
  184    HG   SER  27            HG      SER  27 -17.379  -4.061   8.663
  185    HA   PRO  28            HA      PRO  28 -14.121  -1.719   3.911
  186   1HB   PRO  28           2HB      PRO  28 -14.205  -2.630   1.336
  187   2HB   PRO  28           1HB      PRO  28 -12.788  -2.754   2.393
  188   1HG   PRO  28           2HG      PRO  28 -14.618  -4.884   1.521
  189   2HG   PRO  28           1HG      PRO  28 -13.014  -4.997   2.208
  190   1HD   PRO  28           2HD      PRO  28 -15.494  -5.443   3.525
  191   2HD   PRO  28           1HD      PRO  28 -13.855  -5.524   4.214
  192    H    SER  29             H      SER  29 -15.215  -0.298   2.361
  193    HA   SER  29            HA      SER  29 -17.809  -0.948   1.368
  194   1HB   SER  29           2HB      SER  29 -19.049   0.672   2.795
  195   2HB   SER  29           1HB      SER  29 -18.444  -0.705   3.708
  196    HG   SER  29            HG      SER  29 -17.037   0.554   4.690
  197    H    VAL  30             H      VAL  30 -18.654   0.774   0.100
  198    HA   VAL  30            HA      VAL  30 -16.575   2.546  -0.893
  199    HB   VAL  30            HB      VAL  30 -19.376   1.835  -1.755
  200   1HG1  VAL  30          2HG1      VAL  30 -18.807   4.227  -2.330
  201   2HG1  VAL  30          1HG1      VAL  30 -17.411   3.615  -3.219
  202   3HG1  VAL  30          3HG1      VAL  30 -19.039   3.188  -3.735
  203   1HG2  VAL  30          1HG2      VAL  30 -16.604   0.959  -2.367
  204   2HG2  VAL  30          3HG2      VAL  30 -18.117   0.061  -2.473
  205   3HG2  VAL  30          2HG2      VAL  30 -17.651   1.156  -3.757
  206    CH2  TRP  31           CH2      TRP  31 -13.844   5.871   6.842
  207    H    TRP  31             H      TRP  31 -16.297   4.236   0.462
  208    HA   TRP  31            HA      TRP  31 -18.362   5.538   1.940
  209   1HB   TRP  31           2HB      TRP  31 -15.458   6.020   1.401
  210   2HB   TRP  31           1HB      TRP  31 -16.408   7.321   2.116
  211    HD1  TRP  31           HD1      TRP  31 -17.862   4.128   3.216
  212    HE1  TRP  31           HE1      TRP  31 -17.127   3.542   5.561
  213    HE3  TRP  31           HE3      TRP  31 -13.939   7.377   3.799
  214    HZ2  TRP  31           HZ2      TRP  31 -15.170   4.312   7.496
  215    HZ3  TRP  31           HZ3      TRP  31 -12.691   7.418   5.929
  216    HH2  TRP  31           HH2      TRP  31 -13.284   5.891   7.758
  217    H    ALA  32             H      ALA  32 -17.071   5.930  -1.266
  218    HA   ALA  32            HA      ALA  32 -19.228   7.551  -2.147
  219   1HB   ALA  32           2HB      ALA  32 -16.695   9.136  -1.558
  220   2HB   ALA  32           1HB      ALA  32 -18.089   9.761  -2.478
  221   3HB   ALA  32           3HB      ALA  32 -18.262   9.335  -0.761
  222    H    ALA  33             H      ALA  33 -19.023   6.001  -3.851
  223    HA   ALA  33            HA      ALA  33 -16.826   6.603  -5.754
  224   1HB   ALA  33           1HB      ALA  33 -18.325   3.981  -5.447
  225   2HB   ALA  33           3HB      ALA  33 -17.081   4.314  -6.651
  226   3HB   ALA  33           2HB      ALA  33 -16.657   4.273  -4.941
  227    H    VAL  34             H      VAL  34 -17.478   7.262  -7.746
  228    HA   VAL  34            HA      VAL  34 -20.060   8.212  -8.324
  229    HB   VAL  34            HB      VAL  34 -18.072   7.133 -10.354
  230   1HG1  VAL  34          1HG1      VAL  34 -20.561   8.790 -10.518
  231   2HG1  VAL  34          3HG1      VAL  34 -19.242   9.136 -11.645
  232   3HG1  VAL  34          2HG1      VAL  34 -19.992   7.522 -11.610
  233   1HG2  VAL  34          3HG2      VAL  34 -17.175   8.875  -8.742
  234   2HG2  VAL  34          2HG2      VAL  34 -17.164   9.378 -10.427
  235   3HG2  VAL  34          1HG2      VAL  34 -18.417   9.973  -9.338
  236    HA   PRO  35            HA      PRO  35 -22.047   4.138  -8.544
  237   1HB   PRO  35           2HB      PRO  35 -24.643   5.052  -8.693
  238   2HB   PRO  35           1HB      PRO  35 -23.724   4.912  -7.180
  239   1HG   PRO  35           2HG      PRO  35 -24.396   7.372  -8.750
  240   2HG   PRO  35           1HG      PRO  35 -24.102   7.197  -7.011
  241   1HD   PRO  35           2HD      PRO  35 -22.252   8.207  -8.884
  242   2HD   PRO  35           1HD      PRO  35 -21.863   7.657  -7.240
  243    H    GLY  36             H      GLY  36 -23.107   2.848 -10.110
  244   1HA   GLY  36           2HA      GLY  36 -24.291   2.493 -12.194
  245   2HA   GLY  36           1HA      GLY  36 -23.826   4.111 -12.704
  246    H    LYS  37             H      LYS  37 -20.956   3.357 -11.631
  247    HA   LYS  37            HA      LYS  37 -20.060   2.306 -14.237
  248   1HB   LYS  37           2HB      LYS  37 -18.742   3.654 -11.913
  249   2HB   LYS  37           1HB      LYS  37 -17.758   2.783 -13.093
  250   1HG   LYS  37           2HG      LYS  37 -17.964   5.116 -13.791
  251   2HG   LYS  37           1HG      LYS  37 -18.850   4.096 -14.910
  252   1HD   LYS  37           2HD      LYS  37 -20.924   4.807 -14.152
  253   2HD   LYS  37           1HD      LYS  37 -20.306   5.241 -12.557
  254   1HE   LYS  37           2HE      LYS  37 -19.230   7.212 -13.422
  255   2HE   LYS  37           1HE      LYS  37 -19.542   6.720 -15.085
  256   1HZ   LYS  37           2HZ      LYS  37 -21.918   6.895 -14.648
  257   2HZ   LYS  37           1HZ      LYS  37 -21.600   7.413 -13.062
  258   3HZ   LYS  37           3HZ      LYS  37 -21.132   8.376 -14.376
  259    H    THR  38             H      THR  38 -18.465   1.569 -11.110
  260    HA   THR  38            HA      THR  38 -19.063  -1.259 -11.083
  261    HB   THR  38            HB      THR  38 -16.854  -0.282 -12.770
  262    HG1  THR  38           HG1      THR  38 -17.630  -1.718 -14.088
  263   1HG2  THR  38          2HG2      THR  38 -16.461  -2.676 -10.972
  264   2HG2  THR  38          1HG2      THR  38 -15.642  -2.562 -12.524
  265   3HG2  THR  38          3HG2      THR  38 -15.327  -1.345 -11.275
  266    H    PHE  39             H      PHE  39 -16.733   1.230 -10.289
  267    HA   PHE  39            HA      PHE  39 -15.227  -0.006  -8.274
  268   1HB   PHE  39           2HB      PHE  39 -16.061   2.824  -8.760
  269   2HB   PHE  39           1HB      PHE  39 -15.036   2.361  -7.430
  270    HD1  PHE  39           HD2      PHE  39 -14.821   0.559 -10.655
  271    HD2  PHE  39           HD1      PHE  39 -13.137   3.665  -8.205
  272    HE1  PHE  39           HE2      PHE  39 -12.845   0.603 -12.091
  273    HE2  PHE  39           HE1      PHE  39 -11.137   3.725  -9.666
  274    HZ   PHE  39            HZ      PHE  39 -11.021   2.148 -11.609
  275    H    VAL  40             H      VAL  40 -18.209   1.825  -7.947
  276    HA   VAL  40            HA      VAL  40 -18.399   2.016  -5.187
  277    HB   VAL  40            HB      VAL  40 -19.959   3.313  -6.414
  278   1HG1  VAL  40          3HG1      VAL  40 -20.613   0.706  -7.764
  279   2HG1  VAL  40          2HG1      VAL  40 -21.706   2.090  -7.856
  280   3HG1  VAL  40          1HG1      VAL  40 -20.059   2.220  -8.486
  281   1HG2  VAL  40          3HG2      VAL  40 -20.829   1.688  -4.379
  282   2HG2  VAL  40          2HG2      VAL  40 -21.807   2.964  -5.112
  283   3HG2  VAL  40          1HG2      VAL  40 -21.987   1.294  -5.651
  284    H    ASN  41             H      ASN  41 -18.839  -0.758  -7.233
  285    HA   ASN  41            HA      ASN  41 -20.161  -2.323  -5.149
  286   1HB   ASN  41           2HB      ASN  41 -19.449  -2.716  -8.008
  287   2HB   ASN  41           1HB      ASN  41 -19.649  -4.117  -6.983
  288   1HD2  ASN  41          2HD2      ASN  41 -22.933  -2.284  -8.307
  289   2HD2  ASN  41          1HD2      ASN  41 -21.383  -2.009  -8.942
  290    H    ILE  42             H      ILE  42 -17.365  -1.173  -4.774
  291    HA   ILE  42            HA      ILE  42 -15.502  -3.354  -5.008
  292    HB   ILE  42            HB      ILE  42 -15.486  -0.570  -3.869
  293   1HG1  ILE  42          2HG1      ILE  42 -13.343  -1.993  -5.445
  294   2HG1  ILE  42          1HG1      ILE  42 -14.808  -1.397  -6.230
  295   1HG2  ILE  42          2HG2      ILE  42 -13.639  -2.763  -2.931
  296   2HG2  ILE  42          1HG2      ILE  42 -13.044  -1.113  -3.081
  297   3HG2  ILE  42          3HG2      ILE  42 -14.387  -1.471  -2.002
  298   1HD1  ILE  42          1HD1      ILE  42 -14.333   0.869  -5.233
  299   2HD1  ILE  42          3HD1      ILE  42 -12.785   0.237  -4.668
  300   3HD1  ILE  42          2HD1      ILE  42 -13.118   0.336  -6.400
  301    H    THR  43             H      THR  43 -15.429  -5.036  -3.726
  302    HA   THR  43            HA      THR  43 -16.589  -5.183  -0.987
  303    HB   THR  43            HB      THR  43 -16.261  -7.727  -1.618
  304    HG1  THR  43           HG1      THR  43 -14.922  -7.241  -3.416
  305   1HG2  THR  43          1HG2      THR  43 -18.242  -5.824  -2.742
  306   2HG2  THR  43          3HG2      THR  43 -18.303  -7.512  -3.249
  307   3HG2  THR  43          2HG2      THR  43 -18.485  -7.094  -1.545
  308    HA   PRO  44            HA      PRO  44 -12.473  -5.977   0.680
  309   1HB   PRO  44           2HB      PRO  44 -12.584  -8.340   1.968
  310   2HB   PRO  44           1HB      PRO  44 -13.186  -6.857   2.647
  311   1HG   PRO  44           2HG      PRO  44 -14.712  -9.138   1.479
  312   2HG   PRO  44           1HG      PRO  44 -15.214  -7.980   2.721
  313   1HD   PRO  44           2HD      PRO  44 -16.033  -7.878   0.085
  314   2HD   PRO  44           1HD      PRO  44 -16.070  -6.498   1.172
  315    H    ALA  45             H      ALA  45 -13.593  -7.883  -1.719
  316    HA   ALA  45            HA      ALA  45 -11.350  -9.711  -1.995
  317   1HB   ALA  45           1HB      ALA  45 -13.956  -9.704  -2.887
  318   2HB   ALA  45           3HB      ALA  45 -13.052  -9.253  -4.334
  319   3HB   ALA  45           2HB      ALA  45 -12.688 -10.766  -3.505
  320    H    GLU  46             H      GLU  46 -12.765  -7.265  -4.012
  321    HA   GLU  46            HA      GLU  46 -10.457  -6.765  -5.638
  322   1HB   GLU  46           2HB      GLU  46 -11.718  -4.415  -5.945
  323   2HB   GLU  46           1HB      GLU  46 -12.286  -5.863  -6.745
  324   1HG   GLU  46           2HG      GLU  46 -13.324  -5.415  -4.020
  325   2HG   GLU  46           1HG      GLU  46 -13.801  -4.222  -5.213
  326    H    VAL  47             H      VAL  47 -11.550  -5.463  -2.598
  327    HA   VAL  47            HA      VAL  47  -9.430  -3.526  -2.428
  328    HB   VAL  47            HB      VAL  47 -11.866  -4.059  -0.956
  329   1HG1  VAL  47          2HG1      VAL  47 -10.129  -4.420   0.809
  330   2HG1  VAL  47          1HG1      VAL  47  -9.587  -2.774   0.456
  331   3HG1  VAL  47          3HG1      VAL  47 -11.208  -3.049   1.080
  332   1HG2  VAL  47          3HG2      VAL  47 -11.076  -2.058  -2.460
  333   2HG2  VAL  47          2HG2      VAL  47 -12.050  -1.726  -1.028
  334   3HG2  VAL  47          1HG2      VAL  47 -10.271  -1.511  -0.960
  335    H    GLY  48             H      GLY  48  -9.920  -6.810  -1.602
  336   1HA   GLY  48           2HA      GLY  48  -8.003  -7.128   0.475
  337   2HA   GLY  48           1HA      GLY  48  -8.521  -8.394  -0.630
  338    H    VAL  49             H      VAL  49  -7.707  -6.857  -2.985
  339    HA   VAL  49            HA      VAL  49  -4.801  -7.398  -2.851
  340    HB   VAL  49            HB      VAL  49  -6.025  -8.568  -4.651
  341   1HG1  VAL  49          3HG1      VAL  49  -7.170  -5.951  -5.030
  342   2HG1  VAL  49          2HG1      VAL  49  -6.412  -6.473  -6.523
  343   3HG1  VAL  49          1HG1      VAL  49  -7.646  -7.474  -5.764
  344   1HG2  VAL  49          3HG2      VAL  49  -3.748  -6.696  -5.093
  345   2HG2  VAL  49          2HG2      VAL  49  -3.878  -8.421  -5.454
  346   3HG2  VAL  49          1HG2      VAL  49  -4.557  -7.240  -6.568
  347    H    LEU  50             H      LEU  50  -7.052  -4.825  -3.437
  348    HA   LEU  50            HA      LEU  50  -5.228  -2.821  -4.382
  349   1HB   LEU  50           2HB      LEU  50  -7.913  -2.939  -3.236
  350   2HB   LEU  50           1HB      LEU  50  -7.129  -1.428  -3.159
  351    HG   LEU  50            HG      LEU  50  -7.363  -2.892  -5.752
  352   1HD1  LEU  50          1HD1      LEU  50  -9.415  -1.072  -4.381
  353   2HD1  LEU  50          3HD1      LEU  50  -9.491  -1.569  -6.085
  354   3HD1  LEU  50          2HD1      LEU  50  -9.643  -2.779  -4.813
  355   1HD2  LEU  50          1HD2      LEU  50  -5.932  -0.768  -5.321
  356   2HD2  LEU  50          3HD2      LEU  50  -7.063  -0.707  -6.675
  357   3HD2  LEU  50          2HD2      LEU  50  -7.472   0.078  -5.143
  358    H    VAL  51             H      VAL  51  -5.827  -4.277  -1.359
  359    HA   VAL  51            HA      VAL  51  -4.137  -2.288   0.053
  360    HB   VAL  51            HB      VAL  51  -5.886  -1.664   1.541
  361   1HG1  VAL  51          2HG1      VAL  51  -7.356  -2.445  -0.992
  362   2HG1  VAL  51          1HG1      VAL  51  -8.067  -1.477   0.277
  363   3HG1  VAL  51          3HG1      VAL  51  -6.668  -0.870  -0.601
  364   1HG2  VAL  51          1HG2      VAL  51  -6.812  -4.473   1.202
  365   2HG2  VAL  51          3HG2      VAL  51  -6.793  -3.464   2.651
  366   3HG2  VAL  51          2HG2      VAL  51  -8.094  -3.282   1.467
  367    H    GLY  52             H      GLY  52  -4.797  -5.585  -0.483
  368   1HA   GLY  52           2HA      GLY  52  -4.435  -6.814   2.011
  369   2HA   GLY  52           1HA      GLY  52  -3.939  -7.522   0.476
  370    H    LYS  53             H      LYS  53  -2.284  -8.175   2.256
  371    HA   LYS  53            HA      LYS  53  -0.165  -6.255   2.651
  372   1HB   LYS  53           2HB      LYS  53   0.886  -7.945   4.054
  373   2HB   LYS  53           1HB      LYS  53  -0.798  -7.748   4.507
  374   1HG   LYS  53           2HG      LYS  53  -0.758 -10.048   4.386
  375   2HG   LYS  53           1HG      LYS  53  -1.087  -9.713   2.687
  376   1HD   LYS  53           2HD      LYS  53   0.767 -11.003   2.327
  377   2HD   LYS  53           1HD      LYS  53   1.638  -9.527   2.725
  378   1HE   LYS  53           2HE      LYS  53   2.219 -10.257   4.832
  379   2HE   LYS  53           1HE      LYS  53   0.783 -11.267   4.993
  380   1HZ   LYS  53           1HZ      LYS  53   2.723 -11.991   2.920
  381   2HZ   LYS  53           3HZ      LYS  53   3.155 -12.292   4.532
  382   3HZ   LYS  53           2HZ      LYS  53   1.747 -12.989   3.891
  383    H    ASP  54             H      ASP  54  -0.978  -8.361   0.223
  384    HA   ASP  54            HA      ASP  54   1.126  -9.821  -0.627
  385   1HB   ASP  54           2HB      ASP  54  -1.149  -9.202  -1.718
  386   2HB   ASP  54           1HB      ASP  54  -0.167  -8.068  -2.622
  387    NH1  ARG  55           NH1      ARG  55   4.724  -5.111   3.571
  388    NH2  ARG  55           NH2      ARG  55   6.704  -5.788   4.427
  389    H    ARG  55             H      ARG  55   3.169  -9.321  -0.681
  390    HA   ARG  55            HA      ARG  55   4.119  -6.633  -0.948
  391   1HB   ARG  55           2HB      ARG  55   5.243  -9.210  -0.012
  392   2HB   ARG  55           1HB      ARG  55   6.371  -7.966  -0.555
  393   1HG   ARG  55           2HG      ARG  55   4.185  -7.465   1.482
  394   2HG   ARG  55           1HG      ARG  55   5.841  -7.885   1.915
  395   1HD   ARG  55           2HD      ARG  55   6.204  -5.825   0.105
  396   2HD   ARG  55           1HD      ARG  55   4.754  -5.325   0.969
  397    HE   ARG  55            HE      ARG  55   7.423  -5.300   2.047
  398   1HH1  ARG  55          1HH1      ARG  55   4.341  -5.076   4.496
  399   2HH1  ARG  55          2HH1      ARG  55   4.157  -4.868   2.788
  400   1HH2  ARG  55          1HH2      ARG  55   7.656  -6.065   4.297
  401   2HH2  ARG  55          2HH2      ARG  55   6.319  -5.745   5.350
  402    H    SER  56             H      SER  56   3.329  -8.672  -3.413
  403    HA   SER  56            HA      SER  56   5.293  -7.437  -5.163
  404   1HB   SER  56           2HB      SER  56   6.612  -9.239  -4.037
  405   2HB   SER  56           1HB      SER  56   5.603 -10.397  -4.897
  406    HG   SER  56            HG      SER  56   6.965 -10.097  -6.467
  407    H    SER  57             H      SER  57   3.404 -10.387  -5.232
  408    HA   SER  57            HA      SER  57   2.976 -10.761  -7.882
  409   1HB   SER  57           2HB      SER  57   0.660 -11.617  -7.368
  410   2HB   SER  57           1HB      SER  57   1.990 -12.343  -6.481
  411    HG   SER  57            HG      SER  57   0.011 -11.552  -5.334
  412    H    PHE  58             H      PHE  58   0.059  -9.367  -6.581
  413    HA   PHE  58            HA      PHE  58  -1.029  -8.352  -8.828
  414   1HB   PHE  58           2HB      PHE  58  -2.447  -6.932  -7.617
  415   2HB   PHE  58           1HB      PHE  58  -2.062  -8.249  -6.550
  416    HD1  PHE  58           HD1      PHE  58  -0.976  -4.780  -7.401
  417    HD2  PHE  58           HD2      PHE  58  -1.300  -7.820  -4.384
  418    HE1  PHE  58           HE1      PHE  58  -0.301  -3.156  -5.673
  419    HE2  PHE  58           HE2      PHE  58  -0.619  -6.173  -2.658
  420    HZ   PHE  58            HZ      PHE  58  -0.134  -3.845  -3.310
  421    OH   TYR  59            OH      TYR  59   3.191  -4.185  -2.587
  422    H    TYR  59             H      TYR  59   1.845  -6.792  -7.510
  423    HA   TYR  59            HA      TYR  59   1.435  -4.298  -8.756
  424   1HB   TYR  59           2HB      TYR  59   4.134  -5.522  -8.461
  425   2HB   TYR  59           1HB      TYR  59   3.752  -3.816  -8.607
  426    HD1  TYR  59           HD1      TYR  59   1.649  -3.316  -6.791
  427    HD2  TYR  59           HD2      TYR  59   4.983  -5.942  -6.381
  428    HE1  TYR  59           HE1      TYR  59   1.567  -3.026  -4.321
  429    HE2  TYR  59           HE2      TYR  59   4.905  -5.679  -3.923
  430    HH   TYR  59            HH      TYR  59   4.080  -3.990  -2.284
  431    H    VAL  60             H      VAL  60   1.852  -7.156 -10.325
  432    HA   VAL  60            HA      VAL  60   2.658  -5.783 -12.784
  433    HB   VAL  60            HB      VAL  60   3.455  -8.136 -13.396
  434   1HG1  VAL  60          2HG1      VAL  60   4.709  -6.205 -11.508
  435   2HG1  VAL  60          1HG1      VAL  60   5.581  -7.682 -11.932
  436   3HG1  VAL  60          3HG1      VAL  60   5.126  -6.536 -13.192
  437   1HG2  VAL  60          3HG2      VAL  60   2.395  -9.249 -11.414
  438   2HG2  VAL  60          2HG2      VAL  60   4.117  -9.590 -11.580
  439   3HG2  VAL  60          1HG2      VAL  60   3.563  -8.402 -10.396
  440    H    ASN  61             H      ASN  61   0.508  -8.237 -11.366
  441    HA   ASN  61            HA      ASN  61  -0.699  -8.793 -13.937
  442   1HB   ASN  61           2HB      ASN  61  -2.184 -10.274 -12.692
  443   2HB   ASN  61           1HB      ASN  61  -0.528 -10.616 -12.327
  444   1HD2  ASN  61          2HD2      ASN  61  -1.077 -10.293  -8.925
  445   2HD2  ASN  61          1HD2      ASN  61  -0.191 -10.986 -10.194
  446    H    GLY  62             H      GLY  62  -1.479  -7.061 -10.990
  447   1HA   GLY  62           2HA      GLY  62  -2.551  -4.873 -11.296
  448   2HA   GLY  62           1HA      GLY  62  -3.606  -5.620 -12.494
  449    H    LEU  63             H      LEU  63  -4.055  -4.147  -9.917
  450    HA   LEU  63            HA      LEU  63  -5.130  -5.922  -7.955
  451   1HB   LEU  63           2HB      LEU  63  -5.958  -3.041  -8.476
  452   2HB   LEU  63           1HB      LEU  63  -6.125  -3.921  -6.952
  453    HG   LEU  63            HG      LEU  63  -3.418  -3.494  -8.198
  454   1HD1  LEU  63          3HD1      LEU  63  -5.209  -1.432  -7.317
  455   2HD1  LEU  63          2HD1      LEU  63  -3.955  -1.614  -6.083
  456   3HD1  LEU  63          1HD1      LEU  63  -3.509  -1.279  -7.758
  457   1HD2  LEU  63          2HD2      LEU  63  -4.602  -4.204  -5.544
  458   2HD2  LEU  63          1HD2      LEU  63  -3.352  -5.038  -6.438
  459   3HD2  LEU  63          3HD2      LEU  63  -2.986  -3.520  -5.623
  460    H    THR  64             H      THR  64  -7.737  -4.663  -7.697
  461    HA   THR  64            HA      THR  64  -9.229  -5.186 -10.099
  462    HB   THR  64            HB      THR  64 -10.636  -6.924  -8.894
  463    HG1  THR  64           HG1      THR  64  -9.698  -7.935  -7.165
  464   1HG2  THR  64          1HG2      THR  64  -8.923  -7.358 -10.689
  465   2HG2  THR  64          3HG2      THR  64  -7.778  -7.754  -9.399
  466   3HG2  THR  64          2HG2      THR  64  -9.245  -8.724  -9.618
  467    H    LEU  65             H      LEU  65 -10.836  -3.838  -9.980
  468    HA   LEU  65            HA      LEU  65 -11.884  -3.025  -7.350
  469   1HB   LEU  65           2HB      LEU  65 -12.116  -0.683  -8.533
  470   2HB   LEU  65           1HB      LEU  65 -10.713  -1.132  -7.613
  471    HG   LEU  65            HG      LEU  65  -9.628  -1.891  -9.762
  472   1HD1  LEU  65          2HD1      LEU  65 -12.231  -0.983 -10.778
  473   2HD1  LEU  65          1HD1      LEU  65 -10.847  -0.464 -11.713
  474   3HD1  LEU  65          3HD1      LEU  65 -11.136  -2.172 -11.427
  475   1HD2  LEU  65          2HD2      LEU  65 -10.382   0.927  -9.092
  476   2HD2  LEU  65          1HD2      LEU  65  -8.793   0.156  -9.080
  477   3HD2  LEU  65          3HD2      LEU  65  -9.526   0.638 -10.611
  478    H    GLY  66             H      GLY  66 -13.800  -3.912  -7.393
  479   1HA   GLY  66           2HA      GLY  66 -16.068  -4.156  -7.876
  480   2HA   GLY  66           1HA      GLY  66 -15.876  -2.917  -9.119
  481    H    GLY  67             H      GLY  67 -13.738  -5.695  -9.065
  482   1HA   GLY  67           2HA      GLY  67 -13.814  -7.709 -10.334
  483   2HA   GLY  67           1HA      GLY  67 -15.287  -7.139 -11.117
  484    H    GLN  68             H      GLN  68 -12.893  -4.640 -11.024
  485    HA   GLN  68            HA      GLN  68 -12.204  -5.282 -13.895
  486   1HB   GLN  68           2HB      GLN  68 -13.331  -3.271 -13.981
  487   2HB   GLN  68           1HB      GLN  68 -12.634  -2.765 -12.495
  488   1HG   GLN  68           2HG      GLN  68 -11.742  -1.507 -14.509
  489   2HG   GLN  68           1HG      GLN  68 -10.495  -2.251 -13.511
  490   1HE2  GLN  68          2HE2      GLN  68  -9.251  -3.678 -16.532
  491   2HE2  GLN  68          1HE2      GLN  68  -8.954  -2.607 -15.248
  492    H    LYS  69             H      LYS  69 -10.299  -6.258 -13.968
  493    HA   LYS  69            HA      LYS  69  -8.174  -5.929 -12.070
  494   1HB   LYS  69           2HB      LYS  69  -8.775  -7.684 -14.189
  495   2HB   LYS  69           1HB      LYS  69  -7.258  -6.915 -14.649
  496   1HG   LYS  69           2HG      LYS  69  -6.088  -7.963 -13.003
  497   2HG   LYS  69           1HG      LYS  69  -7.368  -7.732 -11.819
  498   1HD   LYS  69           2HD      LYS  69  -8.425  -9.705 -12.360
  499   2HD   LYS  69           1HD      LYS  69  -7.878  -9.658 -14.036
  500   1HE   LYS  69           2HE      LYS  69  -6.522 -11.354 -13.219
  501   2HE   LYS  69           1HE      LYS  69  -5.482  -9.960 -12.910
  502   1HZ   LYS  69           1HZ      LYS  69  -7.437 -10.846 -10.889
  503   2HZ   LYS  69           3HZ      LYS  69  -5.936 -11.620 -11.020
  504   3HZ   LYS  69           2HZ      LYS  69  -6.005  -9.957 -10.677
  505    H    CYS  70             H      CYS  70  -7.002  -4.041 -11.868
  506    HA   CYS  70            HA      CYS  70  -6.184  -2.642 -14.450
  507   1HB   CYS  70           2HB      CYS  70  -5.842  -0.679 -12.885
  508   2HB   CYS  70           1HB      CYS  70  -7.476  -1.130 -13.236
  509    HG   CYS  70            HG      CYS  70  -7.651  -2.241 -10.862
  510    H    SER  71             H      SER  71  -4.039  -2.438 -14.683
  511    HA   SER  71            HA      SER  71  -2.328  -3.886 -12.789
  512   1HB   SER  71           2HB      SER  71  -0.934  -4.404 -14.490
  513   2HB   SER  71           1HB      SER  71  -2.421  -4.105 -15.347
  514    HG   SER  71            HG      SER  71  -0.080  -2.723 -15.370
  515    H    VAL  72             H      VAL  72  -1.346  -2.894 -11.241
  516    HA   VAL  72            HA      VAL  72  -0.903  -0.180 -10.866
  517    HB   VAL  72            HB      VAL  72   1.150  -2.112  -9.948
  518   1HG1  VAL  72          3HG1      VAL  72   0.380   0.584  -9.369
  519   2HG1  VAL  72          2HG1      VAL  72   0.201  -0.391  -7.914
  520   3HG1  VAL  72          1HG1      VAL  72   1.753  -0.328  -8.743
  521   1HG2  VAL  72          3HG2      VAL  72  -1.693  -1.948  -9.003
  522   2HG2  VAL  72          2HG2      VAL  72  -0.762  -3.389  -9.403
  523   3HG2  VAL  72          1HG2      VAL  72  -0.403  -2.488  -7.932
  524    H    ILE  73             H      ILE  73   0.541   1.184 -11.487
  525    HA   ILE  73            HA      ILE  73   2.841   0.338 -13.010
  526    HB   ILE  73            HB      ILE  73   0.787   2.256 -13.861
  527   1HG1  ILE  73          2HG1      ILE  73   2.210   0.937 -15.980
  528   2HG1  ILE  73          1HG1      ILE  73   1.756  -0.244 -14.757
  529   1HG2  ILE  73          3HG2      ILE  73   3.691   2.596 -14.333
  530   2HG2  ILE  73          2HG2      ILE  73   2.567   3.027 -15.620
  531   3HG2  ILE  73          1HG2      ILE  73   2.465   3.836 -14.055
  532   1HD1  ILE  73          3HD1      ILE  73  -0.520   1.411 -15.172
  533   2HD1  ILE  73          2HD1      ILE  73   0.095   0.988 -16.774
  534   3HD1  ILE  73          1HD1      ILE  73  -0.331  -0.291 -15.625
  535    NH1  ARG  74           NH2      ARG  74  10.145   3.522  -8.603
  536    NH2  ARG  74           NH1      ARG  74   9.287   4.741  -6.905
  537    H    ARG  74             H      ARG  74   3.620   0.580 -10.966
  538    HA   ARG  74            HA      ARG  74   5.311   1.510  -9.615
  539   1HB   ARG  74           2HB      ARG  74   4.891   3.665 -11.397
  540   2HB   ARG  74           1HB      ARG  74   4.595   4.340  -9.797
  541   1HG   ARG  74           2HG      ARG  74   6.987   2.576 -10.169
  542   2HG   ARG  74           1HG      ARG  74   7.056   4.211 -10.823
  543   1HD   ARG  74           2HD      ARG  74   7.180   5.156  -8.761
  544   2HD   ARG  74           1HD      ARG  74   5.980   4.058  -8.081
  545    HE   ARG  74            HE      ARG  74   7.794   2.394  -7.798
  546   1HH1  ARG  74          1HH2      ARG  74  10.024   2.849  -9.332
  547   2HH1  ARG  74          2HH2      ARG  74  11.041   3.932  -8.446
  548   1HH2  ARG  74          2HH1      ARG  74   8.511   5.001  -6.332
  549   2HH2  ARG  74          1HH1      ARG  74  10.183   5.154  -6.749
  550    H    ASP  75             H      ASP  75   4.131   0.511  -8.030
  551    HA   ASP  75            HA      ASP  75   1.835   1.743  -6.855
  552   1HB   ASP  75           2HB      ASP  75   1.911  -0.642  -6.791
  553   2HB   ASP  75           1HB      ASP  75   3.468  -0.603  -6.059
  554    H    SER  76             H      SER  76   1.982   3.554  -5.792
  555    HA   SER  76            HA      SER  76   4.155   3.745  -3.715
  556   1HB   SER  76           2HB      SER  76   3.909   5.545  -5.781
  557   2HB   SER  76           1HB      SER  76   2.944   6.302  -4.540
  558    HG   SER  76            HG      SER  76   5.582   5.313  -4.218
  559    H    LEU  77             H      LEU  77   0.940   3.163  -4.194
  560    HA   LEU  77            HA      LEU  77  -0.819   4.564  -2.613
  561   1HB   LEU  77           2HB      LEU  77  -1.012   2.256  -3.814
  562   2HB   LEU  77           1HB      LEU  77  -0.450   1.564  -2.299
  563    HG   LEU  77            HG      LEU  77  -2.343   2.773  -1.157
  564   1HD1  LEU  77          2HD1      LEU  77  -3.036   3.269  -4.046
  565   2HD1  LEU  77          1HD1      LEU  77  -4.213   3.411  -2.741
  566   3HD1  LEU  77          3HD1      LEU  77  -2.808   4.477  -2.782
  567   1HD2  LEU  77          1HD2      LEU  77  -2.421   0.421  -2.916
  568   2HD2  LEU  77          3HD2      LEU  77  -3.162   0.651  -1.323
  569   3HD2  LEU  77          2HD2      LEU  77  -4.015   1.179  -2.774
  570    H    LEU  78             H      LEU  78   1.893   2.641  -1.418
  571    HA   LEU  78            HA      LEU  78   1.011   3.301   1.257
  572   1HB   LEU  78           2HB      LEU  78   3.043   1.440   0.339
  573   2HB   LEU  78           1HB      LEU  78   2.719   1.705   2.020
  574    HG   LEU  78            HG      LEU  78   0.565   0.943   0.022
  575   1HD1  LEU  78          3HD1      LEU  78   2.220  -0.917   0.158
  576   2HD1  LEU  78          2HD1      LEU  78   1.992  -0.962   1.907
  577   3HD1  LEU  78          1HD1      LEU  78   0.636  -1.363   0.827
  578   1HD2  LEU  78          3HD2      LEU  78   0.727   0.989   3.041
  579   2HD2  LEU  78          2HD2      LEU  78  -0.295   1.984   2.005
  580   3HD2  LEU  78          1HD2      LEU  78  -0.608   0.253   2.148
  581    H    GLN  79             H      GLN  79   1.837   4.848   2.330
  582    HA   GLN  79            HA      GLN  79   3.038   6.998   1.497
  583   1HB   GLN  79           2HB      GLN  79   3.284   7.669   3.850
  584   2HB   GLN  79           1HB      GLN  79   1.731   6.878   3.576
  585   1HG   GLN  79           2HG      GLN  79   3.535   4.790   4.185
  586   2HG   GLN  79           1HG      GLN  79   3.908   6.074   5.330
  587   1HE2  GLN  79          2HE2      GLN  79   1.242   4.821   7.291
  588   2HE2  GLN  79          1HE2      GLN  79   2.911   5.111   7.187
  589    H    ASP  80             H      ASP  80   4.670   6.160   0.297
  590    HA   ASP  80            HA      ASP  80   7.283   5.920   1.716
  591   1HB   ASP  80           2HB      ASP  80   6.613   4.249  -0.172
  592   2HB   ASP  80           1HB      ASP  80   6.809   5.615  -1.270
  593    H    GLY  81             H      GLY  81   5.448   8.300   1.512
  594   1HA   GLY  81           2HA      GLY  81   5.839  10.625   1.290
  595   2HA   GLY  81           1HA      GLY  81   7.259  10.265   0.293
  596    H    GLU  82             H      GLU  82   4.110   8.654  -0.218
  597    HA   GLU  82            HA      GLU  82   3.511  10.280  -2.548
  598   1HB   GLU  82           2HB      GLU  82   4.629   7.593  -2.551
  599   2HB   GLU  82           1HB      GLU  82   3.401   7.961  -3.701
  600   1HG   GLU  82           2HG      GLU  82   5.171   8.602  -4.968
  601   2HG   GLU  82           1HG      GLU  82   4.908  10.123  -4.087
  602    H    PHE  83             H      PHE  83   2.564   7.085  -1.224
  603    HA   PHE  83            HA      PHE  83   0.517   5.956  -1.339
  604   1HB   PHE  83           2HB      PHE  83  -1.470   7.578  -0.636
  605   2HB   PHE  83           1HB      PHE  83  -0.470   6.721   0.448
  606    HD1  PHE  83           HD1      PHE  83   1.383   7.879   1.635
  607    HD2  PHE  83           HD2      PHE  83  -1.405   9.950  -0.904
  608    HE1  PHE  83           HE1      PHE  83   2.111  10.047   2.612
  609    HE2  PHE  83           HE2      PHE  83  -0.679  12.114   0.087
  610    HZ   PHE  83            HZ      PHE  83   1.078  12.164   1.838
  611    H    SER  84             H      SER  84   1.160   6.525  -3.799
  612    HA   SER  84            HA      SER  84  -1.410   7.027  -5.211
  613   1HB   SER  84           2HB      SER  84  -0.169   8.467  -6.901
  614   2HB   SER  84           1HB      SER  84  -0.452   9.233  -5.334
  615    HG   SER  84            HG      SER  84   1.639   9.165  -4.931
  616    H    MET  85             H      MET  85  -1.641   5.520  -6.642
  617    HA   MET  85            HA      MET  85   0.622   3.746  -7.476
  618   1HB   MET  85           2HB      MET  85  -1.137   3.258  -5.619
  619   2HB   MET  85           1HB      MET  85  -2.236   3.116  -6.935
  620   1HG   MET  85           2HG      MET  85  -0.966   1.241  -7.817
  621   2HG   MET  85           1HG      MET  85   0.133   1.416  -6.464
  622   1HE   MET  85           1HE      MET  85  -0.235  -0.868  -6.062
  623   2HE   MET  85           3HE      MET  85  -1.547  -1.544  -5.080
  624   3HE   MET  85           2HE      MET  85  -1.752  -1.386  -6.830
  625    H    ASP  86             H      ASP  86   0.666   3.404  -9.811
  626    HA   ASP  86            HA      ASP  86  -1.678   4.677 -11.257
  627   1HB   ASP  86           2HB      ASP  86   1.088   3.907 -12.030
  628   2HB   ASP  86           1HB      ASP  86  -0.124   4.187 -13.249
  629    H    LEU  87             H      LEU  87  -3.055   2.693 -10.655
  630    HA   LEU  87            HA      LEU  87  -2.302   0.338 -12.233
  631   1HB   LEU  87           2HB      LEU  87  -4.480  -0.687 -11.174
  632   2HB   LEU  87           1HB      LEU  87  -2.971  -0.678 -10.312
  633    HG   LEU  87            HG      LEU  87  -4.805  -0.125  -8.825
  634   1HD1  LEU  87          1HD1      LEU  87  -2.490   1.382  -9.081
  635   2HD1  LEU  87          3HD1      LEU  87  -3.773   2.570  -8.841
  636   3HD1  LEU  87          2HD1      LEU  87  -3.554   1.277  -7.689
  637   1HD2  LEU  87          1HD2      LEU  87  -6.008   1.012 -10.913
  638   2HD2  LEU  87          3HD2      LEU  87  -6.428   1.411  -9.255
  639   3HD2  LEU  87          2HD2      LEU  87  -5.352   2.466 -10.167
  640    NH1  ARG  88           NH2      ARG  88  -0.890   2.565 -21.100
  641    NH2  ARG  88           NH1      ARG  88   0.705   3.004 -19.559
  642    H    ARG  88             H      ARG  88  -2.782   0.315 -14.212
  643    HA   ARG  88            HA      ARG  88  -5.357   1.714 -15.002
  644   1HB   ARG  88           2HB      ARG  88  -4.325   2.704 -16.868
  645   2HB   ARG  88           1HB      ARG  88  -2.965   2.658 -15.780
  646   1HG   ARG  88           2HG      ARG  88  -2.033   0.785 -16.951
  647   2HG   ARG  88           1HG      ARG  88  -3.500   0.491 -17.889
  648   1HD   ARG  88           2HD      ARG  88  -3.090   2.256 -19.291
  649   2HD   ARG  88           1HD      ARG  88  -2.244   3.200 -18.051
  650    HE   ARG  88            HE      ARG  88  -0.696   0.880 -18.696
  651   1HH1  ARG  88          1HH2      ARG  88  -1.754   2.126 -21.350
  652   2HH1  ARG  88          2HH2      ARG  88  -0.388   3.101 -21.777
  653   1HH2  ARG  88          2HH1      ARG  88   1.065   2.898 -18.632
  654   2HH2  ARG  88          1HH1      ARG  88   1.203   3.553 -20.228
  655    H    THR  89             H      THR  89  -6.861   0.596 -16.072
  656    HA   THR  89            HA      THR  89  -6.786  -2.220 -16.502
  657    HB   THR  89            HB      THR  89  -8.851  -1.953 -17.612
  658    HG1  THR  89           HG1      THR  89  -9.021  -0.701 -19.231
  659   1HG2  THR  89          2HG2      THR  89  -8.680  -0.679 -15.329
  660   2HG2  THR  89          1HG2      THR  89  -8.949   0.735 -16.347
  661   3HG2  THR  89          3HG2      THR  89 -10.148  -0.560 -16.300
  662    H    LYS  90             H      LYS  90  -5.076  -3.008 -17.744
  663    HA   LYS  90            HA      LYS  90  -4.103  -1.452 -19.922
  664   1HB   LYS  90           2HB      LYS  90  -2.939  -4.136 -19.417
  665   2HB   LYS  90           1HB      LYS  90  -2.198  -2.611 -19.825
  666   1HG   LYS  90           2HG      LYS  90  -3.390  -2.799 -17.105
  667   2HG   LYS  90           1HG      LYS  90  -1.868  -3.625 -17.430
  668   1HD   LYS  90           2HD      LYS  90  -2.159  -0.851 -18.464
  669   2HD   LYS  90           1HD      LYS  90  -1.892  -1.069 -16.740
  670   1HE   LYS  90           2HE      LYS  90   0.311  -1.080 -17.392
  671   2HE   LYS  90           1HE      LYS  90  -0.030  -2.778 -17.695
  672   1HZ   LYS  90           3HZ      LYS  90  -0.551  -0.769 -19.785
  673   2HZ   LYS  90           2HZ      LYS  90   1.025  -1.352 -19.546
  674   3HZ   LYS  90           1HZ      LYS  90  -0.229  -2.423 -19.950
  675    H    SER  91             H      SER  91  -3.447  -2.617 -21.887
  676    HA   SER  91            HA      SER  91  -5.536  -4.506 -22.863
  677   1HB   SER  91           2HB      SER  91  -6.336  -2.566 -23.864
  678   2HB   SER  91           1HB      SER  91  -4.801  -1.810 -23.867
  679    HG   SER  91            HG      SER  91  -4.285  -2.710 -25.726
  680    H    THR  92             H      THR  92  -4.743  -5.234 -25.239
  681    HA   THR  92            HA      THR  92  -1.785  -5.679 -25.184
  682    HB   THR  92            HB      THR  92  -2.127  -8.056 -25.758
  683    HG1  THR  92           HG1      THR  92  -4.846  -7.338 -25.446
  684   1HG2  THR  92          1HG2      THR  92  -3.530  -7.059 -23.273
  685   2HG2  THR  92          3HG2      THR  92  -3.138  -8.756 -23.553
  686   3HG2  THR  92          2HG2      THR  92  -1.847  -7.563 -23.422
  687    H    GLY  93             H      GLY  93  -1.607  -4.143 -26.903
  688   1HA   GLY  93           2HA      GLY  93  -1.103  -3.991 -29.256
  689   2HA   GLY  93           1HA      GLY  93  -2.279  -5.265 -29.566
  690    H    GLY  94             H      GLY  94  -4.480  -4.720 -29.836
  691   1HA   GLY  94           2HA      GLY  94  -4.975  -1.815 -30.321
  692   2HA   GLY  94           1HA      GLY  94  -5.862  -3.131 -31.082
  693    H    ALA  95             H      ALA  95  -5.779  -4.238 -28.012
  694    HA   ALA  95            HA      ALA  95  -8.514  -3.636 -27.421
  695   1HB   ALA  95           2HB      ALA  95  -6.457  -5.155 -26.175
  696   2HB   ALA  95           1HB      ALA  95  -7.078  -4.049 -24.950
  697   3HB   ALA  95           3HB      ALA  95  -8.176  -5.147 -25.788
  698    HA   PRO  96            HA      PRO  96  -8.393   0.332 -25.596
  699   1HB   PRO  96           2HB      PRO  96 -10.585   0.170 -23.988
  700   2HB   PRO  96           1HB      PRO  96 -10.696   0.122 -25.759
  701   1HG   PRO  96           2HG      PRO  96 -11.036  -2.120 -23.815
  702   2HG   PRO  96           1HG      PRO  96 -11.669  -1.964 -25.453
  703   1HD   PRO  96           2HD      PRO  96  -9.383  -3.454 -24.630
  704   2HD   PRO  96           1HD      PRO  96  -9.980  -3.182 -26.281
  705    H    THR  97             H      THR  97  -7.504   1.469 -23.851
  706    HA   THR  97            HA      THR  97  -7.068  -0.044 -21.278
  707    HB   THR  97            HB      THR  97  -5.128   1.539 -20.900
  708    HG1  THR  97           HG1      THR  97  -5.575   2.090 -23.656
  709   1HG2  THR  97          2HG2      THR  97  -5.175  -0.834 -22.177
  710   2HG2  THR  97          1HG2      THR  97  -4.485   0.178 -23.450
  711   3HG2  THR  97          3HG2      THR  97  -3.693   0.081 -21.875
  712    H    PHE  98             H      PHE  98  -7.181   1.268 -19.386
  713    HA   PHE  98            HA      PHE  98  -8.408   3.929 -19.515
  714   1HB   PHE  98           2HB      PHE  98  -9.616   1.564 -18.001
  715   2HB   PHE  98           1HB      PHE  98 -10.229   3.230 -17.996
  716    HD1  PHE  98           HD1      PHE  98 -10.351   4.201 -20.568
  717    HD2  PHE  98           HD2      PHE  98 -10.839   0.120 -19.386
  718    HE1  PHE  98           HE1      PHE  98 -11.608   3.772 -22.649
  719    HE2  PHE  98           HE2      PHE  98 -12.105  -0.335 -21.476
  720    HZ   PHE  98            HZ      PHE  98 -12.491   1.495 -23.107
  721    H    ASN  99             H      ASN  99  -7.342   5.174 -17.887
  722    HA   ASN  99            HA      ASN  99  -5.665   3.526 -16.052
  723   1HB   ASN  99           2HB      ASN  99  -5.147   6.446 -16.562
  724   2HB   ASN  99           1HB      ASN  99  -4.018   5.212 -16.009
  725   1HD2  ASN  99          2HD2      ASN  99  -3.304   5.831 -19.611
  726   2HD2  ASN  99          1HD2      ASN  99  -3.281   6.770 -18.199
  727    H    VAL 100             H      VAL 100  -5.487   3.803 -13.949
  728    HA   VAL 100            HA      VAL 100  -7.353   5.672 -12.614
  729    HB   VAL 100            HB      VAL 100  -6.698   2.875 -11.616
  730   1HG1  VAL 100          2HG1      VAL 100  -7.588   4.921 -10.200
  731   2HG1  VAL 100          1HG1      VAL 100  -9.134   4.448 -10.904
  732   3HG1  VAL 100          3HG1      VAL 100  -8.214   3.295  -9.943
  733   1HG2  VAL 100          3HG2      VAL 100  -8.119   3.207 -13.887
  734   2HG2  VAL 100          2HG2      VAL 100  -8.551   1.993 -12.688
  735   3HG2  VAL 100          1HG2      VAL 100  -9.393   3.537 -12.722
  736    H    THR 101             H      THR 101  -6.428   6.647 -10.814
  737    HA   THR 101            HA      THR 101  -3.739   5.691  -9.973
  738    HB   THR 101            HB      THR 101  -4.912   8.514  -9.815
  739    HG1  THR 101           HG1      THR 101  -3.959   7.734 -11.833
  740   1HG2  THR 101          2HG2      THR 101  -3.076   7.246  -8.062
  741   2HG2  THR 101          1HG2      THR 101  -2.116   8.295  -9.103
  742   3HG2  THR 101          3HG2      THR 101  -3.448   8.959  -8.166
  743    H    VAL 102             H      VAL 102  -3.828   4.877  -7.991
  744    HA   VAL 102            HA      VAL 102  -6.245   5.412  -6.380
  745    HB   VAL 102            HB      VAL 102  -4.670   2.925  -7.009
  746   1HG1  VAL 102          3HG1      VAL 102  -6.058   3.562  -4.409
  747   2HG1  VAL 102          2HG1      VAL 102  -6.338   1.967  -5.106
  748   3HG1  VAL 102          1HG1      VAL 102  -4.704   2.474  -4.712
  749   1HG2  VAL 102          2HG2      VAL 102  -7.489   3.887  -7.068
  750   2HG2  VAL 102          1HG2      VAL 102  -6.530   3.153  -8.335
  751   3HG2  VAL 102          3HG2      VAL 102  -7.155   2.158  -7.028
  752    H    THR 103             H      THR 103  -5.878   6.493  -4.603
  753    HA   THR 103            HA      THR 103  -3.109   6.589  -3.516
  754    HB   THR 103            HB      THR 103  -3.982   8.685  -2.333
  755    HG1  THR 103           HG1      THR 103  -6.231   8.011  -2.970
  756   1HG2  THR 103          3HG2      THR 103  -3.232   8.254  -5.131
  757   2HG2  THR 103          2HG2      THR 103  -4.148   9.752  -4.897
  758   3HG2  THR 103          1HG2      THR 103  -2.651   9.459  -3.976
  759    H    LYS 104             H      LYS 104  -3.143   7.103  -1.089
  760    HA   LYS 104            HA      LYS 104  -5.241   5.575   0.373
  761   1HB   LYS 104           2HB      LYS 104  -3.364   4.034  -0.039
  762   2HB   LYS 104           1HB      LYS 104  -2.247   5.193   0.665
  763   1HG   LYS 104           2HG      LYS 104  -2.696   3.610   2.396
  764   2HG   LYS 104           1HG      LYS 104  -3.651   5.028   2.806
  765   1HD   LYS 104           2HD      LYS 104  -5.311   3.456   3.010
  766   2HD   LYS 104           1HD      LYS 104  -5.446   3.751   1.274
  767   1HE   LYS 104           2HE      LYS 104  -5.332   1.340   1.712
  768   2HE   LYS 104           1HE      LYS 104  -3.897   1.868   0.842
  769   1HZ   LYS 104           2HZ      LYS 104  -3.659   1.997   3.727
  770   2HZ   LYS 104           1HZ      LYS 104  -3.855   0.427   3.111
  771   3HZ   LYS 104           3HZ      LYS 104  -2.574   1.392   2.569
  772    H    THR 105             H      THR 105  -5.527   6.201   2.520
  773    HA   THR 105            HA      THR 105  -4.107   8.675   3.411
  774    HB   THR 105            HB      THR 105  -6.174   9.371   4.492
  775    HG1  THR 105           HG1      THR 105  -7.891   8.087   4.628
  776   1HG2  THR 105          3HG2      THR 105  -6.119   8.750   1.613
  777   2HG2  THR 105          2HG2      THR 105  -7.740   8.989   2.262
  778   3HG2  THR 105          1HG2      THR 105  -6.529  10.258   2.427
  779    H    ASP 106             H      ASP 106  -5.704   8.190   6.073
  780    HA   ASP 106            HA      ASP 106  -3.715   6.360   7.234
  781   1HB   ASP 106           2HB      ASP 106  -4.543   8.633   8.195
  782   2HB   ASP 106           1HB      ASP 106  -5.849   7.660   8.858
  783    H    LYS 107             H      LYS 107  -7.184   6.450   6.515
  784    HA   LYS 107            HA      LYS 107  -7.359   3.552   7.089
  785   1HB   LYS 107           2HB      LYS 107  -9.552   5.173   8.356
  786   2HB   LYS 107           1HB      LYS 107  -8.963   3.572   8.779
  787   1HG   LYS 107           2HG      LYS 107  -6.990   4.487   9.826
  788   2HG   LYS 107           1HG      LYS 107  -7.356   6.105   9.221
  789   1HD   LYS 107           2HD      LYS 107  -9.374   6.208  10.579
  790   2HD   LYS 107           1HD      LYS 107  -9.129   4.548  11.121
  791   1HE   LYS 107           2HE      LYS 107  -7.024   5.192  12.203
  792   2HE   LYS 107           1HE      LYS 107  -7.224   6.849  11.630
  793   1HZ   LYS 107           2HZ      LYS 107  -9.327   5.541  13.227
  794   2HZ   LYS 107           1HZ      LYS 107  -7.993   6.266  13.986
  795   3HZ   LYS 107           3HZ      LYS 107  -9.024   7.198  13.013
  796    H    THR 108             H      THR 108  -7.707   5.524   4.753
  797    HA   THR 108            HA      THR 108 -10.324   4.457   3.821
  798    HB   THR 108            HB      THR 108 -10.991   6.510   2.874
  799    HG1  THR 108           HG1      THR 108  -9.281   7.365   1.919
  800   1HG2  THR 108          1HG2      THR 108 -10.941   6.321   5.458
  801   2HG2  THR 108          3HG2      THR 108  -9.624   7.496   5.363
  802   3HG2  THR 108          2HG2      THR 108 -11.213   7.919   4.739
  803    H    LEU 109             H      LEU 109 -10.333   4.186   1.513
  804    HA   LEU 109            HA      LEU 109  -7.671   3.860   0.245
  805   1HB   LEU 109           2HB      LEU 109  -9.357   1.888   1.015
  806   2HB   LEU 109           1HB      LEU 109 -10.036   2.188  -0.564
  807    HG   LEU 109            HG      LEU 109  -8.045   0.427   0.003
  808   1HD1  LEU 109          3HD1      LEU 109  -9.136   1.654  -2.410
  809   2HD1  LEU 109          2HD1      LEU 109  -7.611   0.791  -2.621
  810   3HD1  LEU 109          1HD1      LEU 109  -9.014  -0.047  -1.947
  811   1HD2  LEU 109          1HD2      LEU 109  -6.440   2.304   0.353
  812   2HD2  LEU 109          3HD2      LEU 109  -5.952   1.133  -0.867
  813   3HD2  LEU 109          2HD2      LEU 109  -6.620   2.689  -1.357
  814    H    VAL 110             H      VAL 110  -7.779   5.922  -1.003
  815    HA   VAL 110            HA      VAL 110 -10.314   6.451  -2.409
  816    HB   VAL 110            HB      VAL 110  -7.775   8.021  -1.836
  817   1HG1  VAL 110          3HG1      VAL 110  -9.502   8.322  -4.259
  818   2HG1  VAL 110          2HG1      VAL 110  -9.012   9.784  -3.426
  819   3HG1  VAL 110          1HG1      VAL 110  -7.799   8.688  -4.055
  820   1HG2  VAL 110          3HG2      VAL 110 -10.727   8.234  -1.381
  821   2HG2  VAL 110          2HG2      VAL 110  -9.390   8.651  -0.304
  822   3HG2  VAL 110          1HG2      VAL 110  -9.852   9.758  -1.609
  823    H    LEU 111             H      LEU 111 -10.480   6.485  -4.635
  824    HA   LEU 111            HA      LEU 111  -8.193   5.493  -6.217
  825   1HB   LEU 111           2HB      LEU 111 -10.971   4.518  -6.889
  826   2HB   LEU 111           1HB      LEU 111  -9.434   3.844  -7.392
  827    HG   LEU 111            HG      LEU 111 -10.681   3.658  -4.664
  828   1HD1  LEU 111          2HD1      LEU 111 -11.279   2.143  -6.768
  829   2HD1  LEU 111          1HD1      LEU 111  -9.800   1.303  -6.277
  830   3HD1  LEU 111          3HD1      LEU 111 -11.161   1.447  -5.153
  831   1HD2  LEU 111          3HD2      LEU 111  -7.976   3.723  -5.193
  832   2HD2  LEU 111          2HD2      LEU 111  -8.728   3.138  -3.732
  833   3HD2  LEU 111          1HD2      LEU 111  -8.348   2.015  -5.038
  834    H    LEU 112             H      LEU 112  -8.356   6.161  -8.409
  835    HA   LEU 112            HA      LEU 112 -10.333   8.266  -9.002
  836   1HB   LEU 112           2HB      LEU 112  -7.984   9.118  -8.301
  837   2HB   LEU 112           1HB      LEU 112  -7.427   8.383  -9.774
  838    HG   LEU 112            HG      LEU 112  -7.850  10.311 -10.857
  839   1HD1  LEU 112          3HD1      LEU 112 -10.709   9.682 -10.217
  840   2HD1  LEU 112          2HD1      LEU 112 -10.270  11.166 -11.065
  841   3HD1  LEU 112          1HD1      LEU 112  -9.866   9.599 -11.772
  842   1HD2  LEU 112          3HD2      LEU 112  -8.472  11.036  -8.137
  843   2HD2  LEU 112          2HD2      LEU 112  -7.640  11.947  -9.397
  844   3HD2  LEU 112          1HD2      LEU 112  -9.390  12.005  -9.295
  845    H    MET 113             H      MET 113 -11.454   7.179 -10.598
  846    HA   MET 113            HA      MET 113  -9.821   5.470 -12.465
  847   1HB   MET 113           2HB      MET 113 -11.816   4.385 -11.876
  848   2HB   MET 113           1HB      MET 113 -12.757   5.793 -12.042
  849   1HG   MET 113           2HG      MET 113 -13.416   4.569 -13.939
  850   2HG   MET 113           1HG      MET 113 -12.169   5.609 -14.608
  851   1HE   MET 113           1HE      MET 113 -13.431   2.480 -13.434
  852   2HE   MET 113           3HE      MET 113 -13.282   2.038 -15.142
  853   3HE   MET 113           2HE      MET 113 -12.337   1.190 -13.922
  854    H    GLY 114             H      GLY 114  -9.697   5.766 -14.590
  855   1HA   GLY 114           2HA      GLY 114 -10.711   8.233 -15.774
  856   2HA   GLY 114           1HA      GLY 114  -8.989   7.981 -15.781
  857    H    LYS 115             H      LYS 115 -10.905   8.167 -17.937
  858    HA   LYS 115            HA      LYS 115 -10.285   5.705 -19.390
  859   1HB   LYS 115           2HB      LYS 115 -12.855   7.230 -19.275
  860   2HB   LYS 115           1HB      LYS 115 -12.401   6.361 -20.743
  861   1HG   LYS 115           2HG      LYS 115 -11.867   4.429 -18.965
  862   2HG   LYS 115           1HG      LYS 115 -13.104   5.271 -18.066
  863   1HD   LYS 115           2HD      LYS 115 -14.584   5.141 -20.099
  864   2HD   LYS 115           1HD      LYS 115 -13.362   4.110 -20.844
  865   1HE   LYS 115           2HE      LYS 115 -13.538   2.630 -18.768
  866   2HE   LYS 115           1HE      LYS 115 -14.984   3.556 -18.357
  867   1HZ   LYS 115           3HZ      LYS 115 -14.621   2.245 -20.985
  868   2HZ   LYS 115           2HZ      LYS 115 -15.352   1.464 -19.665
  869   3HZ   LYS 115           1HZ      LYS 115 -16.048   2.869 -20.318
  870    H    GLU 116             H      GLU 116 -10.096   6.136 -21.700
  871    HA   GLU 116            HA      GLU 116  -8.152   7.465 -22.757
  872   1HB   GLU 116           2HB      GLU 116  -9.940   6.464 -23.737
  873   2HB   GLU 116           1HB      GLU 116 -10.764   7.948 -23.784
  874   1HG   GLU 116           2HG      GLU 116  -8.037   8.006 -24.896
  875   2HG   GLU 116           1HG      GLU 116  -9.154   7.014 -25.812
  876    H    GLY 117             H      GLY 117  -7.394   9.284 -23.655
  877   1HA   GLY 117           2HA      GLY 117  -6.940  11.598 -23.784
  878   2HA   GLY 117           1HA      GLY 117  -8.549  11.919 -23.073
  879    H    VAL 118             H      VAL 118  -7.005   9.213 -21.709
  880    HA   VAL 118            HA      VAL 118  -6.580  10.543 -19.178
  881    HB   VAL 118            HB      VAL 118  -8.229   8.651 -19.900
  882   1HG1  VAL 118          2HG1      VAL 118  -6.544   7.154 -20.832
  883   2HG1  VAL 118          1HG1      VAL 118  -5.921   6.893 -19.201
  884   3HG1  VAL 118          3HG1      VAL 118  -7.594   6.442 -19.582
  885   1HG2  VAL 118          2HG2      VAL 118  -6.662   9.043 -17.386
  886   2HG2  VAL 118          1HG2      VAL 118  -8.414   9.027 -17.623
  887   3HG2  VAL 118          3HG2      VAL 118  -7.526   7.493 -17.469
  888    H    HIS 119             H      HIS 119  -4.428  11.291 -19.242
  889    HA   HIS 119            HA      HIS 119  -2.260   9.609 -20.256
  890   1HB   HIS 119           2HB      HIS 119  -2.183  12.123 -20.280
  891   2HB   HIS 119           1HB      HIS 119  -2.037  12.086 -18.521
  892    HD1  HIS 119           HD1      HIS 119   0.376  13.263 -19.217
  893    HD2  HIS 119           HD2      HIS 119  -0.043   9.191 -20.015
  894    HE1  HIS 119           HE1      HIS 119   2.720  12.342 -19.523
  895    H    GLY 120             H      GLY 120  -3.779  10.278 -17.163
  896   1HA   GLY 120           2HA      GLY 120  -3.753   8.749 -15.313
  897   2HA   GLY 120           1HA      GLY 120  -2.252   8.057 -15.938
  898    H    GLY 121             H      GLY 121  -1.240  10.948 -16.364
  899   1HA   GLY 121           2HA      GLY 121   0.059  11.214 -13.745
  900   2HA   GLY 121           1HA      GLY 121   0.367  12.218 -15.161
  901    H    LEU 122             H      LEU 122  -2.484  12.862 -15.526
  902    HA   LEU 122            HA      LEU 122  -2.712  15.152 -13.693
  903   1HB   LEU 122           2HB      LEU 122  -4.997  14.236 -15.438
  904   2HB   LEU 122           1HB      LEU 122  -4.538  15.874 -14.992
  905    HG   LEU 122            HG      LEU 122  -2.513  14.441 -16.597
  906   1HD1  LEU 122          1HD1      LEU 122  -5.181  15.205 -17.782
  907   2HD1  LEU 122          3HD1      LEU 122  -3.760  14.696 -18.698
  908   3HD1  LEU 122          2HD1      LEU 122  -4.568  13.556 -17.610
  909   1HD2  LEU 122          2HD2      LEU 122  -3.826  17.149 -16.536
  910   2HD2  LEU 122          1HD2      LEU 122  -2.150  16.740 -16.159
  911   3HD2  LEU 122          3HD2      LEU 122  -2.722  16.685 -17.830
  912    H    ILE 123             H      ILE 123  -4.227  12.057 -14.277
  913    HA   ILE 123            HA      ILE 123  -6.288  12.228 -12.280
  914    HB   ILE 123            HB      ILE 123  -4.804  10.044 -13.703
  915   1HG1  ILE 123          2HG1      ILE 123  -7.616  11.205 -13.890
  916   2HG1  ILE 123          1HG1      ILE 123  -6.330  11.346 -15.088
  917   1HG2  ILE 123          1HG2      ILE 123  -6.054   9.547 -11.249
  918   2HG2  ILE 123          3HG2      ILE 123  -7.301   9.156 -12.423
  919   3HG2  ILE 123          2HG2      ILE 123  -5.742   8.351 -12.492
  920   1HD1  ILE 123          2HD1      ILE 123  -6.390   8.903 -15.413
  921   2HD1  ILE 123          1HD1      ILE 123  -7.707   8.791 -14.244
  922   3HD1  ILE 123          3HD1      ILE 123  -7.942   9.664 -15.748
  923    H    ASN 124             H      ASN 124  -2.897  11.260 -12.324
  924    HA   ASN 124            HA      ASN 124  -2.720  10.255  -9.655
  925   1HB   ASN 124           2HB      ASN 124  -0.948   9.790 -11.289
  926   2HB   ASN 124           1HB      ASN 124  -0.633  11.518 -11.463
  927   1HD2  ASN 124          2HD2      ASN 124   0.928   9.487  -8.289
  928   2HD2  ASN 124          1HD2      ASN 124  -0.134   8.721  -9.365
  929    H    LYS 125             H      LYS 125  -2.705  13.408 -11.148
  930    HA   LYS 125            HA      LYS 125  -1.817  14.854  -8.684
  931   1HB   LYS 125           2HB      LYS 125  -2.969  15.725 -11.388
  932   2HB   LYS 125           1HB      LYS 125  -2.602  16.875 -10.097
  933   1HG   LYS 125           2HG      LYS 125  -0.487  14.904 -10.890
  934   2HG   LYS 125           1HG      LYS 125  -0.799  16.278 -11.964
  935   1HD   LYS 125           2HD      LYS 125  -0.582  17.773  -9.911
  936   2HD   LYS 125           1HD      LYS 125   0.023  16.359  -9.045
  937   1HE   LYS 125           2HE      LYS 125   1.242  17.235 -11.664
  938   2HE   LYS 125           1HE      LYS 125   1.776  17.917 -10.128
  939   1HZ   LYS 125           3HZ      LYS 125   2.036  15.525  -9.389
  940   2HZ   LYS 125           2HZ      LYS 125   1.896  15.104 -11.030
  941   3HZ   LYS 125           1HZ      LYS 125   3.169  16.100 -10.510
  942    H    LYS 126             H      LYS 126  -4.923  14.003 -10.239
  943    HA   LYS 126            HA      LYS 126  -6.550  15.630  -8.419
  944   1HB   LYS 126           2HB      LYS 126  -7.070  13.876 -10.781
  945   2HB   LYS 126           1HB      LYS 126  -8.388  14.112  -9.633
  946   1HG   LYS 126           2HG      LYS 126  -8.776  15.964 -10.921
  947   2HG   LYS 126           1HG      LYS 126  -7.556  16.665  -9.869
  948   1HD   LYS 126           2HD      LYS 126  -6.924  17.182 -12.132
  949   2HD   LYS 126           1HD      LYS 126  -5.813  15.948 -11.549
  950   1HE   LYS 126           2HE      LYS 126  -6.461  14.522 -13.177
  951   2HE   LYS 126           1HE      LYS 126  -8.151  14.704 -12.739
  952   1HZ   LYS 126           1HZ      LYS 126  -6.680  16.714 -14.341
  953   2HZ   LYS 126           3HZ      LYS 126  -7.529  15.426 -15.046
  954   3HZ   LYS 126           2HZ      LYS 126  -8.358  16.584 -14.119
  955    H    CYS 127             H      CYS 127  -5.118  12.545  -8.322
  956    HA   CYS 127            HA      CYS 127  -7.088  11.339  -6.485
  957   1HB   CYS 127           2HB      CYS 127  -5.589  10.080  -8.259
  958   2HB   CYS 127           1HB      CYS 127  -4.368  10.194  -7.000
  959    HG   CYS 127            HG      CYS 127  -5.502   8.326  -5.858
  960    OH   TYR 128            OH      TYR 128   2.455  14.145  -2.037
  961    H    TYR 128             H      TYR 128  -3.976  12.885  -6.637
  962    HA   TYR 128            HA      TYR 128  -3.141  12.476  -3.925
  963   1HB   TYR 128           2HB      TYR 128  -1.979  13.416  -6.168
  964   2HB   TYR 128           1HB      TYR 128  -2.503  14.954  -5.512
  965    HD1  TYR 128           HD1      TYR 128  -1.949  13.193  -2.588
  966    HD2  TYR 128           HD2      TYR 128   0.199  14.745  -5.973
  967    HE1  TYR 128           HE1      TYR 128   0.102  13.312  -1.221
  968    HE2  TYR 128           HE2      TYR 128   2.265  14.858  -4.574
  969    HH   TYR 128            HH      TYR 128   2.730  13.241  -1.848
  970    H    GLU 129             H      GLU 129  -5.173  14.823  -5.692
  971    HA   GLU 129            HA      GLU 129  -5.559  16.607  -3.368
  972   1HB   GLU 129           2HB      GLU 129  -6.693  16.458  -6.154
  973   2HB   GLU 129           1HB      GLU 129  -7.441  17.504  -4.949
  974   1HG   GLU 129           2HG      GLU 129  -5.176  18.526  -4.534
  975   2HG   GLU 129           1HG      GLU 129  -4.568  17.595  -5.903
  976    H    MET 130             H      MET 130  -7.329  13.973  -4.913
  977    HA   MET 130            HA      MET 130  -9.835  14.181  -3.526
  978   1HB   MET 130           2HB      MET 130  -8.894  12.619  -5.527
  979   2HB   MET 130           1HB      MET 130  -8.653  11.497  -4.206
  980   1HG   MET 130           2HG      MET 130 -11.133  11.972  -3.603
  981   2HG   MET 130           1HG      MET 130 -11.248  12.686  -5.226
  982   1HE   MET 130           3HE      MET 130 -12.964  10.753  -4.187
  983   2HE   MET 130           2HE      MET 130 -13.219  10.438  -5.901
  984   3HE   MET 130           1HE      MET 130 -12.890   9.095  -4.807
  985    H    ALA 131             H      ALA 131  -6.835  12.437  -2.818
  986    HA   ALA 131            HA      ALA 131  -7.652  11.532  -0.163
  987   1HB   ALA 131           3HB      ALA 131  -5.020  11.398  -1.709
  988   2HB   ALA 131           2HB      ALA 131  -5.240  10.751  -0.066
  989   3HB   ALA 131           1HB      ALA 131  -6.169  10.079  -1.407
  990    H    SER 132             H      SER 132  -6.258  14.418  -1.521
  991    HA   SER 132            HA      SER 132  -4.647  15.233   0.722
  992   1HB   SER 132           2HB      SER 132  -4.630  17.432  -0.242
  993   2HB   SER 132           1HB      SER 132  -4.664  16.343  -1.615
  994    HG   SER 132            HG      SER 132  -6.731  17.924  -0.513
  995    H    HIS 133             H      HIS 133  -8.115  15.352  -0.066
  996    HA   HIS 133            HA      HIS 133  -8.712  16.937   2.333
  997   1HB   HIS 133           2HB      HIS 133 -10.249  16.832   0.282
  998   2HB   HIS 133           1HB      HIS 133 -10.797  15.254   0.923
  999    HD1  HIS 133           HD1      HIS 133 -12.607  15.402   2.602
 1000    HD2  HIS 133           HD2      HIS 133 -10.389  18.927   2.476
 1001    HE1  HIS 133           HE1      HIS 133 -13.702  16.997   4.242
 1002    H    LEU 134             H      LEU 134  -8.858  13.484   1.309
 1003    HA   LEU 134            HA      LEU 134  -9.908  12.595   3.856
 1004   1HB   LEU 134           2HB      LEU 134  -8.373  11.240   1.666
 1005   2HB   LEU 134           1HB      LEU 134  -8.815  10.390   3.141
 1006    HG   LEU 134            HG      LEU 134 -11.137  11.759   2.358
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.526  10.954   0.049
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.189  10.370   0.020
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.861  12.099   0.150
 1010   1HD2  LEU 134          3HD2      LEU 134 -10.738   9.428   3.399
 1011   2HD2  LEU 134          2HD2      LEU 134 -12.097   9.594   2.289
 1012   3HD2  LEU 134          1HD2      LEU 134 -10.590   8.862   1.738
 1013    NH1  ARG 135           NH2      ARG 135  -2.510  10.051   5.901
 1014    NH2  ARG 135           NH1      ARG 135  -1.513  11.560   7.261
 1015    H    ARG 135             H      ARG 135  -6.888  13.836   3.076
 1016    HA   ARG 135            HA      ARG 135  -5.436  12.535   5.273
 1017   1HB   ARG 135           2HB      ARG 135  -4.760  14.578   3.153
 1018   2HB   ARG 135           1HB      ARG 135  -3.724  14.412   4.569
 1019   1HG   ARG 135           2HG      ARG 135  -4.436  11.830   3.341
 1020   2HG   ARG 135           1HG      ARG 135  -3.525  12.888   2.265
 1021   1HD   ARG 135           2HD      ARG 135  -2.093  11.381   3.709
 1022   2HD   ARG 135           1HD      ARG 135  -1.731  13.101   3.860
 1023    HE   ARG 135            HE      ARG 135  -3.304  12.950   5.939
 1024   1HH1  ARG 135          1HH2      ARG 135  -3.082   9.849   5.108
 1025   2HH1  ARG 135          2HH2      ARG 135  -2.133   9.304   6.449
 1026   1HH2  ARG 135          2HH1      ARG 135  -1.324  12.512   7.508
 1027   2HH2  ARG 135          1HH1      ARG 135  -1.132  10.817   7.809
 1028    NH1  ARG 136           NH1      ARG 136  -4.230  21.512   4.192
 1029    NH2  ARG 136           NH2      ARG 136  -3.938  21.939   6.391
 1030    H    ARG 136             H      ARG 136  -6.873  15.615   4.330
 1031    HA   ARG 136            HA      ARG 136  -6.408  16.847   6.947
 1032   1HB   ARG 136           2HB      ARG 136  -7.986  17.682   4.513
 1033   2HB   ARG 136           1HB      ARG 136  -7.909  18.652   5.986
 1034   1HG   ARG 136           2HG      ARG 136  -5.435  17.729   4.507
 1035   2HG   ARG 136           1HG      ARG 136  -6.222  19.274   4.177
 1036   1HD   ARG 136           2HD      ARG 136  -5.984  19.867   6.590
 1037   2HD   ARG 136           1HD      ARG 136  -5.092  18.366   6.838
 1038    HE   ARG 136            HE      ARG 136  -3.264  19.283   5.551
 1039   1HH1  ARG 136          2HH1      ARG 136  -4.342  20.859   3.444
 1040   2HH1  ARG 136          1HH1      ARG 136  -4.225  22.493   4.001
 1041   1HH2  ARG 136          1HH2      ARG 136  -3.824  21.613   7.327
 1042   2HH2  ARG 136          2HH2      ARG 136  -3.942  22.921   6.200
 1043    H    SER 137             H      SER 137  -8.460  14.483   5.855
 1044    HA   SER 137            HA      SER 137 -10.876  15.302   7.259
 1045   1HB   SER 137           2HB      SER 137 -11.841  13.320   6.309
 1046   2HB   SER 137           1HB      SER 137 -10.775  13.917   5.056
 1047    HG   SER 137            HG      SER 137 -10.550  11.655   5.469
 1048    H    GLN 138             H      GLN 138  -7.926  13.490   7.832
 1049    HA   GLN 138            HA      GLN 138  -7.089  12.553   9.824
 1050   1HB   GLN 138           2HB      GLN 138  -9.718  13.312  11.158
 1051   2HB   GLN 138           1HB      GLN 138  -8.185  12.958  11.943
 1052   1HG   GLN 138           2HG      GLN 138  -8.181  15.163   9.932
 1053   2HG   GLN 138           1HG      GLN 138  -8.988  15.480  11.465
 1054   1HE2  GLN 138          2HE2      GLN 138  -5.970  15.483  13.359
 1055   2HE2  GLN 138          1HE2      GLN 138  -7.668  15.428  13.438
 1056    OH   TYR 139            OH      TYR 139 -15.584  10.838   9.935
 1057    H    TYR 139             H      TYR 139  -8.804  11.211   7.783
 1058    HA   TYR 139            HA      TYR 139  -9.980   8.988   9.392
 1059   1HB   TYR 139           2HB      TYR 139 -10.479  10.059   6.632
 1060   2HB   TYR 139           1HB      TYR 139 -10.834   8.370   6.982
 1061    HD1  TYR 139           HD1      TYR 139 -11.506  11.846   8.166
 1062    HD2  TYR 139           HD2      TYR 139 -12.775   7.753   8.125
 1063    HE1  TYR 139           HE1      TYR 139 -13.631  12.497   9.271
 1064    HE2  TYR 139           HE2      TYR 139 -14.897   8.391   9.224
 1065    HH   TYR 139            HH      TYR 139 -15.776  10.179  10.607
   
  Start of MODEL          15
 Raw file had 1065 H/Q atoms
  Start of MODEL   15
    1   1H    ALA   1            1H      ALA   1 -21.731  15.706   2.602
    2   2H    ALA   1            3H      ALA   1 -23.202  16.409   2.139
    3   3H    ALA   1            2H      ALA   1 -22.090  15.910   0.954
    4    HA   ALA   1            HA      ALA   1 -21.710  18.155   0.981
    5   1HB   ALA   1           1HB      ALA   1 -23.276  18.482   2.939
    6   2HB   ALA   1           3HB      ALA   1 -21.923  18.108   4.006
    7   3HB   ALA   1           2HB      ALA   1 -21.856  19.530   2.967
    8    H    GLY   2             H      GLY   2 -20.016  15.742   1.278
    9   1HA   GLY   2           2HA      GLY   2 -17.471  17.098   1.847
   10   2HA   GLY   2           1HA      GLY   2 -17.845  15.758   2.933
   11    CH2  TRP   3           CH2      TRP   3 -12.864  11.619   3.702
   12    H    TRP   3             H      TRP   3 -17.959  13.633   2.081
   13    HA   TRP   3            HA      TRP   3 -16.102  12.808   0.239
   14   1HB   TRP   3           2HB      TRP   3 -18.559  11.653   1.183
   15   2HB   TRP   3           1HB      TRP   3 -17.666  10.834  -0.059
   16    HD1  TRP   3           HD1      TRP   3 -17.876   9.309   2.369
   17    HE1  TRP   3           HE1      TRP   3 -15.986   8.801   4.006
   18    HE3  TRP   3           HE3      TRP   3 -14.627  13.193   1.267
   19    HZ2  TRP   3           HZ2      TRP   3 -13.470   9.859   4.761
   20    HZ3  TRP   3           HZ3      TRP   3 -12.514  13.358   2.492
   21    HH2  TRP   3           HH2      TRP   3 -11.926  11.707   4.232
   22    H    ASN   4             H      ASN   4 -19.529  13.467  -0.471
   23    HA   ASN   4            HA      ASN   4 -19.566  12.652  -3.185
   24   1HB   ASN   4           2HB      ASN   4 -21.182  14.854  -1.883
   25   2HB   ASN   4           1HB      ASN   4 -21.572  14.071  -3.415
   26   1HD2  ASN   4          2HD2      ASN   4 -22.340  12.138   0.105
   27   2HD2  ASN   4          1HD2      ASN   4 -21.474  13.597   0.095
   28    H    ALA   5             H      ALA   5 -18.392  15.601  -1.812
   29    HA   ALA   5            HA      ALA   5 -18.170  17.114  -4.338
   30   1HB   ALA   5           2HB      ALA   5 -17.364  17.512  -1.484
   31   2HB   ALA   5           1HB      ALA   5 -16.315  18.275  -2.679
   32   3HB   ALA   5           3HB      ALA   5 -18.033  18.664  -2.641
   33    OH   TYR   6            OH      TYR   6 -13.499  17.861   1.401
   34    H    TYR   6             H      TYR   6 -16.087  14.937  -2.378
   35    HA   TYR   6            HA      TYR   6 -13.790  15.334  -4.172
   36   1HB   TYR   6           2HB      TYR   6 -14.227  13.025  -2.254
   37   2HB   TYR   6           1HB      TYR   6 -12.688  13.577  -2.941
   38    HD1  TYR   6           HD1      TYR   6 -11.832  15.899  -2.371
   39    HD2  TYR   6           HD2      TYR   6 -15.202  14.148  -0.516
   40    HE1  TYR   6           HE1      TYR   6 -11.787  17.669  -0.622
   41    HE2  TYR   6           HE2      TYR   6 -15.176  15.833   1.255
   42    HH   TYR   6            HH      TYR   6 -14.413  18.128   1.541
   43    H    ILE   7             H      ILE   7 -16.779  13.815  -4.419
   44    HA   ILE   7            HA      ILE   7 -15.954  11.911  -6.494
   45    HB   ILE   7            HB      ILE   7 -18.529  12.493  -5.102
   46   1HG1  ILE   7          2HG1      ILE   7 -16.670  10.954  -4.252
   47   2HG1  ILE   7          1HG1      ILE   7 -18.286  10.264  -4.313
   48   1HG2  ILE   7          2HG2      ILE   7 -18.137  11.400  -7.812
   49   2HG2  ILE   7          1HG2      ILE   7 -19.168  10.425  -6.753
   50   3HG2  ILE   7          3HG2      ILE   7 -19.583  12.110  -7.088
   51   1HD1  ILE   7          1HD1      ILE   7 -16.770   9.929  -6.792
   52   2HD1  ILE   7          3HD1      ILE   7 -16.013   9.150  -5.407
   53   3HD1  ILE   7          2HD1      ILE   7 -17.665   8.737  -5.857
   54    H    ASP   8             H      ASP   8 -17.330  15.093  -5.959
   55    HA   ASP   8            HA      ASP   8 -18.290  15.730  -8.516
   56   1HB   ASP   8           2HB      ASP   8 -17.498  17.208  -6.135
   57   2HB   ASP   8           1HB      ASP   8 -17.574  18.120  -7.576
   58    H    ASN   9             H      ASN   9 -15.177  15.341  -7.223
   59    HA   ASN   9            HA      ASN   9 -13.419  16.717  -8.853
   60   1HB   ASN   9           2HB      ASN   9 -12.259  15.580  -7.267
   61   2HB   ASN   9           1HB      ASN   9 -13.488  14.512  -6.995
   62   1HD2  ASN   9          2HD2      ASN   9 -11.539  11.665  -8.207
   63   2HD2  ASN   9          1HD2      ASN   9 -12.628  12.281  -7.048
   64    H    LEU  10             H      LEU  10 -14.874  13.726  -9.305
   65    HA   LEU  10            HA      LEU  10 -13.676  12.959 -11.747
   66   1HB   LEU  10           2HB      LEU  10 -16.171  11.924 -10.529
   67   2HB   LEU  10           1HB      LEU  10 -15.259  11.160 -11.826
   68    HG   LEU  10            HG      LEU  10 -14.571  10.057  -9.999
   69   1HD1  LEU  10          2HD1      LEU  10 -12.537  12.253 -10.296
   70   2HD1  LEU  10          1HD1      LEU  10 -12.244  10.767  -9.431
   71   3HD1  LEU  10          3HD1      LEU  10 -12.579  10.711 -11.139
   72   1HD2  LEU  10          1HD2      LEU  10 -15.738  11.608  -8.347
   73   2HD2  LEU  10          3HD2      LEU  10 -14.259  10.974  -7.725
   74   3HD2  LEU  10          2HD2      LEU  10 -14.284  12.549  -8.314
   75    H    MET  11             H      MET  11 -16.348  14.720 -10.825
   76    HA   MET  11            HA      MET  11 -17.554  14.444 -13.480
   77   1HB   MET  11           2HB      MET  11 -18.444  15.957 -10.991
   78   2HB   MET  11           1HB      MET  11 -19.454  15.459 -12.349
   79   1HG   MET  11           2HG      MET  11 -17.902  13.165 -10.896
   80   2HG   MET  11           1HG      MET  11 -19.308  13.909 -10.062
   81   1HE   MET  11           1HE      MET  11 -17.926  11.648 -12.441
   82   2HE   MET  11           3HE      MET  11 -18.997  10.729 -11.372
   83   3HE   MET  11           2HE      MET  11 -19.290  10.756 -13.110
   84    H    ALA  12             H      ALA  12 -15.443  16.588 -11.687
   85    HA   ALA  12            HA      ALA  12 -15.809  18.973 -13.297
   86   1HB   ALA  12           3HB      ALA  12 -14.061  18.221 -11.000
   87   2HB   ALA  12           2HB      ALA  12 -13.718  19.683 -11.936
   88   3HB   ALA  12           1HB      ALA  12 -15.265  19.513 -11.105
   89    H    ASP  13             H      ASP  13 -13.088  16.817 -12.801
   90    HA   ASP  13            HA      ASP  13 -11.392  18.069 -14.710
   91   1HB   ASP  13           2HB      ASP  13 -10.072  15.734 -14.277
   92   2HB   ASP  13           1HB      ASP  13  -9.826  17.254 -13.424
   93    H    GLY  14             H      GLY  14 -13.765  16.205 -15.923
   94   1HA   GLY  14           2HA      GLY  14 -13.988  15.042 -18.050
   95   2HA   GLY  14           1HA      GLY  14 -13.013  16.385 -18.609
   96    H    THR  15             H      THR  15 -11.345  14.295 -16.510
   97    HA   THR  15            HA      THR  15  -9.983  12.650 -18.596
   98    HB   THR  15            HB      THR  15  -8.834  13.860 -16.072
   99    HG1  THR  15           HG1      THR  15  -8.060  14.165 -18.781
  100   1HG2  THR  15          2HG2      THR  15  -7.612  11.966 -18.102
  101   2HG2  THR  15          1HG2      THR  15  -6.769  12.722 -16.728
  102   3HG2  THR  15          3HG2      THR  15  -8.088  11.581 -16.424
  103    H    CYS  16             H      CYS  16 -10.974  13.122 -15.379
  104    HA   CYS  16            HA      CYS  16 -10.971  10.542 -14.348
  105   1HB   CYS  16           2HB      CYS  16 -12.427  11.741 -12.643
  106   2HB   CYS  16           1HB      CYS  16 -10.964  12.562 -12.958
  107    HG   CYS  16            HG      CYS  16 -12.218  14.384 -14.230
  108    H    GLN  17             H      GLN  17 -12.661   9.141 -14.285
  109    HA   GLN  17            HA      GLN  17 -14.994   9.580 -16.010
  110   1HB   GLN  17           2HB      GLN  17 -12.853   8.164 -16.616
  111   2HB   GLN  17           1HB      GLN  17 -13.667   6.935 -15.706
  112   1HG   GLN  17           2HG      GLN  17 -15.093   8.427 -17.864
  113   2HG   GLN  17           1HG      GLN  17 -13.955   7.124 -18.293
  114   1HE2  GLN  17          2HE2      GLN  17 -15.992   4.667 -16.429
  115   2HE2  GLN  17          1HE2      GLN  17 -14.372   5.163 -16.484
  116    H    ASP  18             H      ASP  18 -13.448   7.784 -13.383
  117    HA   ASP  18            HA      ASP  18 -15.938   7.638 -11.902
  118   1HB   ASP  18           2HB      ASP  18 -15.317   5.445 -13.188
  119   2HB   ASP  18           1HB      ASP  18 -14.268   5.213 -11.813
  120    H    ALA  19             H      ALA  19 -15.211   6.549  -9.610
  121    HA   ALA  19            HA      ALA  19 -12.582   7.461  -8.625
  122   1HB   ALA  19           3HB      ALA  19 -15.048   9.102  -8.568
  123   2HB   ALA  19           2HB      ALA  19 -14.062   8.990  -7.067
  124   3HB   ALA  19           1HB      ALA  19 -13.317   9.494  -8.569
  125    H    ALA  20             H      ALA  20 -12.293   6.464  -6.539
  126    HA   ALA  20            HA      ALA  20 -14.822   5.660  -5.158
  127   1HB   ALA  20           1HB      ALA  20 -12.752   3.666  -5.924
  128   2HB   ALA  20           3HB      ALA  20 -13.973   3.390  -4.669
  129   3HB   ALA  20           2HB      ALA  20 -14.448   3.729  -6.324
  130    H    ILE  21             H      ILE  21 -14.666   6.660  -3.372
  131    HA   ILE  21            HA      ILE  21 -12.148   6.546  -1.796
  132    HB   ILE  21            HB      ILE  21 -14.852   7.747  -1.054
  133   1HG1  ILE  21          2HG1      ILE  21 -12.412   8.891  -2.463
  134   2HG1  ILE  21          1HG1      ILE  21 -14.094   8.952  -2.987
  135   1HG2  ILE  21          3HG2      ILE  21 -12.052   8.020   0.125
  136   2HG2  ILE  21          2HG2      ILE  21 -13.442   8.977   0.635
  137   3HG2  ILE  21          1HG2      ILE  21 -13.435   7.231   0.886
  138   1HD1  ILE  21          3HD1      ILE  21 -14.247  10.227  -0.578
  139   2HD1  ILE  21          2HD1      ILE  21 -12.633  10.690  -1.110
  140   3HD1  ILE  21          1HD1      ILE  21 -14.032  11.058  -2.121
  141    H    VAL  22             H      VAL  22 -11.959   4.641  -0.559
  142    HA   VAL  22            HA      VAL  22 -14.497   3.215   0.065
  143    HB   VAL  22            HB      VAL  22 -11.833   1.915  -0.550
  144   1HG1  VAL  22          3HG1      VAL  22 -13.638   0.702   0.802
  145   2HG1  VAL  22          2HG1      VAL  22 -14.596   0.708  -0.679
  146   3HG1  VAL  22          1HG1      VAL  22 -13.040  -0.131  -0.637
  147   1HG2  VAL  22          3HG2      VAL  22 -13.617   3.222  -2.380
  148   2HG2  VAL  22          2HG2      VAL  22 -12.187   2.255  -2.764
  149   3HG2  VAL  22          1HG2      VAL  22 -13.770   1.479  -2.633
  150    H    GLY  23             H      GLY  23 -14.776   3.181   2.308
  151   1HA   GLY  23           2HA      GLY  23 -12.618   3.432   4.255
  152   2HA   GLY  23           1HA      GLY  23 -14.279   2.924   4.626
  153    OH   TYR  24            OH      TYR  24  -5.141   1.344   5.334
  154    H    TYR  24             H      TYR  24 -11.196   1.815   3.516
  155    HA   TYR  24            HA      TYR  24 -11.842  -0.966   3.261
  156   1HB   TYR  24           2HB      TYR  24  -9.730  -1.110   2.192
  157   2HB   TYR  24           1HB      TYR  24 -10.182   0.534   1.925
  158    HD1  TYR  24           HD1      TYR  24  -9.587   1.835   4.554
  159    HD2  TYR  24           HD2      TYR  24  -7.512  -1.155   2.434
  160    HE1  TYR  24           HE1      TYR  24  -7.491   2.446   5.698
  161    HE2  TYR  24           HE2      TYR  24  -5.410  -0.561   3.523
  162    HH   TYR  24            HH      TYR  24  -5.020   0.749   6.076
  163    H    LYS  25             H      LYS  25 -12.143   0.111   6.050
  164    HA   LYS  25            HA      LYS  25  -9.960  -0.716   7.684
  165   1HB   LYS  25           2HB      LYS  25 -12.817  -0.164   8.220
  166   2HB   LYS  25           1HB      LYS  25 -11.761  -0.715   9.484
  167   1HG   LYS  25           2HG      LYS  25 -11.675   1.634   9.635
  168   2HG   LYS  25           1HG      LYS  25 -10.195   1.179   8.790
  169   1HD   LYS  25           2HD      LYS  25 -10.977   1.903   6.744
  170   2HD   LYS  25           1HD      LYS  25 -12.671   1.752   7.220
  171   1HE   LYS  25           2HE      LYS  25 -10.763   3.755   8.431
  172   2HE   LYS  25           1HE      LYS  25 -11.851   4.120   7.095
  173   1HZ   LYS  25           1HZ      LYS  25 -13.640   3.159   8.643
  174   2HZ   LYS  25           3HZ      LYS  25 -12.513   3.429   9.881
  175   3HZ   LYS  25           2HZ      LYS  25 -13.071   4.730   8.943
  176    H    ASP  26             H      ASP  26 -11.438  -2.447   9.509
  177    HA   ASP  26            HA      ASP  26 -10.727  -5.035   8.810
  178   1HB   ASP  26           2HB      ASP  26 -12.920  -5.726  10.087
  179   2HB   ASP  26           1HB      ASP  26 -11.573  -5.037  10.960
  180    H    SER  27             H      SER  27 -13.988  -3.756   8.329
  181    HA   SER  27            HA      SER  27 -14.405  -5.599   6.072
  182   1HB   SER  27           2HB      SER  27 -16.803  -4.789   6.452
  183   2HB   SER  27           1HB      SER  27 -16.158  -5.889   7.639
  184    HG   SER  27            HG      SER  27 -17.000  -3.325   7.908
  185    HA   PRO  28            HA      PRO  28 -13.800  -1.815   3.854
  186   1HB   PRO  28           2HB      PRO  28 -13.967  -2.848   1.323
  187   2HB   PRO  28           1HB      PRO  28 -12.526  -2.956   2.351
  188   1HG   PRO  28           2HG      PRO  28 -14.400  -5.095   1.601
  189   2HG   PRO  28           1HG      PRO  28 -12.796  -5.209   2.291
  190   1HD   PRO  28           2HD      PRO  28 -15.308  -5.510   3.621
  191   2HD   PRO  28           1HD      PRO  28 -13.668  -5.663   4.300
  192    H    SER  29             H      SER  29 -15.014  -0.312   2.655
  193    HA   SER  29            HA      SER  29 -17.628  -0.990   1.674
  194   1HB   SER  29           2HB      SER  29 -18.655   0.844   3.101
  195   2HB   SER  29           1HB      SER  29 -18.278  -0.656   3.937
  196    HG   SER  29            HG      SER  29 -17.044   1.852   4.065
  197    H    VAL  30             H      VAL  30 -18.530   0.763   0.466
  198    HA   VAL  30            HA      VAL  30 -16.453   2.419  -0.719
  199    HB   VAL  30            HB      VAL  30 -19.304   1.734  -1.427
  200   1HG1  VAL  30          3HG1      VAL  30 -18.754   4.073  -2.121
  201   2HG1  VAL  30          2HG1      VAL  30 -17.352   3.442  -2.986
  202   3HG1  VAL  30          1HG1      VAL  30 -18.981   2.984  -3.492
  203   1HG2  VAL  30          3HG2      VAL  30 -16.540   1.002  -2.379
  204   2HG2  VAL  30          2HG2      VAL  30 -17.863  -0.070  -1.900
  205   3HG2  VAL  30          1HG2      VAL  30 -17.938   0.797  -3.422
  206    CH2  TRP  31           CH2      TRP  31 -13.266   6.115   6.778
  207    H    TRP  31             H      TRP  31 -16.067   4.125   0.584
  208    HA   TRP  31            HA      TRP  31 -17.987   5.551   2.141
  209   1HB   TRP  31           2HB      TRP  31 -15.109   5.906   1.388
  210   2HB   TRP  31           1HB      TRP  31 -15.968   7.284   2.083
  211    HD1  TRP  31           HD1      TRP  31 -17.398   4.138   3.407
  212    HE1  TRP  31           HE1      TRP  31 -16.569   3.682   5.757
  213    HE3  TRP  31           HE3      TRP  31 -13.491   7.448   3.660
  214    HZ2  TRP  31           HZ2      TRP  31 -14.548   4.577   7.562
  215    HZ3  TRP  31           HZ3      TRP  31 -12.165   7.631   5.731
  216    HH2  TRP  31           HH2      TRP  31 -12.673   6.192   7.675
  217    H    ALA  32             H      ALA  32 -17.007   5.733  -1.180
  218    HA   ALA  32            HA      ALA  32 -19.127   7.366  -2.006
  219   1HB   ALA  32           2HB      ALA  32 -16.698   8.922  -1.171
  220   2HB   ALA  32           1HB      ALA  32 -17.667   9.500  -2.540
  221   3HB   ALA  32           3HB      ALA  32 -18.408   9.303  -0.947
  222    H    ALA  33             H      ALA  33 -18.904   5.718  -3.624
  223    HA   ALA  33            HA      ALA  33 -16.767   6.278  -5.609
  224   1HB   ALA  33           2HB      ALA  33 -18.383   3.728  -5.250
  225   2HB   ALA  33           1HB      ALA  33 -17.153   3.999  -6.480
  226   3HB   ALA  33           3HB      ALA  33 -16.694   3.943  -4.782
  227    H    VAL  34             H      VAL  34 -17.472   6.999  -7.554
  228    HA   VAL  34            HA      VAL  34 -20.062   7.989  -8.040
  229    HB   VAL  34            HB      VAL  34 -17.998   7.007 -10.033
  230   1HG1  VAL  34          3HG1      VAL  34 -20.283   7.147 -11.039
  231   2HG1  VAL  34          2HG1      VAL  34 -20.377   8.832 -10.502
  232   3HG1  VAL  34          1HG1      VAL  34 -19.175   8.353 -11.702
  233   1HG2  VAL  34          3HG2      VAL  34 -17.640   8.970  -8.301
  234   2HG2  VAL  34          2HG2      VAL  34 -17.116   9.155  -9.972
  235   3HG2  VAL  34          1HG2      VAL  34 -18.639   9.872  -9.440
  236    HA   PRO  35            HA      PRO  35 -22.019   3.870  -8.271
  237   1HB   PRO  35           2HB      PRO  35 -24.616   4.781  -8.097
  238   2HB   PRO  35           1HB      PRO  35 -23.565   4.509  -6.695
  239   1HG   PRO  35           2HG      PRO  35 -24.340   7.098  -7.992
  240   2HG   PRO  35           1HG      PRO  35 -23.942   6.766  -6.295
  241   1HD   PRO  35           2HD      PRO  35 -22.197   7.960  -8.134
  242   2HD   PRO  35           1HD      PRO  35 -21.696   7.172  -6.621
  243    H    GLY  36             H      GLY  36 -22.840   2.708  -9.973
  244   1HA   GLY  36           2HA      GLY  36 -24.290   2.518 -11.952
  245   2HA   GLY  36           1HA      GLY  36 -23.920   4.202 -12.320
  246    H    LYS  37             H      LYS  37 -20.987   2.967 -11.328
  247    HA   LYS  37            HA      LYS  37 -20.274   2.276 -14.137
  248   1HB   LYS  37           2HB      LYS  37 -18.448   3.403 -12.004
  249   2HB   LYS  37           1HB      LYS  37 -18.059   3.165 -13.707
  250   1HG   LYS  37           2HG      LYS  37 -20.050   5.138 -12.522
  251   2HG   LYS  37           1HG      LYS  37 -18.621   5.501 -13.480
  252   1HD   LYS  37           2HD      LYS  37 -19.861   4.021 -15.306
  253   2HD   LYS  37           1HD      LYS  37 -21.294   4.488 -14.388
  254   1HE   LYS  37           2HE      LYS  37 -21.239   6.333 -15.730
  255   2HE   LYS  37           1HE      LYS  37 -20.023   6.890 -14.579
  256   1HZ   LYS  37           3HZ      LYS  37 -18.425   5.569 -16.106
  257   2HZ   LYS  37           2HZ      LYS  37 -19.655   5.744 -17.264
  258   3HZ   LYS  37           1HZ      LYS  37 -18.934   7.118 -16.572
  259    H    THR  38             H      THR  38 -18.545   1.624 -11.017
  260    HA   THR  38            HA      THR  38 -18.891  -1.238 -11.146
  261    HB   THR  38            HB      THR  38 -16.743  -0.015 -12.750
  262    HG1  THR  38           HG1      THR  38 -17.553  -1.294 -14.149
  263   1HG2  THR  38          2HG2      THR  38 -16.226  -2.572 -11.210
  264   2HG2  THR  38          1HG2      THR  38 -15.274  -2.058 -12.600
  265   3HG2  THR  38          3HG2      THR  38 -15.273  -1.082 -11.123
  266    H    PHE  39             H      PHE  39 -16.712   1.335 -10.223
  267    HA   PHE  39            HA      PHE  39 -15.135   0.085  -8.273
  268   1HB   PHE  39           2HB      PHE  39 -16.116   2.880  -8.646
  269   2HB   PHE  39           1HB      PHE  39 -15.101   2.427  -7.302
  270    HD1  PHE  39           HD2      PHE  39 -14.789   0.839 -10.652
  271    HD2  PHE  39           HD1      PHE  39 -13.159   3.744  -7.942
  272    HE1  PHE  39           HE2      PHE  39 -12.778   0.996 -12.037
  273    HE2  PHE  39           HE1      PHE  39 -11.129   3.922  -9.347
  274    HZ   PHE  39            HZ      PHE  39 -10.967   2.493 -11.384
  275    H    VAL  40             H      VAL  40 -18.226   1.678  -7.828
  276    HA   VAL  40            HA      VAL  40 -18.369   1.695  -5.040
  277    HB   VAL  40            HB      VAL  40 -20.009   2.975  -6.183
  278   1HG1  VAL  40          1HG1      VAL  40 -20.633   0.406  -7.621
  279   2HG1  VAL  40          3HG1      VAL  40 -21.707   1.803  -7.664
  280   3HG1  VAL  40          2HG1      VAL  40 -20.068   1.937  -8.300
  281   1HG2  VAL  40          1HG2      VAL  40 -20.747   1.223  -4.210
  282   2HG2  VAL  40          3HG2      VAL  40 -21.810   2.470  -4.869
  283   3HG2  VAL  40          2HG2      VAL  40 -21.909   0.815  -5.474
  284    H    ASN  41             H      ASN  41 -18.614  -0.979  -7.233
  285    HA   ASN  41            HA      ASN  41 -19.899  -2.762  -5.313
  286   1HB   ASN  41           2HB      ASN  41 -18.927  -2.948  -8.115
  287   2HB   ASN  41           1HB      ASN  41 -19.065  -4.411  -7.166
  288   1HD2  ASN  41          2HD2      ASN  41 -22.389  -2.958  -8.745
  289   2HD2  ASN  41          1HD2      ASN  41 -20.823  -2.593  -9.287
  290    H    ILE  42             H      ILE  42 -17.150  -1.377  -4.810
  291    HA   ILE  42            HA      ILE  42 -15.178  -3.448  -4.930
  292    HB   ILE  42            HB      ILE  42 -15.371  -0.668  -3.813
  293   1HG1  ILE  42          2HG1      ILE  42 -13.014  -1.944  -5.176
  294   2HG1  ILE  42          1HG1      ILE  42 -14.461  -1.557  -6.104
  295   1HG2  ILE  42          3HG2      ILE  42 -13.386  -2.714  -2.771
  296   2HG2  ILE  42          2HG2      ILE  42 -13.035  -0.991  -2.773
  297   3HG2  ILE  42          1HG2      ILE  42 -14.398  -1.608  -1.848
  298   1HD1  ILE  42          1HD1      ILE  42 -14.316   0.798  -5.265
  299   2HD1  ILE  42          3HD1      ILE  42 -12.802   0.382  -4.462
  300   3HD1  ILE  42          2HD1      ILE  42 -12.907   0.329  -6.227
  301    H    THR  43             H      THR  43 -15.109  -5.138  -3.684
  302    HA   THR  43            HA      THR  43 -16.338  -5.383  -0.978
  303    HB   THR  43            HB      THR  43 -15.935  -7.913  -1.726
  304    HG1  THR  43           HG1      THR  43 -14.702  -7.449  -3.541
  305   1HG2  THR  43          1HG2      THR  43 -18.001  -5.987  -2.615
  306   2HG2  THR  43          3HG2      THR  43 -18.042  -7.623  -3.277
  307   3HG2  THR  43          2HG2      THR  43 -18.162  -7.377  -1.535
  308    HA   PRO  44            HA      PRO  44 -12.265  -6.197   0.690
  309   1HB   PRO  44           2HB      PRO  44 -12.332  -8.568   1.933
  310   2HB   PRO  44           1HB      PRO  44 -12.985  -7.102   2.619
  311   1HG   PRO  44           2HG      PRO  44 -14.430  -9.419   1.422
  312   2HG   PRO  44           1HG      PRO  44 -14.985  -8.264   2.646
  313   1HD   PRO  44           2HD      PRO  44 -15.709  -8.213  -0.038
  314   2HD   PRO  44           1HD      PRO  44 -15.886  -6.849   1.065
  315    H    ALA  45             H      ALA  45 -13.320  -8.049  -1.769
  316    HA   ALA  45            HA      ALA  45 -11.057  -9.840  -2.073
  317   1HB   ALA  45           3HB      ALA  45 -13.393  -9.099  -3.818
  318   2HB   ALA  45           2HB      ALA  45 -12.128 -10.218  -4.341
  319   3HB   ALA  45           1HB      ALA  45 -13.142 -10.623  -2.959
  320    H    GLU  46             H      GLU  46 -12.438  -7.348  -4.060
  321    HA   GLU  46            HA      GLU  46 -10.095  -6.749  -5.609
  322   1HB   GLU  46           2HB      GLU  46 -11.344  -4.381  -5.795
  323   2HB   GLU  46           1HB      GLU  46 -11.915  -5.785  -6.684
  324   1HG   GLU  46           2HG      GLU  46 -12.978  -5.495  -3.944
  325   2HG   GLU  46           1HG      GLU  46 -13.436  -4.223  -5.065
  326    H    VAL  47             H      VAL  47 -11.296  -5.504  -2.553
  327    HA   VAL  47            HA      VAL  47  -9.176  -3.567  -2.294
  328    HB   VAL  47            HB      VAL  47 -11.627  -4.169  -0.855
  329   1HG1  VAL  47          1HG1      VAL  47  -9.191  -3.261   0.558
  330   2HG1  VAL  47          3HG1      VAL  47 -10.805  -2.887   1.140
  331   3HG1  VAL  47          2HG1      VAL  47 -10.258  -4.568   1.036
  332   1HG2  VAL  47          2HG2      VAL  47 -10.714  -2.105  -2.288
  333   2HG2  VAL  47          1HG2      VAL  47 -11.869  -1.865  -0.978
  334   3HG2  VAL  47          3HG2      VAL  47 -10.125  -1.575  -0.668
  335    H    GLY  48             H      GLY  48  -9.627  -6.897  -1.532
  336   1HA   GLY  48           2HA      GLY  48  -7.663  -7.210   0.525
  337   2HA   GLY  48           1HA      GLY  48  -8.170  -8.467  -0.598
  338    H    VAL  49             H      VAL  49  -7.461  -6.888  -2.934
  339    HA   VAL  49            HA      VAL  49  -4.567  -7.458  -3.002
  340    HB   VAL  49            HB      VAL  49  -5.914  -8.373  -4.841
  341   1HG1  VAL  49          1HG1      VAL  49  -6.611  -5.462  -5.290
  342   2HG1  VAL  49          3HG1      VAL  49  -6.830  -6.698  -6.529
  343   3HG1  VAL  49          2HG1      VAL  49  -7.712  -6.809  -5.006
  344   1HG2  VAL  49          3HG2      VAL  49  -3.504  -7.070  -5.080
  345   2HG2  VAL  49          2HG2      VAL  49  -4.250  -8.021  -6.361
  346   3HG2  VAL  49          1HG2      VAL  49  -4.460  -6.274  -6.331
  347    H    LEU  50             H      LEU  50  -6.741  -4.785  -3.285
  348    HA   LEU  50            HA      LEU  50  -4.815  -2.766  -3.968
  349   1HB   LEU  50           2HB      LEU  50  -7.638  -2.925  -3.254
  350   2HB   LEU  50           1HB      LEU  50  -6.870  -1.423  -2.924
  351    HG   LEU  50            HG      LEU  50  -6.891  -2.773  -5.604
  352   1HD1  LEU  50          2HD1      LEU  50  -8.645  -0.572  -4.376
  353   2HD1  LEU  50          1HD1      LEU  50  -8.578  -0.933  -6.117
  354   3HD1  LEU  50          3HD1      LEU  50  -9.176  -2.153  -4.991
  355   1HD2  LEU  50          2HD2      LEU  50  -6.114  -0.015  -4.608
  356   2HD2  LEU  50          1HD2      LEU  50  -5.043  -1.214  -5.331
  357   3HD2  LEU  50          3HD2      LEU  50  -6.277  -0.431  -6.312
  358    H    VAL  51             H      VAL  51  -5.512  -4.423  -1.096
  359    HA   VAL  51            HA      VAL  51  -3.981  -2.456   0.469
  360    HB   VAL  51            HB      VAL  51  -5.728  -1.753   1.873
  361   1HG1  VAL  51          3HG1      VAL  51  -7.199  -2.465  -0.666
  362   2HG1  VAL  51          2HG1      VAL  51  -7.842  -1.407   0.581
  363   3HG1  VAL  51          1HG1      VAL  51  -6.392  -0.941  -0.304
  364   1HG2  VAL  51          3HG2      VAL  51  -6.913  -4.463   1.400
  365   2HG2  VAL  51          2HG2      VAL  51  -6.589  -3.638   2.922
  366   3HG2  VAL  51          1HG2      VAL  51  -7.967  -3.147   1.931
  367    H    GLY  52             H      GLY  52  -5.531  -5.610   0.397
  368   1HA   GLY  52           2HA      GLY  52  -4.743  -6.701   2.864
  369   2HA   GLY  52           1HA      GLY  52  -4.899  -7.662   1.397
  370    H    LYS  53             H      LYS  53  -2.755  -6.727   3.710
  371    HA   LYS  53            HA      LYS  53  -0.349  -6.056   2.571
  372   1HB   LYS  53           2HB      LYS  53   0.790  -6.928   4.474
  373   2HB   LYS  53           1HB      LYS  53  -0.792  -6.435   5.056
  374   1HG   LYS  53           2HG      LYS  53  -0.781  -8.532   5.985
  375   2HG   LYS  53           1HG      LYS  53  -1.329  -9.014   4.383
  376   1HD   LYS  53           2HD      LYS  53   0.525 -10.449   4.945
  377   2HD   LYS  53           1HD      LYS  53   1.113  -9.300   3.740
  378   1HE   LYS  53           2HE      LYS  53   2.801  -9.057   5.291
  379   2HE   LYS  53           1HE      LYS  53   1.672  -7.880   5.953
  380   1HZ   LYS  53           3HZ      LYS  53   0.788  -9.631   7.391
  381   2HZ   LYS  53           2HZ      LYS  53   1.952 -10.712   6.792
  382   3HZ   LYS  53           1HZ      LYS  53   2.433  -9.345   7.679
  383    H    ASP  54             H      ASP  54  -1.877  -9.125   2.497
  384    HA   ASP  54            HA      ASP  54   0.304 -10.490   1.211
  385   1HB   ASP  54           2HB      ASP  54  -1.449 -11.616   2.668
  386   2HB   ASP  54           1HB      ASP  54  -2.564 -11.400   1.322
  387    NH1  ARG  55           NH2      ARG  55   0.899  -3.547  -0.017
  388    NH2  ARG  55           NH1      ARG  55  -0.921  -2.312  -0.541
  389    H    ARG  55             H      ARG  55   0.674  -9.110  -0.618
  390    HA   ARG  55            HA      ARG  55  -1.023  -9.570  -2.876
  391   1HB   ARG  55           2HB      ARG  55  -1.677  -7.188  -3.164
  392   2HB   ARG  55           1HB      ARG  55  -2.329  -7.871  -1.685
  393   1HG   ARG  55           2HG      ARG  55  -0.442  -6.913  -0.408
  394   2HG   ARG  55           1HG      ARG  55   0.200  -6.208  -1.887
  395   1HD   ARG  55           2HD      ARG  55  -1.572  -4.681  -2.084
  396   2HD   ARG  55           1HD      ARG  55  -2.623  -5.625  -1.029
  397    HE   ARG  55            HE      ARG  55  -1.418  -4.764   0.883
  398   1HH1  ARG  55          1HH2      ARG  55   1.303  -4.421   0.255
  399   2HH1  ARG  55          2HH2      ARG  55   1.483  -2.748  -0.159
  400   1HH2  ARG  55          2HH1      ARG  55  -1.910  -2.240  -0.673
  401   2HH2  ARG  55          1HH1      ARG  55  -0.340  -1.508  -0.670
  402    H    SER  56             H      SER  56   1.637 -10.189  -2.735
  403    HA   SER  56            HA      SER  56   3.211  -7.996  -3.873
  404   1HB   SER  56           2HB      SER  56   4.394  -9.290  -2.266
  405   2HB   SER  56           1HB      SER  56   3.958 -10.788  -3.068
  406    HG   SER  56            HG      SER  56   6.109 -10.082  -3.544
  407    H    SER  57             H      SER  57   1.251 -10.452  -5.071
  408    HA   SER  57            HA      SER  57   2.712 -10.936  -7.522
  409   1HB   SER  57           2HB      SER  57   0.518 -12.044  -8.184
  410   2HB   SER  57           1HB      SER  57   1.407 -12.759  -6.848
  411    HG   SER  57            HG      SER  57  -0.702 -12.507  -6.194
  412    H    PHE  58             H      PHE  58  -0.415  -9.512  -6.897
  413    HA   PHE  58            HA      PHE  58  -1.124  -8.493  -9.336
  414   1HB   PHE  58           2HB      PHE  58  -2.631  -7.096  -8.330
  415   2HB   PHE  58           1HB      PHE  58  -2.268  -8.197  -7.031
  416    HD1  PHE  58           HD2      PHE  58  -1.601  -4.847  -8.391
  417    HD2  PHE  58           HD1      PHE  58  -1.179  -7.480  -5.044
  418    HE1  PHE  58           HE2      PHE  58  -1.000  -2.973  -6.953
  419    HE2  PHE  58           HE1      PHE  58  -0.549  -5.555  -3.626
  420    HZ   PHE  58            HZ      PHE  58  -0.461  -3.285  -4.580
  421    OH   TYR  59            OH      TYR  59   2.527  -4.333  -2.626
  422    H    TYR  59             H      TYR  59   1.696  -7.194  -7.641
  423    HA   TYR  59            HA      TYR  59   1.759  -4.694  -8.928
  424   1HB   TYR  59           2HB      TYR  59   4.195  -6.261  -8.197
  425   2HB   TYR  59           1HB      TYR  59   4.103  -4.527  -8.486
  426    HD1  TYR  59           HD1      TYR  59   1.972  -3.490  -7.066
  427    HD2  TYR  59           HD2      TYR  59   4.501  -6.763  -5.917
  428    HE1  TYR  59           HE1      TYR  59   1.539  -2.999  -4.673
  429    HE2  TYR  59           HE2      TYR  59   4.061  -6.262  -3.539
  430    HH   TYR  59            HH      TYR  59   3.228  -3.759  -2.307
  431    H    VAL  60             H      VAL  60   1.993  -7.594 -10.434
  432    HA   VAL  60            HA      VAL  60   3.319  -6.427 -12.757
  433    HB   VAL  60            HB      VAL  60   3.654  -8.906 -13.321
  434   1HG1  VAL  60          3HG1      VAL  60   5.067  -7.399 -11.151
  435   2HG1  VAL  60          2HG1      VAL  60   5.674  -8.952 -11.737
  436   3HG1  VAL  60          1HG1      VAL  60   5.550  -7.581 -12.842
  437   1HG2  VAL  60          1HG2      VAL  60   2.119  -9.622 -11.382
  438   2HG2  VAL  60          3HG2      VAL  60   3.639 -10.500 -11.572
  439   3HG2  VAL  60          2HG2      VAL  60   3.495  -9.240 -10.348
  440    H    ASN  61             H      ASN  61   0.563  -8.392 -11.620
  441    HA   ASN  61            HA      ASN  61  -0.497  -8.505 -14.313
  442   1HB   ASN  61           2HB      ASN  61  -2.279  -9.869 -13.315
  443   2HB   ASN  61           1HB      ASN  61  -0.714 -10.527 -13.018
  444   1HD2  ASN  61          2HD2      ASN  61  -1.051 -10.445  -9.571
  445   2HD2  ASN  61          1HD2      ASN  61  -0.134 -10.926 -10.915
  446    H    GLY  62             H      GLY  62  -1.615  -7.207 -11.134
  447   1HA   GLY  62           2HA      GLY  62  -2.281  -4.753 -11.417
  448   2HA   GLY  62           1HA      GLY  62  -3.393  -5.369 -12.646
  449    H    LEU  63             H      LEU  63  -3.941  -3.928 -10.180
  450    HA   LEU  63            HA      LEU  63  -5.081  -5.686  -8.210
  451   1HB   LEU  63           2HB      LEU  63  -5.747  -2.748  -8.739
  452   2HB   LEU  63           1HB      LEU  63  -6.101  -3.629  -7.239
  453    HG   LEU  63            HG      LEU  63  -3.236  -3.585  -8.126
  454   1HD1  LEU  63          3HD1      LEU  63  -4.865  -1.174  -7.564
  455   2HD1  LEU  63          2HD1      LEU  63  -3.342  -1.294  -6.693
  456   3HD1  LEU  63          1HD1      LEU  63  -3.353  -1.335  -8.456
  457   1HD2  LEU  63          3HD2      LEU  63  -4.917  -3.733  -5.663
  458   2HD2  LEU  63          2HD2      LEU  63  -3.434  -4.592  -6.051
  459   3HD2  LEU  63          1HD2      LEU  63  -3.359  -2.924  -5.492
  460    H    THR  64             H      THR  64  -7.636  -4.437  -7.972
  461    HA   THR  64            HA      THR  64  -9.128  -4.806 -10.400
  462    HB   THR  64            HB      THR  64 -10.540  -6.612  -9.327
  463    HG1  THR  64           HG1      THR  64  -9.932  -7.401  -7.478
  464   1HG2  THR  64          3HG2      THR  64  -8.770  -6.926 -11.094
  465   2HG2  THR  64          2HG2      THR  64  -7.688  -7.446  -9.792
  466   3HG2  THR  64          1HG2      THR  64  -9.164  -8.360 -10.144
  467    H    LEU  65             H      LEU  65 -10.626  -3.339 -10.189
  468    HA   LEU  65            HA      LEU  65 -11.658  -2.729  -7.483
  469   1HB   LEU  65           2HB      LEU  65 -11.944  -0.331  -8.543
  470   2HB   LEU  65           1HB      LEU  65 -10.521  -0.814  -7.665
  471    HG   LEU  65            HG      LEU  65  -9.407  -1.388  -9.817
  472   1HD1  LEU  65          3HD1      LEU  65 -12.058  -0.642 -10.865
  473   2HD1  LEU  65          2HD1      LEU  65 -10.679  -0.106 -11.795
  474   3HD1  LEU  65          1HD1      LEU  65 -10.911  -1.818 -11.461
  475   1HD2  LEU  65          1HD2      LEU  65 -10.310   1.317  -9.001
  476   2HD2  LEU  65          3HD2      LEU  65  -8.676   0.701  -9.263
  477   3HD2  LEU  65          2HD2      LEU  65  -9.653   1.202 -10.640
  478    H    GLY  66             H      GLY  66 -13.540  -3.613  -7.454
  479   1HA   GLY  66           2HA      GLY  66 -15.830  -3.848  -7.854
  480   2HA   GLY  66           1HA      GLY  66 -15.676  -2.632  -9.123
  481    H    GLY  67             H      GLY  67 -13.478  -5.326  -9.123
  482   1HA   GLY  67           2HA      GLY  67 -13.521  -7.353 -10.357
  483   2HA   GLY  67           1HA      GLY  67 -15.050  -6.859 -11.081
  484    H    GLN  68             H      GLN  68 -12.698  -4.288 -11.095
  485    HA   GLN  68            HA      GLN  68 -12.188  -4.881 -14.009
  486   1HB   GLN  68           2HB      GLN  68 -13.306  -2.847 -13.936
  487   2HB   GLN  68           1HB      GLN  68 -12.433  -2.374 -12.534
  488   1HG   GLN  68           2HG      GLN  68 -11.764  -1.163 -14.700
  489   2HG   GLN  68           1HG      GLN  68 -10.441  -1.831 -13.751
  490   1HE2  GLN  68          2HE2      GLN  68  -9.345  -3.385 -16.777
  491   2HE2  GLN  68          1HE2      GLN  68  -8.990  -2.248 -15.565
  492    H    LYS  69             H      LYS  69 -10.316  -5.881 -14.224
  493    HA   LYS  69            HA      LYS  69  -8.064  -5.696 -12.474
  494   1HB   LYS  69           2HB      LYS  69  -8.855  -7.275 -14.641
  495   2HB   LYS  69           1HB      LYS  69  -7.401  -6.462 -15.218
  496   1HG   LYS  69           2HG      LYS  69  -6.042  -7.548 -13.735
  497   2HG   LYS  69           1HG      LYS  69  -7.259  -7.544 -12.458
  498   1HD   LYS  69           2HD      LYS  69  -8.105  -9.559 -13.080
  499   2HD   LYS  69           1HD      LYS  69  -7.977  -9.188 -14.799
  500   1HE   LYS  69           2HE      LYS  69  -5.420  -9.470 -14.466
  501   2HE   LYS  69           1HE      LYS  69  -5.845 -10.267 -12.951
  502   1HZ   LYS  69           2HZ      LYS  69  -7.483 -11.552 -14.541
  503   2HZ   LYS  69           1HZ      LYS  69  -6.321 -11.134 -15.708
  504   3HZ   LYS  69           3HZ      LYS  69  -5.867 -12.044 -14.351
  505    H    CYS  70             H      CYS  70  -6.935  -3.781 -12.185
  506    HA   CYS  70            HA      CYS  70  -6.138  -2.300 -14.730
  507   1HB   CYS  70           2HB      CYS  70  -5.799  -0.399 -13.061
  508   2HB   CYS  70           1HB      CYS  70  -7.422  -0.813 -13.475
  509    HG   CYS  70            HG      CYS  70  -6.905  -0.539 -10.760
  510    H    SER  71             H      SER  71  -3.923  -2.062 -14.801
  511    HA   SER  71            HA      SER  71  -2.343  -3.596 -12.908
  512   1HB   SER  71           2HB      SER  71  -0.943  -4.211 -14.578
  513   2HB   SER  71           1HB      SER  71  -2.407  -3.886 -15.470
  514    HG   SER  71            HG      SER  71  -0.027  -2.541 -15.441
  515    H    VAL  72             H      VAL  72  -1.192  -2.693 -11.496
  516    HA   VAL  72            HA      VAL  72  -0.752  -0.033 -10.928
  517    HB   VAL  72            HB      VAL  72   1.417  -2.004 -10.420
  518   1HG1  VAL  72          1HG1      VAL  72   0.994   0.576  -9.650
  519   2HG1  VAL  72          3HG1      VAL  72   0.383  -0.338  -8.284
  520   3HG1  VAL  72          2HG1      VAL  72   2.034  -0.574  -8.821
  521   1HG2  VAL  72          2HG2      VAL  72  -1.268  -1.992  -9.090
  522   2HG2  VAL  72          1HG2      VAL  72  -0.459  -3.353  -9.863
  523   3HG2  VAL  72          3HG2      VAL  72   0.171  -2.691  -8.369
  524    H    ILE  73             H      ILE  73   0.452   1.480 -11.679
  525    HA   ILE  73            HA      ILE  73   2.884   0.888 -13.166
  526    HB   ILE  73            HB      ILE  73   0.665   2.554 -14.138
  527   1HG1  ILE  73          2HG1      ILE  73   2.135   1.309 -16.220
  528   2HG1  ILE  73          1HG1      ILE  73   1.963   0.129 -14.926
  529   1HG2  ILE  73          2HG2      ILE  73   3.493   3.244 -14.380
  530   2HG2  ILE  73          1HG2      ILE  73   2.619   3.217 -15.914
  531   3HG2  ILE  73          3HG2      ILE  73   2.080   4.272 -14.607
  532   1HD1  ILE  73          3HD1      ILE  73  -0.567   1.385 -15.216
  533   2HD1  ILE  73          2HD1      ILE  73  -0.005   1.003 -16.846
  534   3HD1  ILE  73          1HD1      ILE  73  -0.136  -0.274 -15.638
  535    NH1  ARG  74           NH1      ARG  74   7.684   6.925  -7.549
  536    NH2  ARG  74           NH2      ARG  74   7.230   8.968  -8.401
  537    H    ARG  74             H      ARG  74   3.475   1.318 -10.986
  538    HA   ARG  74            HA      ARG  74   5.145   2.714  -9.858
  539   1HB   ARG  74           2HB      ARG  74   4.308   4.755 -11.291
  540   2HB   ARG  74           1HB      ARG  74   3.217   5.035  -9.934
  541   1HG   ARG  74           2HG      ARG  74   5.202   4.973  -8.408
  542   2HG   ARG  74           1HG      ARG  74   6.241   4.878  -9.830
  543   1HD   ARG  74           2HD      ARG  74   5.923   7.076 -10.370
  544   2HD   ARG  74           1HD      ARG  74   4.230   7.057  -9.871
  545    HE   ARG  74            HE      ARG  74   4.924   7.549  -7.618
  546   1HH1  ARG  74          2HH1      ARG  74   7.385   6.004  -7.301
  547   2HH1  ARG  74          1HH1      ARG  74   8.631   7.204  -7.381
  548   1HH2  ARG  74          1HH2      ARG  74   6.581   9.612  -8.806
  549   2HH2  ARG  74          2HH2      ARG  74   8.177   9.246  -8.238
  550    H    ASP  75             H      ASP  75   4.206   0.974  -8.475
  551    HA   ASP  75            HA      ASP  75   2.008   1.639  -6.816
  552   1HB   ASP  75           2HB      ASP  75   2.031  -0.635  -6.892
  553   2HB   ASP  75           1HB      ASP  75   3.752  -0.690  -7.008
  554    H    SER  76             H      SER  76   1.983   3.234  -5.504
  555    HA   SER  76            HA      SER  76   4.147   3.322  -3.444
  556   1HB   SER  76           2HB      SER  76   3.520   5.510  -5.419
  557   2HB   SER  76           1HB      SER  76   3.875   5.952  -3.757
  558    HG   SER  76            HG      SER  76   5.881   5.449  -4.068
  559    H    LEU  77             H      LEU  77   1.202   2.594  -3.724
  560    HA   LEU  77            HA      LEU  77  -0.634   4.366  -2.513
  561   1HB   LEU  77           2HB      LEU  77  -0.727   1.893  -3.445
  562   2HB   LEU  77           1HB      LEU  77  -0.616   1.471  -1.765
  563    HG   LEU  77            HG      LEU  77  -2.610   2.821  -1.336
  564   1HD1  LEU  77          1HD1      LEU  77  -2.583   3.207  -4.343
  565   2HD1  LEU  77          3HD1      LEU  77  -3.923   3.639  -3.281
  566   3HD1  LEU  77          2HD1      LEU  77  -2.400   4.472  -3.130
  567   1HD2  LEU  77          1HD2      LEU  77  -2.754   0.728  -3.510
  568   2HD2  LEU  77          3HD2      LEU  77  -2.978   0.496  -1.771
  569   3HD2  LEU  77          2HD2      LEU  77  -4.192   1.372  -2.702
  570    H    LEU  78             H      LEU  78   1.980   2.610  -0.991
  571    HA   LEU  78            HA      LEU  78   0.893   3.470   1.574
  572   1HB   LEU  78           2HB      LEU  78   3.000   1.570   0.993
  573   2HB   LEU  78           1HB      LEU  78   2.534   1.994   2.605
  574    HG   LEU  78            HG      LEU  78   0.564   0.972   0.527
  575   1HD1  LEU  78          1HD1      LEU  78   2.265  -0.782   0.992
  576   2HD1  LEU  78          3HD1      LEU  78   1.880  -0.658   2.710
  577   3HD1  LEU  78          2HD1      LEU  78   0.644  -1.224   1.567
  578   1HD2  LEU  78          3HD2      LEU  78  -0.272   2.271   2.535
  579   2HD2  LEU  78          2HD2      LEU  78  -0.916   0.638   2.404
  580   3HD2  LEU  78          1HD2      LEU  78   0.374   0.988   3.555
  581    H    GLN  79             H      GLN  79   1.584   5.184   2.458
  582    HA   GLN  79            HA      GLN  79   2.888   7.195   1.442
  583   1HB   GLN  79           2HB      GLN  79   2.854   8.242   3.641
  584   2HB   GLN  79           1HB      GLN  79   1.360   7.342   3.385
  585   1HG   GLN  79           2HG      GLN  79   3.258   5.537   4.536
  586   2HG   GLN  79           1HG      GLN  79   3.291   7.022   5.488
  587   1HE2  GLN  79          2HE2      GLN  79   0.467   5.819   7.206
  588   2HE2  GLN  79          1HE2      GLN  79   2.075   6.355   7.298
  589    H    ASP  80             H      ASP  80   4.624   6.276   0.546
  590    HA   ASP  80            HA      ASP  80   7.098   6.191   2.232
  591   1HB   ASP  80           2HB      ASP  80   6.703   4.329   0.500
  592   2HB   ASP  80           1HB      ASP  80   6.812   5.574  -0.742
  593    H    GLY  81             H      GLY  81   5.232   8.508   1.499
  594   1HA   GLY  81           2HA      GLY  81   5.747  10.810   1.203
  595   2HA   GLY  81           1HA      GLY  81   7.176  10.334   0.270
  596    H    GLU  82             H      GLU  82   4.024   8.732  -0.219
  597    HA   GLU  82            HA      GLU  82   3.436  10.215  -2.644
  598   1HB   GLU  82           2HB      GLU  82   4.645   7.554  -2.514
  599   2HB   GLU  82           1HB      GLU  82   3.409   7.830  -3.692
  600   1HG   GLU  82           2HG      GLU  82   5.139   8.482  -4.987
  601   2HG   GLU  82           1HG      GLU  82   4.886  10.022  -4.141
  602    H    PHE  83             H      PHE  83   2.597   7.059  -1.213
  603    HA   PHE  83            HA      PHE  83   0.606   5.880  -1.110
  604   1HB   PHE  83           2HB      PHE  83  -1.503   7.569  -0.925
  605   2HB   PHE  83           1HB      PHE  83  -0.660   6.808   0.372
  606    HD1  PHE  83           HD1      PHE  83   1.165   8.043   1.557
  607    HD2  PHE  83           HD2      PHE  83  -1.364   9.942  -1.313
  608    HE1  PHE  83           HE1      PHE  83   1.854  10.262   2.440
  609    HE2  PHE  83           HE2      PHE  83  -0.687  12.167  -0.451
  610    HZ   PHE  83            HZ      PHE  83   0.926  12.328   1.431
  611    H    SER  84             H      SER  84   1.254   7.572  -3.884
  612    HA   SER  84            HA      SER  84  -1.416   7.112  -5.096
  613   1HB   SER  84           2HB      SER  84  -0.363   8.396  -7.032
  614   2HB   SER  84           1HB      SER  84  -0.629   9.310  -5.542
  615    HG   SER  84            HG      SER  84   1.474   9.650  -6.345
  616    H    MET  85             H      MET  85  -1.712   5.788  -6.780
  617    HA   MET  85            HA      MET  85   0.576   4.066  -7.709
  618   1HB   MET  85           2HB      MET  85  -0.969   3.213  -5.784
  619   2HB   MET  85           1HB      MET  85  -2.104   2.986  -7.066
  620   1HG   MET  85           2HG      MET  85  -1.084   1.162  -7.813
  621   2HG   MET  85           1HG      MET  85   0.477   1.924  -7.732
  622   1HE   MET  85           3HE      MET  85  -1.550  -0.541  -6.959
  623   2HE   MET  85           2HE      MET  85   0.019  -1.354  -6.618
  624   3HE   MET  85           1HE      MET  85  -1.215  -1.212  -5.337
  625    H    ASP  86             H      ASP  86   0.561   3.996 -10.013
  626    HA   ASP  86            HA      ASP  86  -1.927   4.966 -11.349
  627   1HB   ASP  86           2HB      ASP  86   0.876   4.577 -12.067
  628   2HB   ASP  86           1HB      ASP  86  -0.296   4.476 -13.349
  629    H    LEU  87             H      LEU  87  -3.137   2.932 -10.753
  630    HA   LEU  87            HA      LEU  87  -2.315   0.623 -12.362
  631   1HB   LEU  87           2HB      LEU  87  -4.551  -0.359 -11.276
  632   2HB   LEU  87           1HB      LEU  87  -3.003  -0.459 -10.507
  633    HG   LEU  87            HG      LEU  87  -4.762   0.195  -8.949
  634   1HD1  LEU  87          1HD1      LEU  87  -2.312   1.558  -9.319
  635   2HD1  LEU  87          3HD1      LEU  87  -3.504   2.676  -8.659
  636   3HD1  LEU  87          2HD1      LEU  87  -3.157   1.166  -7.826
  637   1HD2  LEU  87          1HD2      LEU  87  -5.921   1.545 -10.898
  638   2HD2  LEU  87          3HD2      LEU  87  -6.162   1.996  -9.218
  639   3HD2  LEU  87          2HD2      LEU  87  -5.008   2.881 -10.204
  640    NH1  ARG  88           NH1      ARG  88   0.150   3.724 -19.073
  641    NH2  ARG  88           NH2      ARG  88   0.383   2.166 -20.697
  642    H    ARG  88             H      ARG  88  -2.896   0.485 -14.314
  643    HA   ARG  88            HA      ARG  88  -5.430   1.895 -15.141
  644   1HB   ARG  88           2HB      ARG  88  -4.373   2.801 -17.034
  645   2HB   ARG  88           1HB      ARG  88  -3.043   2.796 -15.890
  646   1HG   ARG  88           2HG      ARG  88  -2.059   0.837 -16.933
  647   2HG   ARG  88           1HG      ARG  88  -3.481   0.496 -17.915
  648   1HD   ARG  88           2HD      ARG  88  -2.964   2.106 -19.433
  649   2HD   ARG  88           1HD      ARG  88  -2.310   3.210 -18.205
  650    HE   ARG  88            HE      ARG  88  -0.643   0.864 -18.671
  651   1HH1  ARG  88          2HH1      ARG  88  -0.239   4.012 -18.198
  652   2HH1  ARG  88          1HH1      ARG  88   0.762   4.334 -19.574
  653   1HH2  ARG  88          1HH2      ARG  88   0.170   1.261 -21.066
  654   2HH2  ARG  88          2HH2      ARG  88   1.001   2.778 -21.194
  655    H    THR  89             H      THR  89  -6.821   0.910 -16.535
  656    HA   THR  89            HA      THR  89  -6.833  -1.928 -16.782
  657    HB   THR  89            HB      THR  89  -8.731  -1.627 -18.117
  658    HG1  THR  89           HG1      THR  89  -8.556  -0.453 -19.782
  659   1HG2  THR  89          2HG2      THR  89  -8.564  -0.112 -15.843
  660   2HG2  THR  89          1HG2      THR  89  -9.166   1.042 -17.046
  661   3HG2  THR  89          3HG2      THR  89 -10.059  -0.452 -16.714
  662    H    LYS  90             H      LYS  90  -5.055  -2.851 -17.859
  663    HA   LYS  90            HA      LYS  90  -4.070  -1.561 -20.241
  664   1HB   LYS  90           2HB      LYS  90  -2.790  -4.069 -19.322
  665   2HB   LYS  90           1HB      LYS  90  -2.121  -2.593 -19.944
  666   1HG   LYS  90           2HG      LYS  90  -3.262  -2.144 -17.370
  667   2HG   LYS  90           1HG      LYS  90  -2.030  -3.371 -17.336
  668   1HD   LYS  90           2HD      LYS  90  -1.559  -0.825 -18.857
  669   2HD   LYS  90           1HD      LYS  90  -1.277  -0.884 -17.126
  670   1HE   LYS  90           2HE      LYS  90   0.233  -2.836 -17.456
  671   2HE   LYS  90           1HE      LYS  90  -0.007  -2.694 -19.195
  672   1HZ   LYS  90           3HZ      LYS  90   0.828  -0.364 -18.968
  673   2HZ   LYS  90           2HZ      LYS  90   1.282  -0.744 -17.377
  674   3HZ   LYS  90           1HZ      LYS  90   1.979  -1.569 -18.685
  675    H    SER  91             H      SER  91  -4.170  -2.523 -22.187
  676    HA   SER  91            HA      SER  91  -5.820  -4.985 -22.433
  677   1HB   SER  91           2HB      SER  91  -6.841  -2.744 -23.134
  678   2HB   SER  91           1HB      SER  91  -5.771  -2.795 -24.494
  679    HG   SER  91            HG      SER  91  -7.603  -4.828 -23.702
  680    H    THR  92             H      THR  92  -5.516  -5.425 -25.103
  681    HA   THR  92            HA      THR  92  -2.824  -6.584 -25.111
  682    HB   THR  92            HB      THR  92  -3.588  -7.904 -26.973
  683    HG1  THR  92           HG1      THR  92  -5.574  -7.383 -27.991
  684   1HG2  THR  92          2HG2      THR  92  -5.174  -7.608 -24.554
  685   2HG2  THR  92          1HG2      THR  92  -6.210  -8.073 -25.911
  686   3HG2  THR  92          3HG2      THR  92  -4.822  -9.075 -25.483
  687    H    GLY  93             H      GLY  93  -2.107  -6.703 -27.732
  688   1HA   GLY  93           2HA      GLY  93  -0.910  -4.116 -28.213
  689   2HA   GLY  93           1HA      GLY  93  -0.703  -5.557 -29.206
  690    H    GLY  94             H      GLY  94  -2.235  -2.574 -28.931
  691   1HA   GLY  94           2HA      GLY  94  -3.200  -1.453 -30.875
  692   2HA   GLY  94           1HA      GLY  94  -3.735  -3.022 -31.466
  693    H    ALA  95             H      ALA  95  -4.273  -2.711 -28.107
  694    HA   ALA  95            HA      ALA  95  -7.188  -2.254 -28.572
  695   1HB   ALA  95           1HB      ALA  95  -5.572  -3.613 -26.439
  696   2HB   ALA  95           3HB      ALA  95  -7.163  -2.963 -26.040
  697   3HB   ALA  95           2HB      ALA  95  -6.997  -4.194 -27.303
  698    HA   PRO  96            HA      PRO  96  -7.030   1.525 -26.367
  699   1HB   PRO  96           2HB      PRO  96  -9.594   1.675 -25.529
  700   2HB   PRO  96           1HB      PRO  96  -9.161   1.791 -27.247
  701   1HG   PRO  96           2HG      PRO  96 -10.461  -0.481 -25.804
  702   2HG   PRO  96           1HG      PRO  96 -10.516  -0.078 -27.524
  703   1HD   PRO  96           2HD      PRO  96  -8.880  -2.053 -26.286
  704   2HD   PRO  96           1HD      PRO  96  -8.868  -1.533 -27.986
  705    H    THR  97             H      THR  97  -6.247   1.949 -24.357
  706    HA   THR  97            HA      THR  97  -6.999   0.126 -22.064
  707    HB   THR  97            HB      THR  97  -5.010   1.258 -20.966
  708    HG1  THR  97           HG1      THR  97  -4.419   2.149 -23.592
  709   1HG2  THR  97          1HG2      THR  97  -5.132  -0.882 -22.642
  710   2HG2  THR  97          3HG2      THR  97  -3.924   0.114 -23.469
  711   3HG2  THR  97          2HG2      THR  97  -3.661  -0.371 -21.792
  712    H    PHE  98             H      PHE  98  -6.834   1.497 -19.944
  713    HA   PHE  98            HA      PHE  98  -7.927   4.234 -20.022
  714   1HB   PHE  98           2HB      PHE  98  -9.521   1.777 -19.117
  715   2HB   PHE  98           1HB      PHE  98  -9.982   3.410 -18.781
  716    HD1  PHE  98           HD1      PHE  98  -9.807   5.059 -20.962
  717    HD2  PHE  98           HD2      PHE  98 -10.577   0.843 -21.033
  718    HE1  PHE  98           HE1      PHE  98 -10.845   5.367 -23.172
  719    HE2  PHE  98           HE2      PHE  98 -11.608   1.086 -23.297
  720    HZ   PHE  98            HZ      PHE  98 -11.746   3.339 -24.351
  721    H    ASN  99             H      ASN  99  -7.583   5.256 -17.757
  722    HA   ASN  99            HA      ASN  99  -5.916   3.426 -16.102
  723   1HB   ASN  99           2HB      ASN  99  -5.130   6.317 -16.304
  724   2HB   ASN  99           1HB      ASN  99  -4.144   4.936 -15.826
  725   1HD2  ASN  99          2HD2      ASN  99  -2.741   5.289 -19.069
  726   2HD2  ASN  99          1HD2      ASN  99  -2.522   5.613 -17.418
  727    H    VAL 100             H      VAL 100  -5.339   4.356 -13.949
  728    HA   VAL 100            HA      VAL 100  -7.391   5.980 -12.634
  729    HB   VAL 100            HB      VAL 100  -6.698   3.184 -11.665
  730   1HG1  VAL 100          1HG1      VAL 100  -7.618   5.200 -10.240
  731   2HG1  VAL 100          3HG1      VAL 100  -9.154   4.701 -10.934
  732   3HG1  VAL 100          2HG1      VAL 100  -8.208   3.561  -9.988
  733   1HG2  VAL 100          1HG2      VAL 100  -9.109   4.112 -13.289
  734   2HG2  VAL 100          3HG2      VAL 100  -7.924   2.893 -13.765
  735   3HG2  VAL 100          2HG2      VAL 100  -9.034   2.573 -12.432
  736    H    THR 101             H      THR 101  -6.481   6.850 -10.736
  737    HA   THR 101            HA      THR 101  -3.771   5.934  -9.974
  738    HB   THR 101            HB      THR 101  -4.913   8.767  -9.801
  739    HG1  THR 101           HG1      THR 101  -2.738   7.752 -11.309
  740   1HG2  THR 101          1HG2      THR 101  -2.822   7.424  -8.334
  741   2HG2  THR 101          3HG2      THR 101  -2.117   8.688  -9.342
  742   3HG2  THR 101          2HG2      THR 101  -3.386   9.084  -8.187
  743    H    VAL 102             H      VAL 102  -3.843   5.199  -7.960
  744    HA   VAL 102            HA      VAL 102  -6.248   5.716  -6.350
  745    HB   VAL 102            HB      VAL 102  -4.618   3.281  -7.032
  746   1HG1  VAL 102          3HG1      VAL 102  -5.754   3.857  -4.346
  747   2HG1  VAL 102          2HG1      VAL 102  -6.294   2.337  -5.054
  748   3HG1  VAL 102          1HG1      VAL 102  -4.586   2.634  -4.835
  749   1HG2  VAL 102          2HG2      VAL 102  -7.524   3.992  -6.840
  750   2HG2  VAL 102          1HG2      VAL 102  -6.588   3.646  -8.274
  751   3HG2  VAL 102          3HG2      VAL 102  -6.960   2.358  -7.139
  752    H    THR 103             H      THR 103  -5.919   6.780  -4.505
  753    HA   THR 103            HA      THR 103  -3.206   6.974  -3.353
  754    HB   THR 103            HB      THR 103  -4.108   9.083  -2.254
  755    HG1  THR 103           HG1      THR 103  -5.871   9.984  -3.432
  756   1HG2  THR 103          3HG2      THR 103  -3.345   8.662  -5.078
  757   2HG2  THR 103          2HG2      THR 103  -4.131  10.217  -4.747
  758   3HG2  THR 103          1HG2      THR 103  -2.654   9.750  -3.868
  759    H    LYS 104             H      LYS 104  -2.941   6.094  -1.317
  760    HA   LYS 104            HA      LYS 104  -5.418   5.462   0.234
  761   1HB   LYS 104           2HB      LYS 104  -4.232   3.437  -0.344
  762   2HB   LYS 104           1HB      LYS 104  -2.700   4.120   0.159
  763   1HG   LYS 104           2HG      LYS 104  -3.052   3.057   2.140
  764   2HG   LYS 104           1HG      LYS 104  -4.236   4.309   2.478
  765   1HD   LYS 104           2HD      LYS 104  -5.308   2.191   2.799
  766   2HD   LYS 104           1HD      LYS 104  -5.958   2.886   1.326
  767   1HE   LYS 104           2HE      LYS 104  -5.421   0.500   0.996
  768   2HE   LYS 104           1HE      LYS 104  -4.384   1.505  -0.009
  769   1HZ   LYS 104           2HZ      LYS 104  -3.336   0.963   2.641
  770   2HZ   LYS 104           1HZ      LYS 104  -3.494  -0.410   1.653
  771   3HZ   LYS 104           3HZ      LYS 104  -2.561   0.905   1.129
  772    H    THR 105             H      THR 105  -5.638   6.283   2.203
  773    HA   THR 105            HA      THR 105  -3.589   8.189   3.205
  774    HB   THR 105            HB      THR 105  -5.381   8.959   4.701
  775    HG1  THR 105           HG1      THR 105  -7.249   7.903   4.857
  776   1HG2  THR 105          3HG2      THR 105  -5.461   9.087   1.873
  777   2HG2  THR 105          2HG2      THR 105  -7.124   8.840   2.409
  778   3HG2  THR 105          1HG2      THR 105  -6.195  10.209   3.019
  779    H    ASP 106             H      ASP 106  -4.751   7.698   6.045
  780    HA   ASP 106            HA      ASP 106  -2.983   5.422   6.686
  781   1HB   ASP 106           2HB      ASP 106  -2.780   7.602   7.918
  782   2HB   ASP 106           1HB      ASP 106  -4.396   7.321   8.577
  783    H    LYS 107             H      LYS 107  -6.385   6.236   6.452
  784    HA   LYS 107            HA      LYS 107  -7.061   3.481   7.299
  785   1HB   LYS 107           2HB      LYS 107  -8.687   5.725   8.505
  786   2HB   LYS 107           1HB      LYS 107  -8.597   4.039   9.003
  787   1HG   LYS 107           2HG      LYS 107  -6.282   4.361   9.762
  788   2HG   LYS 107           1HG      LYS 107  -6.321   6.036   9.213
  789   1HD   LYS 107           2HD      LYS 107  -8.317   6.353  10.784
  790   2HD   LYS 107           1HD      LYS 107  -7.888   4.788  11.477
  791   1HE   LYS 107           2HE      LYS 107  -5.452   5.957  11.496
  792   2HE   LYS 107           1HE      LYS 107  -6.465   7.391  11.666
  793   1HZ   LYS 107           3HZ      LYS 107  -7.659   5.968  13.437
  794   2HZ   LYS 107           2HZ      LYS 107  -6.219   5.069  13.453
  795   3HZ   LYS 107           1HZ      LYS 107  -6.195   6.726  13.832
  796    H    THR 108             H      THR 108  -7.177   5.194   4.747
  797    HA   THR 108            HA      THR 108  -9.951   4.419   3.987
  798    HB   THR 108            HB      THR 108 -10.518   6.516   3.060
  799    HG1  THR 108           HG1      THR 108  -8.809   7.248   2.012
  800   1HG2  THR 108          3HG2      THR 108 -10.530   6.424   5.570
  801   2HG2  THR 108          2HG2      THR 108  -8.951   7.215   5.558
  802   3HG2  THR 108          1HG2      THR 108 -10.364   8.061   4.922
  803    H    LEU 109             H      LEU 109 -10.080   4.257   1.596
  804    HA   LEU 109            HA      LEU 109  -7.474   3.782   0.240
  805   1HB   LEU 109           2HB      LEU 109  -9.163   1.846   1.063
  806   2HB   LEU 109           1HB      LEU 109  -9.904   2.168  -0.474
  807    HG   LEU 109            HG      LEU 109  -7.528   0.614   0.149
  808   1HD1  LEU 109          3HD1      LEU 109  -9.695   0.273  -1.341
  809   2HD1  LEU 109          2HD1      LEU 109  -8.618   0.874  -2.601
  810   3HD1  LEU 109          1HD1      LEU 109  -8.183  -0.567  -1.681
  811   1HD2  LEU 109          3HD2      LEU 109  -7.262   2.790  -1.890
  812   2HD2  LEU 109          2HD2      LEU 109  -6.206   2.433  -0.537
  813   3HD2  LEU 109          1HD2      LEU 109  -6.286   1.328  -1.900
  814    H    VAL 110             H      VAL 110  -7.782   6.032  -0.805
  815    HA   VAL 110            HA      VAL 110 -10.257   6.503  -2.259
  816    HB   VAL 110            HB      VAL 110  -7.733   8.100  -1.723
  817   1HG1  VAL 110          2HG1      VAL 110  -9.570   8.448  -4.069
  818   2HG1  VAL 110          1HG1      VAL 110  -8.868   9.873  -3.304
  819   3HG1  VAL 110          3HG1      VAL 110  -7.833   8.634  -4.004
  820   1HG2  VAL 110          3HG2      VAL 110 -10.693   8.359  -1.289
  821   2HG2  VAL 110          2HG2      VAL 110  -9.362   8.689  -0.176
  822   3HG2  VAL 110          1HG2      VAL 110  -9.749   9.853  -1.459
  823    H    LEU 111             H      LEU 111 -10.465   6.471  -4.442
  824    HA   LEU 111            HA      LEU 111  -8.184   5.534  -6.039
  825   1HB   LEU 111           2HB      LEU 111 -11.003   4.651  -6.695
  826   2HB   LEU 111           1HB      LEU 111  -9.490   3.974  -7.278
  827    HG   LEU 111            HG      LEU 111 -10.567   3.721  -4.469
  828   1HD1  LEU 111          2HD1      LEU 111 -11.342   2.307  -6.676
  829   2HD1  LEU 111          1HD1      LEU 111 -10.011   1.303  -6.077
  830   3HD1  LEU 111          3HD1      LEU 111 -11.392   1.673  -5.033
  831   1HD2  LEU 111          2HD2      LEU 111  -8.008   3.798  -4.910
  832   2HD2  LEU 111          1HD2      LEU 111  -8.687   2.601  -3.822
  833   3HD2  LEU 111          3HD2      LEU 111  -8.276   2.150  -5.477
  834    H    LEU 112             H      LEU 112  -8.349   6.279  -8.239
  835    HA   LEU 112            HA      LEU 112 -10.273   8.453  -8.693
  836   1HB   LEU 112           2HB      LEU 112  -7.885   9.190  -7.997
  837   2HB   LEU 112           1HB      LEU 112  -7.401   8.617  -9.557
  838    HG   LEU 112            HG      LEU 112  -7.721  10.871 -10.017
  839   1HD1  LEU 112          3HD1      LEU 112 -10.463   9.627 -10.456
  840   2HD1  LEU 112          2HD1      LEU 112 -10.049  11.260 -11.000
  841   3HD1  LEU 112          1HD1      LEU 112  -9.171   9.876 -11.655
  842   1HD2  LEU 112          2HD2      LEU 112  -9.779  10.716  -7.864
  843   2HD2  LEU 112          1HD2      LEU 112  -8.333  11.724  -7.965
  844   3HD2  LEU 112          3HD2      LEU 112  -9.735  12.094  -8.968
  845    H    MET 113             H      MET 113 -11.412   7.358 -10.213
  846    HA   MET 113            HA      MET 113  -9.821   5.941 -12.291
  847   1HB   MET 113           2HB      MET 113 -12.110   5.160 -11.214
  848   2HB   MET 113           1HB      MET 113 -12.764   6.182 -12.488
  849   1HG   MET 113           2HG      MET 113 -11.022   4.942 -13.981
  850   2HG   MET 113           1HG      MET 113 -11.099   3.733 -12.749
  851   1HE   MET 113           3HE      MET 113 -11.754   1.999 -13.654
  852   2HE   MET 113           2HE      MET 113 -13.370   1.546 -14.183
  853   3HE   MET 113           1HE      MET 113 -12.237   2.238 -15.341
  854    H    GLY 114             H      GLY 114  -9.868   6.504 -14.411
  855   1HA   GLY 114           2HA      GLY 114 -11.347   8.662 -15.491
  856   2HA   GLY 114           1HA      GLY 114  -9.815   9.260 -14.957
  857    H    LYS 115             H      LYS 115 -11.386   8.114 -17.639
  858    HA   LYS 115            HA      LYS 115  -8.972   7.850 -18.855
  859   1HB   LYS 115           2HB      LYS 115 -10.662   5.540 -19.272
  860   2HB   LYS 115           1HB      LYS 115  -8.928   5.578 -19.279
  861   1HG   LYS 115           2HG      LYS 115  -9.477   4.232 -17.384
  862   2HG   LYS 115           1HG      LYS 115  -9.219   5.749 -16.681
  863   1HD   LYS 115           2HD      LYS 115 -11.268   5.308 -15.742
  864   2HD   LYS 115           1HD      LYS 115 -11.806   6.080 -17.206
  865   1HE   LYS 115           2HE      LYS 115 -11.262   3.146 -17.241
  866   2HE   LYS 115           1HE      LYS 115 -12.773   3.733 -16.544
  867   1HZ   LYS 115           1HZ      LYS 115 -12.813   5.136 -18.740
  868   2HZ   LYS 115           3HZ      LYS 115 -11.827   3.885 -19.310
  869   3HZ   LYS 115           2HZ      LYS 115 -13.373   3.533 -18.716
  870    H    GLU 116             H      GLU 116  -9.125   8.954 -20.664
  871    HA   GLU 116            HA      GLU 116 -11.022   7.955 -22.699
  872   1HB   GLU 116           2HB      GLU 116 -10.898  10.474 -21.929
  873   2HB   GLU 116           1HB      GLU 116  -9.560  10.465 -23.012
  874   1HG   GLU 116           2HG      GLU 116 -10.991   9.583 -24.822
  875   2HG   GLU 116           1HG      GLU 116 -12.373   9.650 -23.725
  876    H    GLY 117             H      GLY 117  -9.107   6.144 -23.042
  877   1HA   GLY 117           2HA      GLY 117  -6.851   5.574 -23.763
  878   2HA   GLY 117           1HA      GLY 117  -6.900   7.106 -24.651
  879    H    VAL 118             H      VAL 118  -7.447   7.963 -21.394
  880    HA   VAL 118            HA      VAL 118  -5.808   9.788 -20.716
  881    HB   VAL 118            HB      VAL 118  -7.614   9.028 -19.356
  882   1HG1  VAL 118          3HG1      VAL 118  -6.515   6.525 -19.650
  883   2HG1  VAL 118          2HG1      VAL 118  -5.969   6.927 -18.034
  884   3HG1  VAL 118          1HG1      VAL 118  -7.650   6.950 -18.400
  885   1HG2  VAL 118          3HG2      VAL 118  -5.084   9.930 -18.320
  886   2HG2  VAL 118          2HG2      VAL 118  -6.643  10.042 -17.528
  887   3HG2  VAL 118          1HG2      VAL 118  -5.589   8.642 -17.205
  888    H    HIS 119             H      HIS 119  -3.981  10.220 -19.928
  889    HA   HIS 119            HA      HIS 119  -1.670   8.537 -20.396
  890   1HB   HIS 119           2HB      HIS 119  -1.891  11.098 -20.575
  891   2HB   HIS 119           1HB      HIS 119  -1.689  11.109 -18.824
  892    HD1  HIS 119           HD1      HIS 119   0.221  11.202 -21.881
  893    HD2  HIS 119           HD2      HIS 119   0.831   9.585 -18.086
  894    HE1  HIS 119           HE1      HIS 119   2.715  10.797 -21.664
  895    H    GLY 120             H      GLY 120  -3.042  10.088 -17.434
  896   1HA   GLY 120           2HA      GLY 120  -3.423   8.558 -15.447
  897   2HA   GLY 120           1HA      GLY 120  -1.850   7.857 -15.812
  898    H    GLY 121             H      GLY 121  -1.135  10.940 -16.438
  899   1HA   GLY 121           2HA      GLY 121  -0.010  11.413 -13.744
  900   2HA   GLY 121           1HA      GLY 121   0.345  12.354 -15.190
  901    H    LEU 122             H      LEU 122  -2.589  12.697 -15.730
  902    HA   LEU 122            HA      LEU 122  -3.034  15.151 -14.159
  903   1HB   LEU 122           2HB      LEU 122  -5.134  13.871 -15.907
  904   2HB   LEU 122           1HB      LEU 122  -4.842  15.580 -15.613
  905    HG   LEU 122            HG      LEU 122  -2.550  14.276 -16.886
  906   1HD1  LEU 122          3HD1      LEU 122  -5.254  13.763 -17.928
  907   2HD1  LEU 122          2HD1      LEU 122  -4.130  14.439 -19.111
  908   3HD1  LEU 122          1HD1      LEU 122  -3.732  12.937 -18.276
  909   1HD2  LEU 122          2HD2      LEU 122  -2.882  16.717 -16.678
  910   2HD2  LEU 122          1HD2      LEU 122  -2.751  16.223 -18.372
  911   3HD2  LEU 122          3HD2      LEU 122  -4.332  16.587 -17.682
  912    H    ILE 123             H      ILE 123  -4.388  11.937 -14.426
  913    HA   ILE 123            HA      ILE 123  -6.446  12.368 -12.430
  914    HB   ILE 123            HB      ILE 123  -5.140  10.019 -13.724
  915   1HG1  ILE 123          2HG1      ILE 123  -8.009  11.020 -13.811
  916   2HG1  ILE 123          1HG1      ILE 123  -6.771  11.491 -14.979
  917   1HG2  ILE 123          2HG2      ILE 123  -6.545   9.942 -11.217
  918   2HG2  ILE 123          1HG2      ILE 123  -7.530   9.151 -12.430
  919   3HG2  ILE 123          3HG2      ILE 123  -5.891   8.596 -12.127
  920   1HD1  ILE 123          3HD1      ILE 123  -6.408   9.088 -15.462
  921   2HD1  ILE 123          2HD1      ILE 123  -7.768   8.707 -14.414
  922   3HD1  ILE 123          1HD1      ILE 123  -8.021   9.657 -15.878
  923    H    ASN 124             H      ASN 124  -3.047  11.385 -12.517
  924    HA   ASN 124            HA      ASN 124  -2.790  10.537  -9.794
  925   1HB   ASN 124           2HB      ASN 124  -1.084  10.147 -11.609
  926   2HB   ASN 124           1HB      ASN 124  -0.695  11.865 -11.522
  927   1HD2  ASN 124          2HD2      ASN 124   1.368   9.590  -9.128
  928   2HD2  ASN 124          1HD2      ASN 124   0.809   9.232 -10.691
  929    H    LYS 125             H      LYS 125  -3.002  13.593 -11.459
  930    HA   LYS 125            HA      LYS 125  -2.024  15.252  -9.163
  931   1HB   LYS 125           2HB      LYS 125  -3.390  15.824 -11.844
  932   2HB   LYS 125           1HB      LYS 125  -3.182  17.099 -10.639
  933   1HG   LYS 125           2HG      LYS 125  -0.776  15.472 -11.208
  934   2HG   LYS 125           1HG      LYS 125  -1.344  16.478 -12.549
  935   1HD   LYS 125           2HD      LYS 125  -1.538  18.204 -10.393
  936   2HD   LYS 125           1HD      LYS 125  -0.091  17.276  -9.998
  937   1HE   LYS 125           2HE      LYS 125  -0.548  18.547 -12.711
  938   2HE   LYS 125           1HE      LYS 125   0.325  19.348 -11.404
  939   1HZ   LYS 125           2HZ      LYS 125   1.199  16.639 -11.945
  940   2HZ   LYS 125           1HZ      LYS 125   1.455  17.725 -13.225
  941   3HZ   LYS 125           3HZ      LYS 125   2.113  18.052 -11.698
  942    H    LYS 126             H      LYS 126  -5.177  14.280 -10.552
  943    HA   LYS 126            HA      LYS 126  -6.738  15.798  -8.602
  944   1HB   LYS 126           2HB      LYS 126  -7.350  13.987 -10.896
  945   2HB   LYS 126           1HB      LYS 126  -8.615  14.343  -9.718
  946   1HG   LYS 126           2HG      LYS 126  -8.940  16.158 -11.090
  947   2HG   LYS 126           1HG      LYS 126  -7.677  16.843 -10.087
  948   1HD   LYS 126           2HD      LYS 126  -7.087  17.222 -12.403
  949   2HD   LYS 126           1HD      LYS 126  -5.998  16.003 -11.746
  950   1HE   LYS 126           2HE      LYS 126  -6.993  14.269 -12.938
  951   2HE   LYS 126           1HE      LYS 126  -8.536  15.112 -13.073
  952   1HZ   LYS 126           2HZ      LYS 126  -6.172  16.282 -14.358
  953   2HZ   LYS 126           1HZ      LYS 126  -6.924  14.952 -15.103
  954   3HZ   LYS 126           3HZ      LYS 126  -7.805  16.372 -14.814
  955    H    CYS 127             H      CYS 127  -5.162  12.808  -8.502
  956    HA   CYS 127            HA      CYS 127  -7.008  11.531  -6.557
  957   1HB   CYS 127           2HB      CYS 127  -5.518  10.268  -8.331
  958   2HB   CYS 127           1HB      CYS 127  -4.242  10.521  -7.161
  959    HG   CYS 127            HG      CYS 127  -6.718   9.340  -5.861
  960    OH   TYR 128            OH      TYR 128   2.549  15.453  -2.813
  961    H    TYR 128             H      TYR 128  -3.981  13.194  -6.899
  962    HA   TYR 128            HA      TYR 128  -2.987  12.952  -4.232
  963   1HB   TYR 128           2HB      TYR 128  -1.971  13.789  -6.554
  964   2HB   TYR 128           1HB      TYR 128  -2.609  15.343  -6.066
  965    HD1  TYR 128           HD1      TYR 128  -1.437  13.302  -3.259
  966    HD2  TYR 128           HD2      TYR 128  -0.258  16.029  -6.381
  967    HE1  TYR 128           HE1      TYR 128   0.652  13.782  -2.029
  968    HE2  TYR 128           HE2      TYR 128   1.842  16.518  -5.125
  969    HH   TYR 128            HH      TYR 128   2.343  15.488  -1.876
  970    H    GLU 129             H      GLU 129  -5.295  15.087  -5.908
  971    HA   GLU 129            HA      GLU 129  -5.629  16.937  -3.620
  972   1HB   GLU 129           2HB      GLU 129  -7.366  16.615  -6.086
  973   2HB   GLU 129           1HB      GLU 129  -7.325  18.003  -4.998
  974   1HG   GLU 129           2HG      GLU 129  -4.674  17.291  -6.066
  975   2HG   GLU 129           1HG      GLU 129  -5.829  17.756  -7.314
  976    H    MET 130             H      MET 130  -7.447  14.245  -5.072
  977    HA   MET 130            HA      MET 130  -9.839  14.343  -3.516
  978   1HB   MET 130           2HB      MET 130  -8.942  12.757  -5.536
  979   2HB   MET 130           1HB      MET 130  -8.610  11.676  -4.192
  980   1HG   MET 130           2HG      MET 130 -11.062  12.099  -3.476
  981   2HG   MET 130           1HG      MET 130 -11.284  12.782  -5.106
  982   1HE   MET 130           3HE      MET 130 -12.932  10.872  -4.013
  983   2HE   MET 130           2HE      MET 130 -13.206  10.577  -5.727
  984   3HE   MET 130           1HE      MET 130 -12.885   9.220  -4.651
  985    H    ALA 131             H      ALA 131  -6.742  12.713  -2.939
  986    HA   ALA 131            HA      ALA 131  -7.391  11.791  -0.246
  987   1HB   ALA 131           1HB      ALA 131  -4.845  11.807  -1.937
  988   2HB   ALA 131           3HB      ALA 131  -4.891  11.236  -0.249
  989   3HB   ALA 131           2HB      ALA 131  -5.861  10.417  -1.473
  990    H    SER 132             H      SER 132  -6.120  14.717  -1.669
  991    HA   SER 132            HA      SER 132  -4.534  15.656   0.512
  992   1HB   SER 132           2HB      SER 132  -4.662  17.811  -0.472
  993   2HB   SER 132           1HB      SER 132  -4.810  16.727  -1.842
  994    HG   SER 132            HG      SER 132  -6.380  18.555  -1.594
  995    H    HIS 133             H      HIS 133  -8.029  15.529  -0.092
  996    HA   HIS 133            HA      HIS 133  -8.635  17.050   2.346
  997   1HB   HIS 133           2HB      HIS 133 -10.225  16.878   0.344
  998   2HB   HIS 133           1HB      HIS 133 -10.644  15.254   0.956
  999    HD1  HIS 133           HD1      HIS 133 -10.496  18.879   2.152
 1000    HD2  HIS 133           HD2      HIS 133 -12.366  15.280   3.117
 1001    HE1  HIS 133           HE1      HIS 133 -12.127  19.400   4.021
 1002    H    LEU 134             H      LEU 134  -8.564  13.613   1.288
 1003    HA   LEU 134            HA      LEU 134  -9.484  12.657   3.879
 1004   1HB   LEU 134           2HB      LEU 134  -8.020  11.369   1.591
 1005   2HB   LEU 134           1HB      LEU 134  -8.429  10.483   3.060
 1006    HG   LEU 134            HG      LEU 134 -10.776  11.802   2.457
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.269  11.305  -0.013
 1008   2HD1  LEU 134          1HD1      LEU 134 -10.961  10.825  -0.021
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.521  12.492   0.327
 1010   1HD2  LEU 134          1HD2      LEU 134  -9.737   9.050   2.189
 1011   2HD2  LEU 134          3HD2      LEU 134 -11.119   9.638   3.109
 1012   3HD2  LEU 134          2HD2      LEU 134 -11.258   9.389   1.368
 1013    NH1  ARG 135           NH2      ARG 135  -0.670  15.585   4.073
 1014    NH2  ARG 135           NH1      ARG 135   1.063  14.152   4.314
 1015    H    ARG 135             H      ARG 135  -6.592  14.081   3.032
 1016    HA   ARG 135            HA      ARG 135  -5.018  12.763   5.161
 1017   1HB   ARG 135           2HB      ARG 135  -4.390  14.665   2.914
 1018   2HB   ARG 135           1HB      ARG 135  -3.359  14.693   4.345
 1019   1HG   ARG 135           2HG      ARG 135  -3.277  12.112   4.063
 1020   2HG   ARG 135           1HG      ARG 135  -3.847  12.426   2.425
 1021   1HD   ARG 135           2HD      ARG 135  -1.496  12.421   2.214
 1022   2HD   ARG 135           1HD      ARG 135  -1.910  14.134   2.292
 1023    HE   ARG 135            HE      ARG 135  -1.094  12.701   4.778
 1024   1HH1  ARG 135          1HH2      ARG 135  -1.649  15.745   3.953
 1025   2HH1  ARG 135          2HH2      ARG 135  -0.040  16.359   4.129
 1026   1HH2  ARG 135          2HH1      ARG 135   1.411  13.216   4.376
 1027   2HH2  ARG 135          1HH1      ARG 135   1.693  14.926   4.385
 1028    NH1  ARG 136           NH1      ARG 136  -5.141  22.770   4.000
 1029    NH2  ARG 136           NH2      ARG 136  -5.816  22.139   1.937
 1030    H    ARG 136             H      ARG 136  -6.587  15.780   4.213
 1031    HA   ARG 136            HA      ARG 136  -6.022  17.097   6.764
 1032   1HB   ARG 136           2HB      ARG 136  -7.612  17.776   4.306
 1033   2HB   ARG 136           1HB      ARG 136  -7.822  18.713   5.783
 1034   1HG   ARG 136           2HG      ARG 136  -5.719  19.636   5.666
 1035   2HG   ARG 136           1HG      ARG 136  -5.028  18.219   4.877
 1036   1HD   ARG 136           2HD      ARG 136  -5.941  18.825   2.762
 1037   2HD   ARG 136           1HD      ARG 136  -7.008  20.028   3.486
 1038    HE   ARG 136            HE      ARG 136  -4.032  20.359   3.466
 1039   1HH1  ARG 136          2HH1      ARG 136  -4.748  22.540   4.891
 1040   2HH1  ARG 136          1HH1      ARG 136  -5.409  23.711   3.801
 1041   1HH2  ARG 136          1HH2      ARG 136  -5.948  21.424   1.249
 1042   2HH2  ARG 136          2HH2      ARG 136  -6.069  23.085   1.731
 1043    H    SER 137             H      SER 137  -8.021  14.612   5.803
 1044    HA   SER 137            HA      SER 137 -10.402  15.304   7.330
 1045   1HB   SER 137           2HB      SER 137 -11.286  13.239   6.464
 1046   2HB   SER 137           1HB      SER 137 -10.359  13.918   5.146
 1047    HG   SER 137            HG      SER 137  -9.951  11.671   5.548
 1048    H    GLN 138             H      GLN 138  -7.291  13.829   7.883
 1049    HA   GLN 138            HA      GLN 138  -6.346  12.893   9.816
 1050   1HB   GLN 138           2HB      GLN 138  -8.963  13.646  11.177
 1051   2HB   GLN 138           1HB      GLN 138  -7.435  13.274  11.972
 1052   1HG   GLN 138           2HG      GLN 138  -7.548  15.475   9.928
 1053   2HG   GLN 138           1HG      GLN 138  -8.083  15.782  11.579
 1054   1HE2  GLN 138          2HE2      GLN 138  -4.109  15.352  10.790
 1055   2HE2  GLN 138          1HE2      GLN 138  -5.265  15.136   9.566
 1056    OH   TYR 139            OH      TYR 139 -14.898  10.185   9.946
 1057    H    TYR 139             H      TYR 139  -8.010  11.386   7.890
 1058    HA   TYR 139            HA      TYR 139  -9.092   9.190   9.589
 1059   1HB   TYR 139           2HB      TYR 139  -9.621  10.173   6.811
 1060   2HB   TYR 139           1HB      TYR 139  -9.764   8.442   7.094
 1061    HD1  TYR 139           HD1      TYR 139 -10.911   8.011   9.613
 1062    HD2  TYR 139           HD2      TYR 139 -11.672  11.274   6.927
 1063    HE1  TYR 139           HE1      TYR 139 -13.139   8.348  10.649
 1064    HE2  TYR 139           HE2      TYR 139 -13.896  11.611   7.965
 1065    HH   TYR 139            HH      TYR 139 -15.441   9.425   9.730
   
  Start of MODEL          16
 Raw file had 1065 H/Q atoms
  Start of MODEL   16
    1   1H    ALA   1            2H      ALA   1 -20.524  19.752  -0.789
    2   2H    ALA   1            1H      ALA   1 -22.176  19.773  -0.394
    3   3H    ALA   1            3H      ALA   1 -21.055  20.538   0.621
    4    HA   ALA   1            HA      ALA   1 -21.543  18.549   1.713
    5   1HB   ALA   1           3HB      ALA   1 -22.359  17.682  -0.752
    6   2HB   ALA   1           2HB      ALA   1 -20.871  16.759  -0.547
    7   3HB   ALA   1           1HB      ALA   1 -22.163  16.628   0.648
    8    H    GLY   2             H      GLY   2 -19.897  16.302   1.506
    9   1HA   GLY   2           2HA      GLY   2 -17.145  17.507   1.471
   10   2HA   GLY   2           1HA      GLY   2 -17.646  16.279   2.634
   11    CH2  TRP   3           CH2      TRP   3 -13.179  11.393   3.568
   12    H    TRP   3             H      TRP   3 -18.090  14.110   1.830
   13    HA   TRP   3            HA      TRP   3 -16.225  12.995   0.115
   14   1HB   TRP   3           2HB      TRP   3 -18.795  12.143   1.070
   15   2HB   TRP   3           1HB      TRP   3 -18.086  11.226  -0.212
   16    HD1  TRP   3           HD1      TRP   3 -18.325   9.568   2.032
   17    HE1  TRP   3           HE1      TRP   3 -16.477   8.800   3.624
   18    HE3  TRP   3           HE3      TRP   3 -14.798  13.300   1.270
   19    HZ2  TRP   3           HZ2      TRP   3 -13.917   9.601   4.469
   20    HZ3  TRP   3           HZ3      TRP   3 -12.690  13.190   2.516
   21    HH2  TRP   3           HH2      TRP   3 -12.243  11.365   4.106
   22    H    ASN   4             H      ASN   4 -19.580  13.833  -0.754
   23    HA   ASN   4            HA      ASN   4 -19.458  13.024  -3.476
   24   1HB   ASN   4           2HB      ASN   4 -21.149  15.108  -2.078
   25   2HB   ASN   4           1HB      ASN   4 -21.343  14.746  -3.792
   26   1HD2  ASN   4          2HD2      ASN   4 -22.678  11.463  -3.209
   27   2HD2  ASN   4          1HD2      ASN   4 -21.786  12.376  -4.327
   28    H    ALA   5             H      ALA   5 -18.078  15.773  -1.979
   29    HA   ALA   5            HA      ALA   5 -17.787  17.450  -4.360
   30   1HB   ALA   5           2HB      ALA   5 -17.624  18.045  -1.727
   31   2HB   ALA   5           1HB      ALA   5 -15.913  17.745  -2.034
   32   3HB   ALA   5           3HB      ALA   5 -16.771  18.982  -2.951
   33    OH   TYR   6            OH      TYR   6 -13.379  17.945   1.165
   34    H    TYR   6             H      TYR   6 -15.808  15.094  -2.523
   35    HA   TYR   6            HA      TYR   6 -13.526  15.345  -4.354
   36   1HB   TYR   6           2HB      TYR   6 -14.042  13.072  -2.426
   37   2HB   TYR   6           1HB      TYR   6 -12.485  13.603  -3.077
   38    HD1  TYR   6           HD1      TYR   6 -11.805  16.048  -2.660
   39    HD2  TYR   6           HD2      TYR   6 -14.883  14.036  -0.564
   40    HE1  TYR   6           HE1      TYR   6 -11.796  17.846  -0.959
   41    HE2  TYR   6           HE2      TYR   6 -14.888  15.777   1.178
   42    HH   TYR   6            HH      TYR   6 -13.431  18.782   0.699
   43    H    ILE   7             H      ILE   7 -16.575  13.989  -4.545
   44    HA   ILE   7            HA      ILE   7 -15.862  12.014  -6.606
   45    HB   ILE   7            HB      ILE   7 -18.375  12.711  -5.158
   46   1HG1  ILE   7          2HG1      ILE   7 -16.555  11.044  -4.449
   47   2HG1  ILE   7          1HG1      ILE   7 -18.215  10.463  -4.419
   48   1HG2  ILE   7          3HG2      ILE   7 -18.119  11.530  -7.875
   49   2HG2  ILE   7          2HG2      ILE   7 -19.311  10.817  -6.778
   50   3HG2  ILE   7          1HG2      ILE   7 -19.415  12.525  -7.211
   51   1HD1  ILE   7          1HD1      ILE   7 -16.882  10.085  -6.995
   52   2HD1  ILE   7          3HD1      ILE   7 -16.092   9.228  -5.681
   53   3HD1  ILE   7          2HD1      ILE   7 -17.791   8.930  -6.034
   54    H    ASP   8             H      ASP   8 -17.061  15.248  -6.053
   55    HA   ASP   8            HA      ASP   8 -17.885  15.927  -8.668
   56   1HB   ASP   8           2HB      ASP   8 -17.351  17.330  -6.178
   57   2HB   ASP   8           1HB      ASP   8 -17.312  18.297  -7.597
   58    H    ASN   9             H      ASN   9 -14.882  15.399  -7.207
   59    HA   ASN   9            HA      ASN   9 -13.077  16.956  -8.595
   60   1HB   ASN   9           2HB      ASN   9 -11.903  15.714  -7.121
   61   2HB   ASN   9           1HB      ASN   9 -13.155  14.689  -6.862
   62   1HD2  ASN   9          2HD2      ASN   9 -11.409  11.765  -8.322
   63   2HD2  ASN   9          1HD2      ASN   9 -12.538  12.355  -7.188
   64    H    LEU  10             H      LEU  10 -14.661  14.165  -9.355
   65    HA   LEU  10            HA      LEU  10 -13.361  13.452 -11.760
   66   1HB   LEU  10           2HB      LEU  10 -15.918  12.640 -10.518
   67   2HB   LEU  10           1HB      LEU  10 -15.240  11.865 -11.915
   68    HG   LEU  10            HG      LEU  10 -14.502  10.527 -10.337
   69   1HD1  LEU  10          1HD1      LEU  10 -12.328  12.603 -10.252
   70   2HD1  LEU  10          3HD1      LEU  10 -12.143  10.952  -9.699
   71   3HD1  LEU  10          2HD1      LEU  10 -12.458  11.278 -11.385
   72   1HD2  LEU  10          1HD2      LEU  10 -14.300  12.833  -8.393
   73   2HD2  LEU  10          3HD2      LEU  10 -15.566  11.639  -8.424
   74   3HD2  LEU  10          2HD2      LEU  10 -13.929  11.224  -7.967
   75    H    MET  11             H      MET  11 -16.202  14.950 -10.750
   76    HA   MET  11            HA      MET  11 -17.246  14.984 -13.456
   77   1HB   MET  11           2HB      MET  11 -18.075  16.454 -10.928
   78   2HB   MET  11           1HB      MET  11 -19.082  16.168 -12.358
   79   1HG   MET  11           2HG      MET  11 -17.758  13.666 -10.988
   80   2HG   MET  11           1HG      MET  11 -19.237  14.402 -10.279
   81   1HE   MET  11           2HE      MET  11 -17.805  12.002 -12.187
   82   2HE   MET  11           1HE      MET  11 -18.894  11.430 -13.448
   83   3HE   MET  11           3HE      MET  11 -17.805  12.791 -13.761
   84    H    ALA  12             H      ALA  12 -15.163  17.010 -11.560
   85    HA   ALA  12            HA      ALA  12 -15.202  19.357 -13.236
   86   1HB   ALA  12           2HB      ALA  12 -13.945  18.535 -10.682
   87   2HB   ALA  12           1HB      ALA  12 -13.118  19.787 -11.626
   88   3HB   ALA  12           3HB      ALA  12 -14.782  20.043 -11.097
   89    H    ASP  13             H      ASP  13 -12.980  16.705 -12.728
   90    HA   ASP  13            HA      ASP  13 -10.654  17.760 -14.011
   91   1HB   ASP  13           2HB      ASP  13  -9.967  15.199 -14.084
   92   2HB   ASP  13           1HB      ASP  13 -10.093  16.065 -12.572
   93    H    GLY  14             H      GLY  14 -13.345  16.719 -15.799
   94   1HA   GLY  14           2HA      GLY  14 -13.513  15.739 -18.031
   95   2HA   GLY  14           1HA      GLY  14 -12.512  17.142 -18.368
   96    H    THR  15             H      THR  15 -11.437  14.347 -16.547
   97    HA   THR  15            HA      THR  15  -9.711  13.271 -18.675
   98    HB   THR  15            HB      THR  15  -8.843  14.230 -15.980
   99    HG1  THR  15           HG1      THR  15  -7.290  15.297 -17.293
  100   1HG2  THR  15          1HG2      THR  15  -7.608  12.268 -17.893
  101   2HG2  THR  15          3HG2      THR  15  -6.629  13.167 -16.711
  102   3HG2  THR  15          2HG2      THR  15  -7.930  12.097 -16.170
  103    H    CYS  16             H      CYS  16 -11.001  13.025 -15.485
  104    HA   CYS  16            HA      CYS  16 -10.447  10.294 -15.070
  105   1HB   CYS  16           2HB      CYS  16 -11.500  10.776 -13.007
  106   2HB   CYS  16           1HB      CYS  16 -11.207  12.374 -13.536
  107    HG   CYS  16            HG      CYS  16 -13.969  10.988 -13.902
  108    H    GLN  17             H      GLN  17 -12.714   9.074 -14.473
  109    HA   GLN  17            HA      GLN  17 -14.829   9.375 -16.390
  110   1HB   GLN  17           2HB      GLN  17 -12.969   7.862 -17.345
  111   2HB   GLN  17           1HB      GLN  17 -13.673   6.658 -16.281
  112   1HG   GLN  17           2HG      GLN  17 -14.786   6.515 -18.433
  113   2HG   GLN  17           1HG      GLN  17 -15.905   7.175 -17.253
  114   1HE2  GLN  17          2HE2      GLN  17 -16.543   9.934 -19.331
  115   2HE2  GLN  17          1HE2      GLN  17 -17.148   8.738 -18.291
  116    H    ASP  18             H      ASP  18 -13.334   7.512 -13.795
  117    HA   ASP  18            HA      ASP  18 -15.902   7.493 -12.379
  118   1HB   ASP  18           2HB      ASP  18 -15.204   5.213 -13.477
  119   2HB   ASP  18           1HB      ASP  18 -14.230   5.093 -12.031
  120    H    ALA  19             H      ALA  19 -15.244   6.552  -9.973
  121    HA   ALA  19            HA      ALA  19 -12.668   7.609  -8.950
  122   1HB   ALA  19           3HB      ALA  19 -15.125   9.221  -9.204
  123   2HB   ALA  19           2HB      ALA  19 -14.337   9.220  -7.596
  124   3HB   ALA  19           1HB      ALA  19 -13.407   9.637  -9.031
  125    H    ALA  20             H      ALA  20 -12.359   6.449  -6.942
  126    HA   ALA  20            HA      ALA  20 -14.943   5.916  -5.488
  127   1HB   ALA  20           2HB      ALA  20 -13.041   3.719  -6.181
  128   2HB   ALA  20           1HB      ALA  20 -14.416   3.574  -5.065
  129   3HB   ALA  20           3HB      ALA  20 -14.683   3.963  -6.766
  130    H    ILE  21             H      ILE  21 -14.760   6.765  -3.651
  131    HA   ILE  21            HA      ILE  21 -12.275   6.548  -2.056
  132    HB   ILE  21            HB      ILE  21 -14.984   7.747  -1.314
  133   1HG1  ILE  21          2HG1      ILE  21 -12.490   8.940  -2.568
  134   2HG1  ILE  21          1HG1      ILE  21 -14.139   9.011  -3.175
  135   1HG2  ILE  21          2HG2      ILE  21 -13.324   7.007   0.526
  136   2HG2  ILE  21          1HG2      ILE  21 -12.255   8.275  -0.071
  137   3HG2  ILE  21          3HG2      ILE  21 -13.840   8.696   0.586
  138   1HD1  ILE  21          1HD1      ILE  21 -14.640  10.259  -0.936
  139   2HD1  ILE  21          3HD1      ILE  21 -12.896  10.511  -0.900
  140   3HD1  ILE  21          2HD1      ILE  21 -13.848  11.137  -2.245
  141    H    VAL  22             H      VAL  22 -12.169   4.648  -0.770
  142    HA   VAL  22            HA      VAL  22 -14.755   3.206  -0.335
  143    HB   VAL  22            HB      VAL  22 -12.059   1.937  -0.991
  144   1HG1  VAL  22          1HG1      VAL  22 -13.895   0.666   0.340
  145   2HG1  VAL  22          3HG1      VAL  22 -14.762   0.621  -1.195
  146   3HG1  VAL  22          2HG1      VAL  22 -13.168  -0.135  -1.052
  147   1HG2  VAL  22          2HG2      VAL  22 -14.466   2.432  -2.786
  148   2HG2  VAL  22          1HG2      VAL  22 -12.885   3.206  -2.935
  149   3HG2  VAL  22          3HG2      VAL  22 -13.051   1.468  -3.231
  150    H    GLY  23             H      GLY  23 -15.085   3.091   1.920
  151   1HA   GLY  23           2HA      GLY  23 -12.995   3.257   3.920
  152   2HA   GLY  23           1HA      GLY  23 -14.639   2.671   4.221
  153    OH   TYR  24            OH      TYR  24  -5.469   1.684   4.929
  154    H    TYR  24             H      TYR  24 -11.497   1.746   3.147
  155    HA   TYR  24            HA      TYR  24 -12.012  -1.047   2.728
  156   1HB   TYR  24           2HB      TYR  24  -9.877  -1.054   1.692
  157   2HB   TYR  24           1HB      TYR  24 -10.436   0.569   1.469
  158    HD1  TYR  24           HD1      TYR  24  -9.909   1.977   3.971
  159    HD2  TYR  24           HD2      TYR  24  -7.662  -1.107   2.115
  160    HE1  TYR  24           HE1      TYR  24  -7.884   2.750   5.148
  161    HE2  TYR  24           HE2      TYR  24  -5.623  -0.364   3.243
  162    HH   TYR  24            HH      TYR  24  -5.168   2.491   4.504
  163    H    LYS  25             H      LYS  25 -12.367  -0.167   5.523
  164    HA   LYS  25            HA      LYS  25 -10.154  -1.010   7.121
  165   1HB   LYS  25           2HB      LYS  25 -13.032  -0.620   7.736
  166   2HB   LYS  25           1HB      LYS  25 -11.895  -1.122   8.949
  167   1HG   LYS  25           2HG      LYS  25 -12.005   1.235   9.151
  168   2HG   LYS  25           1HG      LYS  25 -10.506   0.910   8.286
  169   1HD   LYS  25           2HD      LYS  25 -11.321   1.667   6.293
  170   2HD   LYS  25           1HD      LYS  25 -12.992   1.278   6.700
  171   1HE   LYS  25           2HE      LYS  25 -11.366   3.515   7.889
  172   2HE   LYS  25           1HE      LYS  25 -12.637   3.697   6.695
  173   1HZ   LYS  25           1HZ      LYS  25 -14.023   2.411   8.452
  174   2HZ   LYS  25           3HZ      LYS  25 -12.843   2.970   9.533
  175   3HZ   LYS  25           2HZ      LYS  25 -13.763   4.078   8.639
  176    H    ASP  26             H      ASP  26 -11.544  -2.887   8.835
  177    HA   ASP  26            HA      ASP  26 -10.885  -5.410   7.791
  178   1HB   ASP  26           2HB      ASP  26 -12.854  -6.236   9.306
  179   2HB   ASP  26           1HB      ASP  26 -11.400  -5.609  10.042
  180    H    SER  27             H      SER  27 -14.118  -3.996   7.910
  181    HA   SER  27            HA      SER  27 -15.009  -5.670   5.659
  182   1HB   SER  27           2HB      SER  27 -17.221  -4.558   6.319
  183   2HB   SER  27           1HB      SER  27 -16.601  -5.770   7.407
  184    HG   SER  27            HG      SER  27 -17.315  -3.491   8.156
  185    HA   PRO  28            HA      PRO  28 -14.123  -1.921   3.429
  186   1HB   PRO  28           2HB      PRO  28 -14.461  -2.934   0.916
  187   2HB   PRO  28           1HB      PRO  28 -12.988  -3.139   1.884
  188   1HG   PRO  28           2HG      PRO  28 -15.082  -5.125   1.269
  189   2HG   PRO  28           1HG      PRO  28 -13.434  -5.366   1.786
  190   1HD   PRO  28           2HD      PRO  28 -15.762  -5.570   3.371
  191   2HD   PRO  28           1HD      PRO  28 -14.074  -5.698   3.907
  192    H    SER  29             H      SER  29 -15.262  -0.404   2.023
  193    HA   SER  29            HA      SER  29 -17.936  -0.942   1.164
  194   1HB   SER  29           2HB      SER  29 -18.964   0.829   2.620
  195   2HB   SER  29           1HB      SER  29 -18.494  -0.630   3.486
  196    HG   SER  29            HG      SER  29 -16.912   1.721   3.223
  197    H    VAL  30             H      VAL  30 -18.853   0.928   0.098
  198    HA   VAL  30            HA      VAL  30 -16.766   2.559  -1.127
  199    HB   VAL  30            HB      VAL  30 -19.656   1.977  -1.754
  200   1HG1  VAL  30          3HG1      VAL  30 -18.947   4.316  -2.441
  201   2HG1  VAL  30          2HG1      VAL  30 -17.675   3.565  -3.411
  202   3HG1  VAL  30          1HG1      VAL  30 -19.368   3.259  -3.796
  203   1HG2  VAL  30          3HG2      VAL  30 -16.965   1.158  -2.829
  204   2HG2  VAL  30          2HG2      VAL  30 -18.269   0.119  -2.232
  205   3HG2  VAL  30          1HG2      VAL  30 -18.440   0.966  -3.753
  206    CH2  TRP  31           CH2      TRP  31 -13.924   5.784   6.775
  207    H    TRP  31             H      TRP  31 -16.335   4.204   0.289
  208    HA   TRP  31            HA      TRP  31 -18.315   5.568   1.847
  209   1HB   TRP  31           2HB      TRP  31 -15.406   5.961   1.246
  210   2HB   TRP  31           1HB      TRP  31 -16.301   7.281   2.003
  211    HD1  TRP  31           HD1      TRP  31 -17.746   3.999   2.969
  212    HE1  TRP  31           HE1      TRP  31 -17.061   3.371   5.326
  213    HE3  TRP  31           HE3      TRP  31 -13.975   7.378   3.767
  214    HZ2  TRP  31           HZ2      TRP  31 -15.216   4.156   7.326
  215    HZ3  TRP  31           HZ3      TRP  31 -12.789   7.412   5.941
  216    HH2  TRP  31           HH2      TRP  31 -13.397   5.793   7.718
  217    H    ALA  32             H      ALA  32 -17.091   5.965  -1.377
  218    HA   ALA  32            HA      ALA  32 -19.215   7.648  -2.205
  219   1HB   ALA  32           3HB      ALA  32 -16.666   9.151  -1.485
  220   2HB   ALA  32           2HB      ALA  32 -17.940   9.835  -2.525
  221   3HB   ALA  32           1HB      ALA  32 -18.293   9.422  -0.835
  222    H    ALA  33             H      ALA  33 -18.989   6.064  -3.898
  223    HA   ALA  33            HA      ALA  33 -16.838   6.721  -5.846
  224   1HB   ALA  33           2HB      ALA  33 -18.211   4.042  -5.447
  225   2HB   ALA  33           1HB      ALA  33 -17.024   4.405  -6.698
  226   3HB   ALA  33           3HB      ALA  33 -16.545   4.421  -5.001
  227    H    VAL  34             H      VAL  34 -17.547   7.382  -7.793
  228    HA   VAL  34            HA      VAL  34 -20.201   8.142  -8.372
  229    HB   VAL  34            HB      VAL  34 -18.122   7.238 -10.402
  230   1HG1  VAL  34          3HG1      VAL  34 -20.566   9.020 -10.566
  231   2HG1  VAL  34          2HG1      VAL  34 -19.294   9.032 -11.790
  232   3HG1  VAL  34          1HG1      VAL  34 -20.232   7.554 -11.502
  233   1HG2  VAL  34          2HG2      VAL  34 -17.786   9.195  -8.491
  234   2HG2  VAL  34          1HG2      VAL  34 -16.977   9.184 -10.053
  235   3HG2  VAL  34          3HG2      VAL  34 -18.452  10.122  -9.828
  236    HA   PRO  35            HA      PRO  35 -21.657   3.835  -8.585
  237   1HB   PRO  35           2HB      PRO  35 -24.339   4.403  -8.361
  238   2HB   PRO  35           1HB      PRO  35 -23.235   4.250  -6.984
  239   1HG   PRO  35           2HG      PRO  35 -24.378   6.727  -8.209
  240   2HG   PRO  35           1HG      PRO  35 -23.861   6.435  -6.539
  241   1HD   PRO  35           2HD      PRO  35 -22.377   7.848  -8.470
  242   2HD   PRO  35           1HD      PRO  35 -21.730   7.181  -6.958
  243    H    GLY  36             H      GLY  36 -22.535   2.545 -10.171
  244   1HA   GLY  36           2HA      GLY  36 -24.041   2.252 -12.107
  245   2HA   GLY  36           1HA      GLY  36 -23.633   3.898 -12.593
  246    H    LYS  37             H      LYS  37 -20.702   3.346 -11.828
  247    HA   LYS  37            HA      LYS  37 -20.002   2.191 -14.459
  248   1HB   LYS  37           2HB      LYS  37 -18.227   3.513 -12.389
  249   2HB   LYS  37           1HB      LYS  37 -17.738   3.050 -14.018
  250   1HG   LYS  37           2HG      LYS  37 -19.816   5.134 -13.251
  251   2HG   LYS  37           1HG      LYS  37 -18.288   5.410 -14.080
  252   1HD   LYS  37           2HD      LYS  37 -19.250   3.796 -15.905
  253   2HD   LYS  37           1HD      LYS  37 -20.810   4.138 -15.155
  254   1HE   LYS  37           2HE      LYS  37 -20.524   5.732 -16.929
  255   2HE   LYS  37           1HE      LYS  37 -20.279   6.601 -15.414
  256   1HZ   LYS  37           3HZ      LYS  37 -18.018   5.386 -16.865
  257   2HZ   LYS  37           2HZ      LYS  37 -18.587   6.933 -17.273
  258   3HZ   LYS  37           1HZ      LYS  37 -17.993   6.628 -15.711
  259    H    THR  38             H      THR  38 -17.718   1.734 -11.732
  260    HA   THR  38            HA      THR  38 -18.300  -1.162 -11.640
  261    HB   THR  38            HB      THR  38 -16.099   0.044 -13.178
  262    HG1  THR  38           HG1      THR  38 -17.056  -1.130 -14.571
  263   1HG2  THR  38          2HG2      THR  38 -15.615  -2.263 -11.327
  264   2HG2  THR  38          1HG2      THR  38 -14.891  -2.324 -12.933
  265   3HG2  THR  38          3HG2      THR  38 -14.491  -0.989 -11.836
  266    H    PHE  39             H      PHE  39 -16.112   1.423 -10.527
  267    HA   PHE  39            HA      PHE  39 -14.698  -0.001  -8.531
  268   1HB   PHE  39           2HB      PHE  39 -15.530   2.881  -8.648
  269   2HB   PHE  39           1HB      PHE  39 -14.488   2.203  -7.412
  270    HD1  PHE  39           HD2      PHE  39 -14.154   0.788 -10.796
  271    HD2  PHE  39           HD1      PHE  39 -12.714   3.821  -8.111
  272    HE1  PHE  39           HE2      PHE  39 -12.182   1.102 -12.212
  273    HE2  PHE  39           HE1      PHE  39 -10.725   4.117  -9.548
  274    HZ   PHE  39            HZ      PHE  39 -10.486   2.745 -11.590
  275    H    VAL  40             H      VAL  40 -17.716   1.779  -8.212
  276    HA   VAL  40            HA      VAL  40 -18.088   1.649  -5.457
  277    HB   VAL  40            HB      VAL  40 -19.548   3.083  -6.665
  278   1HG1  VAL  40          1HG1      VAL  40 -20.045   0.633  -8.303
  279   2HG1  VAL  40          3HG1      VAL  40 -21.222   1.945  -8.291
  280   3HG1  VAL  40          2HG1      VAL  40 -19.562   2.255  -8.815
  281   1HG2  VAL  40          3HG2      VAL  40 -20.554   1.330  -4.830
  282   2HG2  VAL  40          2HG2      VAL  40 -21.500   2.637  -5.552
  283   3HG2  VAL  40          1HG2      VAL  40 -21.612   1.001  -6.202
  284    H    ASN  41             H      ASN  41 -18.273  -0.904  -7.785
  285    HA   ASN  41            HA      ASN  41 -19.818  -2.686  -6.083
  286   1HB   ASN  41           2HB      ASN  41 -18.499  -2.863  -8.769
  287   2HB   ASN  41           1HB      ASN  41 -18.992  -4.310  -7.921
  288   1HD2  ASN  41          2HD2      ASN  41 -21.860  -1.799  -9.398
  289   2HD2  ASN  41          1HD2      ASN  41 -20.254  -1.267  -9.271
  290    H    ILE  42             H      ILE  42 -17.114  -1.436  -5.225
  291    HA   ILE  42            HA      ILE  42 -15.219  -3.559  -5.273
  292    HB   ILE  42            HB      ILE  42 -15.352  -0.771  -4.202
  293   1HG1  ILE  42          2HG1      ILE  42 -12.922  -2.090  -5.351
  294   2HG1  ILE  42          1HG1      ILE  42 -14.310  -1.862  -6.412
  295   1HG2  ILE  42          3HG2      ILE  42 -13.336  -2.780  -3.135
  296   2HG2  ILE  42          2HG2      ILE  42 -13.271  -1.038  -2.887
  297   3HG2  ILE  42          1HG2      ILE  42 -14.587  -1.978  -2.191
  298   1HD1  ILE  42          3HD1      ILE  42 -14.228   0.594  -5.333
  299   2HD1  ILE  42          2HD1      ILE  42 -12.526   0.173  -5.157
  300   3HD1  ILE  42          1HD1      ILE  42 -13.274   0.171  -6.758
  301    H    THR  43             H      THR  43 -14.817  -5.000  -3.827
  302    HA   THR  43            HA      THR  43 -16.288  -5.345  -1.267
  303    HB   THR  43            HB      THR  43 -15.979  -7.842  -2.001
  304    HG1  THR  43           HG1      THR  43 -15.353  -8.254  -3.955
  305   1HG2  THR  43          2HG2      THR  43 -17.990  -5.943  -2.551
  306   2HG2  THR  43          1HG2      THR  43 -17.792  -6.933  -4.003
  307   3HG2  THR  43          3HG2      THR  43 -18.168  -7.699  -2.461
  308    HA   PRO  44            HA      PRO  44 -12.186  -6.175   0.441
  309   1HB   PRO  44           2HB      PRO  44 -12.240  -8.584   1.631
  310   2HB   PRO  44           1HB      PRO  44 -12.906  -7.138   2.349
  311   1HG   PRO  44           2HG      PRO  44 -14.335  -9.442   1.106
  312   2HG   PRO  44           1HG      PRO  44 -14.907  -8.305   2.340
  313   1HD   PRO  44           2HD      PRO  44 -15.599  -8.233  -0.360
  314   2HD   PRO  44           1HD      PRO  44 -15.821  -6.894   0.760
  315    H    ALA  45             H      ALA  45 -13.226  -8.028  -2.035
  316    HA   ALA  45            HA      ALA  45 -10.929  -9.751  -2.404
  317   1HB   ALA  45           1HB      ALA  45 -13.454  -9.163  -3.855
  318   2HB   ALA  45           3HB      ALA  45 -12.117  -9.870  -4.762
  319   3HB   ALA  45           2HB      ALA  45 -12.789 -10.730  -3.379
  320    H    GLU  46             H      GLU  46 -12.410  -7.261  -4.344
  321    HA   GLU  46            HA      GLU  46 -10.060  -6.665  -5.918
  322   1HB   GLU  46           2HB      GLU  46 -11.343  -4.323  -6.201
  323   2HB   GLU  46           1HB      GLU  46 -11.890  -5.764  -7.040
  324   1HG   GLU  46           2HG      GLU  46 -12.948  -5.388  -4.323
  325   2HG   GLU  46           1HG      GLU  46 -13.428  -4.171  -5.494
  326    H    VAL  47             H      VAL  47 -11.317  -5.404  -2.904
  327    HA   VAL  47            HA      VAL  47  -9.215  -3.451  -2.593
  328    HB   VAL  47            HB      VAL  47 -11.683  -4.066  -1.204
  329   1HG1  VAL  47          2HG1      VAL  47 -10.026  -4.451   0.604
  330   2HG1  VAL  47          1HG1      VAL  47  -9.481  -2.804   0.301
  331   3HG1  VAL  47          3HG1      VAL  47 -11.115  -3.083   0.869
  332   1HG2  VAL  47          1HG2      VAL  47 -10.965  -2.037  -2.643
  333   2HG2  VAL  47          3HG2      VAL  47 -11.898  -1.735  -1.171
  334   3HG2  VAL  47          2HG2      VAL  47 -10.123  -1.511  -1.149
  335    H    GLY  48             H      GLY  48  -9.682  -6.771  -1.873
  336   1HA   GLY  48           2HA      GLY  48  -7.798  -7.094   0.248
  337   2HA   GLY  48           1HA      GLY  48  -8.288  -8.351  -0.883
  338    H    VAL  49             H      VAL  49  -7.477  -6.699  -3.186
  339    HA   VAL  49            HA      VAL  49  -4.573  -7.259  -3.070
  340    HB   VAL  49            HB      VAL  49  -5.848  -8.367  -4.872
  341   1HG1  VAL  49          3HG1      VAL  49  -6.757  -5.612  -5.323
  342   2HG1  VAL  49          2HG1      VAL  49  -6.234  -6.420  -6.789
  343   3HG1  VAL  49          1HG1      VAL  49  -7.503  -7.129  -5.793
  344   1HG2  VAL  49          3HG2      VAL  49  -3.654  -6.395  -5.461
  345   2HG2  VAL  49          2HG2      VAL  49  -3.597  -8.158  -5.413
  346   3HG2  VAL  49          1HG2      VAL  49  -4.359  -7.340  -6.776
  347    H    LEU  50             H      LEU  50  -6.809  -4.672  -3.548
  348    HA   LEU  50            HA      LEU  50  -4.951  -2.665  -4.438
  349   1HB   LEU  50           2HB      LEU  50  -7.697  -2.815  -3.477
  350   2HB   LEU  50           1HB      LEU  50  -6.948  -1.294  -3.318
  351    HG   LEU  50            HG      LEU  50  -6.943  -2.691  -5.953
  352   1HD1  LEU  50          1HD1      LEU  50  -9.227  -1.048  -4.707
  353   2HD1  LEU  50          3HD1      LEU  50  -9.139  -1.525  -6.418
  354   3HD1  LEU  50          2HD1      LEU  50  -9.301  -2.761  -5.173
  355   1HD2  LEU  50          3HD2      LEU  50  -5.690  -0.518  -5.417
  356   2HD2  LEU  50          2HD2      LEU  50  -6.808  -0.431  -6.777
  357   3HD2  LEU  50          1HD2      LEU  50  -7.273   0.236  -5.207
  358    H    VAL  51             H      VAL  51  -5.624  -4.172  -1.445
  359    HA   VAL  51            HA      VAL  51  -4.057  -2.145   0.033
  360    HB   VAL  51            HB      VAL  51  -5.819  -1.615   1.542
  361   1HG1  VAL  51          3HG1      VAL  51  -7.270  -2.289  -1.011
  362   2HG1  VAL  51          2HG1      VAL  51  -7.868  -1.212   0.240
  363   3HG1  VAL  51          1HG1      VAL  51  -6.428  -0.781  -0.672
  364   1HG2  VAL  51          1HG2      VAL  51  -6.673  -4.401   1.059
  365   2HG2  VAL  51          3HG2      VAL  51  -6.778  -3.428   2.530
  366   3HG2  VAL  51          2HG2      VAL  51  -7.996  -3.258   1.268
  367    H    GLY  52             H      GLY  52  -5.068  -5.440  -0.216
  368   1HA   GLY  52           2HA      GLY  52  -4.565  -6.561   2.229
  369   2HA   GLY  52           1HA      GLY  52  -4.199  -7.376   0.723
  370    H    LYS  53             H      LYS  53  -2.743  -7.685   2.992
  371    HA   LYS  53            HA      LYS  53  -0.375  -6.132   3.112
  372   1HB   LYS  53           2HB      LYS  53   0.485  -8.044   4.507
  373   2HB   LYS  53           1HB      LYS  53  -1.029  -7.347   5.067
  374   1HG   LYS  53           2HG      LYS  53  -1.966  -9.400   4.958
  375   2HG   LYS  53           1HG      LYS  53  -1.752  -9.364   3.209
  376   1HD   LYS  53           2HD      LYS  53  -0.657 -11.351   4.021
  377   2HD   LYS  53           1HD      LYS  53   0.603 -10.207   3.564
  378   1HE   LYS  53           2HE      LYS  53  -0.129  -9.736   6.312
  379   2HE   LYS  53           1HE      LYS  53   0.229 -11.451   6.091
  380   1HZ   LYS  53           2HZ      LYS  53   2.307 -10.798   4.977
  381   2HZ   LYS  53           1HZ      LYS  53   1.972  -9.169   5.330
  382   3HZ   LYS  53           3HZ      LYS  53   2.242 -10.269   6.593
  383    H    ASP  54             H      ASP  54  -1.332  -8.308   0.773
  384    HA   ASP  54            HA      ASP  54   0.263 -10.097  -0.177
  385   1HB   ASP  54           2HB      ASP  54  -1.431  -8.733  -1.463
  386   2HB   ASP  54           1HB      ASP  54  -0.102  -7.661  -1.861
  387    NH1  ARG  55           NH2      ARG  55   2.690 -13.038   3.199
  388    NH2  ARG  55           NH1      ARG  55   2.758 -15.057   2.186
  389    H    ARG  55             H      ARG  55   2.329 -10.498  -0.304
  390    HA   ARG  55            HA      ARG  55   4.257  -8.443   0.162
  391   1HB   ARG  55           2HB      ARG  55   5.833 -10.196   0.641
  392   2HB   ARG  55           1HB      ARG  55   4.297 -10.589   1.406
  393   1HG   ARG  55           2HG      ARG  55   3.897 -11.799  -0.977
  394   2HG   ARG  55           1HG      ARG  55   5.656 -11.914  -0.896
  395   1HD   ARG  55           2HD      ARG  55   5.035 -13.858   0.219
  396   2HD   ARG  55           1HD      ARG  55   5.183 -12.733   1.567
  397    HE   ARG  55            HE      ARG  55   2.497 -12.895   0.387
  398   1HH1  ARG  55          1HH2      ARG  55   2.793 -12.044   3.155
  399   2HH1  ARG  55          2HH2      ARG  55   2.441 -13.475   4.063
  400   1HH2  ARG  55          2HH1      ARG  55   2.907 -15.609   1.367
  401   2HH2  ARG  55          1HH1      ARG  55   2.520 -15.501   3.049
  402    H    SER  56             H      SER  56   3.121  -9.758  -2.789
  403    HA   SER  56            HA      SER  56   5.279  -8.454  -4.201
  404   1HB   SER  56           2HB      SER  56   6.490 -10.431  -3.417
  405   2HB   SER  56           1HB      SER  56   5.328 -11.446  -4.265
  406    HG   SER  56            HG      SER  56   7.133  -9.546  -5.361
  407    H    SER  57             H      SER  57   3.064 -11.088  -4.650
  408    HA   SER  57            HA      SER  57   2.705 -11.302  -7.292
  409   1HB   SER  57           2HB      SER  57   0.209 -11.621  -6.877
  410   2HB   SER  57           1HB      SER  57   1.342 -12.678  -6.051
  411    HG   SER  57            HG      SER  57   0.889 -11.737  -4.215
  412    H    PHE  58             H      PHE  58  -0.065  -9.501  -6.267
  413    HA   PHE  58            HA      PHE  58  -0.660  -8.281  -8.610
  414   1HB   PHE  58           2HB      PHE  58  -2.100  -6.781  -7.587
  415   2HB   PHE  58           1HB      PHE  58  -1.993  -8.134  -6.505
  416    HD1  PHE  58           HD1      PHE  58  -0.358  -4.786  -7.060
  417    HD2  PHE  58           HD2      PHE  58  -1.711  -7.732  -4.233
  418    HE1  PHE  58           HE1      PHE  58   0.134  -3.230  -5.200
  419    HE2  PHE  58           HE2      PHE  58  -1.214  -6.167  -2.377
  420    HZ   PHE  58            HZ      PHE  58  -0.290  -3.925  -2.859
  421    OH   TYR  59            OH      TYR  59   2.743  -5.369  -1.568
  422    H    TYR  59             H      TYR  59   2.096  -7.089  -6.766
  423    HA   TYR  59            HA      TYR  59   2.167  -4.528  -7.962
  424   1HB   TYR  59           2HB      TYR  59   4.659  -6.031  -7.327
  425   2HB   TYR  59           1HB      TYR  59   4.421  -4.289  -7.321
  426    HD1  TYR  59           HD1      TYR  59   2.264  -3.624  -5.747
  427    HD2  TYR  59           HD2      TYR  59   4.882  -6.951  -5.255
  428    HE1  TYR  59           HE1      TYR  59   1.758  -3.660  -3.315
  429    HE2  TYR  59           HE2      TYR  59   4.367  -7.022  -2.832
  430    HH   TYR  59            HH      TYR  59   3.344  -4.765  -1.126
  431    H    VAL  60             H      VAL  60   2.409  -7.339  -9.611
  432    HA   VAL  60            HA      VAL  60   3.821  -6.057 -11.836
  433    HB   VAL  60            HB      VAL  60   4.300  -8.596 -12.358
  434   1HG1  VAL  60          3HG1      VAL  60   5.754  -6.888 -10.352
  435   2HG1  VAL  60          2HG1      VAL  60   6.444  -8.345 -11.067
  436   3HG1  VAL  60          1HG1      VAL  60   6.047  -6.967 -12.091
  437   1HG2  VAL  60          1HG2      VAL  60   3.028  -9.470 -10.414
  438   2HG2  VAL  60          3HG2      VAL  60   4.735  -9.914 -10.327
  439   3HG2  VAL  60          2HG2      VAL  60   4.116  -8.589  -9.339
  440    H    ASN  61             H      ASN  61   1.111  -8.145 -10.857
  441    HA   ASN  61            HA      ASN  61   0.351  -8.561 -13.623
  442   1HB   ASN  61           2HB      ASN  61  -1.362 -10.016 -12.709
  443   2HB   ASN  61           1HB      ASN  61   0.201 -10.439 -12.089
  444   1HD2  ASN  61          2HD2      ASN  61  -0.942 -10.215  -8.814
  445   2HD2  ASN  61          1HD2      ASN  61   0.081 -10.955  -9.945
  446    H    GLY  62             H      GLY  62  -0.828  -6.702 -10.827
  447   1HA   GLY  62           2HA      GLY  62  -1.927  -4.557 -11.467
  448   2HA   GLY  62           1HA      GLY  62  -2.871  -5.519 -12.610
  449    H    LEU  63             H      LEU  63  -3.881  -3.881 -10.424
  450    HA   LEU  63            HA      LEU  63  -4.821  -5.759  -8.333
  451   1HB   LEU  63           2HB      LEU  63  -5.811  -2.910  -8.665
  452   2HB   LEU  63           1HB      LEU  63  -5.794  -3.876  -7.186
  453    HG   LEU  63            HG      LEU  63  -3.293  -2.980  -8.641
  454   1HD1  LEU  63          2HD1      LEU  63  -5.066  -1.277  -7.493
  455   2HD1  LEU  63          1HD1      LEU  63  -4.157  -1.767  -6.057
  456   3HD1  LEU  63          3HD1      LEU  63  -3.322  -1.027  -7.427
  457   1HD2  LEU  63          2HD2      LEU  63  -3.959  -4.298  -6.009
  458   2HD2  LEU  63          1HD2      LEU  63  -2.818  -4.833  -7.245
  459   3HD2  LEU  63          3HD2      LEU  63  -2.438  -3.433  -6.240
  460    H    THR  64             H      THR  64  -7.468  -4.500  -8.043
  461    HA   THR  64            HA      THR  64  -8.936  -5.005 -10.470
  462    HB   THR  64            HB      THR  64 -10.324  -6.788  -9.325
  463    HG1  THR  64           HG1      THR  64  -8.015  -7.042  -7.721
  464   1HG2  THR  64          1HG2      THR  64  -8.613  -7.233 -11.088
  465   2HG2  THR  64          3HG2      THR  64  -7.452  -7.573  -9.806
  466   3HG2  THR  64          2HG2      THR  64  -8.890  -8.584 -10.000
  467    H    LEU  65             H      LEU  65 -10.688  -3.804 -10.297
  468    HA   LEU  65            HA      LEU  65 -11.677  -2.981  -7.650
  469   1HB   LEU  65           2HB      LEU  65 -12.061  -0.678  -8.858
  470   2HB   LEU  65           1HB      LEU  65 -10.593  -1.039  -8.002
  471    HG   LEU  65            HG      LEU  65  -9.615  -1.820 -10.228
  472   1HD1  LEU  65          3HD1      LEU  65 -12.270  -0.768 -11.074
  473   2HD1  LEU  65          2HD1      LEU  65 -10.884  -0.436 -12.114
  474   3HD1  LEU  65          1HD1      LEU  65 -11.324  -2.098 -11.732
  475   1HD2  LEU  65          3HD2      LEU  65 -10.260   0.950  -9.354
  476   2HD2  LEU  65          2HD2      LEU  65  -8.689   0.193  -9.653
  477   3HD2  LEU  65          1HD2      LEU  65  -9.658   0.775 -11.008
  478    H    GLY  66             H      GLY  66 -13.541  -3.985  -7.653
  479   1HA   GLY  66           2HA      GLY  66 -15.818  -4.310  -8.110
  480   2HA   GLY  66           1HA      GLY  66 -15.669  -3.149  -9.434
  481    H    GLY  67             H      GLY  67 -13.471  -5.851  -9.075
  482   1HA   GLY  67           2HA      GLY  67 -13.267  -7.869 -10.257
  483   2HA   GLY  67           1HA      GLY  67 -14.839  -7.560 -10.998
  484    H    GLN  68             H      GLN  68 -12.747  -4.794 -11.219
  485    HA   GLN  68            HA      GLN  68 -12.136  -5.559 -14.060
  486   1HB   GLN  68           2HB      GLN  68 -13.520  -3.683 -14.155
  487   2HB   GLN  68           1HB      GLN  68 -12.691  -2.971 -12.828
  488   1HG   GLN  68           2HG      GLN  68 -12.212  -1.958 -15.170
  489   2HG   GLN  68           1HG      GLN  68 -10.826  -2.269 -14.132
  490   1HE2  GLN  68          2HE2      GLN  68  -9.407  -4.066 -16.863
  491   2HE2  GLN  68          1HE2      GLN  68  -9.246  -2.759 -15.788
  492    H    LYS  69             H      LYS  69 -10.182  -6.448 -13.993
  493    HA   LYS  69            HA      LYS  69  -8.053  -5.847 -12.283
  494   1HB   LYS  69           2HB      LYS  69  -8.567  -7.693 -14.201
  495   2HB   LYS  69           1HB      LYS  69  -7.354  -6.704 -15.014
  496   1HG   LYS  69           2HG      LYS  69  -5.708  -7.191 -13.439
  497   2HG   LYS  69           1HG      LYS  69  -6.888  -7.568 -12.181
  498   1HD   LYS  69           2HD      LYS  69  -6.788  -9.742 -12.720
  499   2HD   LYS  69           1HD      LYS  69  -7.361  -9.363 -14.346
  500   1HE   LYS  69           2HE      LYS  69  -4.471  -8.820 -13.748
  501   2HE   LYS  69           1HE      LYS  69  -4.954 -10.510 -13.909
  502   1HZ   LYS  69           2HZ      LYS  69  -6.196  -9.405 -16.014
  503   2HZ   LYS  69           1HZ      LYS  69  -4.811  -8.424 -15.919
  504   3HZ   LYS  69           3HZ      LYS  69  -4.649 -10.103 -16.088
  505    H    CYS  70             H      CYS  70  -6.927  -4.002 -12.085
  506    HA   CYS  70            HA      CYS  70  -6.331  -2.405 -14.556
  507   1HB   CYS  70           2HB      CYS  70  -5.793  -0.604 -12.849
  508   2HB   CYS  70           1HB      CYS  70  -7.488  -0.999 -13.009
  509    HG   CYS  70            HG      CYS  70  -6.200  -2.582 -10.760
  510    H    SER  71             H      SER  71  -4.032  -1.341 -14.059
  511    HA   SER  71            HA      SER  71  -2.269  -3.496 -13.022
  512   1HB   SER  71           2HB      SER  71  -0.819  -3.119 -14.921
  513   2HB   SER  71           1HB      SER  71  -2.448  -3.602 -15.385
  514    HG   SER  71            HG      SER  71  -1.152  -1.172 -15.675
  515    H    VAL  72             H      VAL  72  -1.337  -2.629 -11.303
  516    HA   VAL  72            HA      VAL  72  -0.649  -0.004 -10.695
  517    HB   VAL  72            HB      VAL  72   1.191  -2.251 -10.100
  518   1HG1  VAL  72          1HG1      VAL  72   1.113   0.455  -9.373
  519   2HG1  VAL  72          3HG1      VAL  72   0.587  -0.441  -7.951
  520   3HG1  VAL  72          2HG1      VAL  72   2.141  -0.802  -8.683
  521   1HG2  VAL  72          2HG2      VAL  72  -1.598  -1.930  -9.291
  522   2HG2  VAL  72          1HG2      VAL  72  -0.575  -3.363  -9.228
  523   3HG2  VAL  72          3HG2      VAL  72  -0.492  -2.162  -7.952
  524    H    ILE  73             H      ILE  73   0.548   1.370 -11.648
  525    HA   ILE  73            HA      ILE  73   2.939   0.542 -13.026
  526    HB   ILE  73            HB      ILE  73   0.898   2.435 -14.043
  527   1HG1  ILE  73          2HG1      ILE  73   2.173   0.316 -15.700
  528   2HG1  ILE  73          1HG1      ILE  73   1.050  -0.222 -14.458
  529   1HG2  ILE  73          3HG2      ILE  73   3.185   3.417 -14.289
  530   2HG2  ILE  73          2HG2      ILE  73   3.628   1.982 -15.208
  531   3HG2  ILE  73          1HG2      ILE  73   2.401   3.084 -15.833
  532   1HD1  ILE  73          2HD1      ILE  73   0.374   1.807 -16.632
  533   2HD1  ILE  73          1HD1      ILE  73  -0.067   0.084 -16.706
  534   3HD1  ILE  73          3HD1      ILE  73  -0.745   1.140 -15.448
  535    NH1  ARG  74           NH1      ARG  74   9.803   4.768 -11.826
  536    NH2  ARG  74           NH2      ARG  74  10.215   4.993  -9.612
  537    H    ARG  74             H      ARG  74   3.654   1.024 -10.984
  538    HA   ARG  74            HA      ARG  74   5.350   2.258  -9.846
  539   1HB   ARG  74           2HB      ARG  74   4.628   4.270 -11.544
  540   2HB   ARG  74           1HB      ARG  74   3.941   4.874 -10.037
  541   1HG   ARG  74           2HG      ARG  74   6.126   5.713  -9.950
  542   2HG   ARG  74           1HG      ARG  74   6.281   4.210  -9.039
  543   1HD   ARG  74           2HD      ARG  74   6.758   3.226 -11.490
  544   2HD   ARG  74           1HD      ARG  74   7.291   4.885 -11.768
  545    HE   ARG  74            HE      ARG  74   8.440   3.112  -9.646
  546   1HH1  ARG  74          2HH1      ARG  74   9.235   4.413 -12.571
  547   2HH1  ARG  74          1HH1      ARG  74  10.621   5.306 -12.033
  548   1HH2  ARG  74          1HH2      ARG  74   9.962   4.811  -8.661
  549   2HH2  ARG  74          2HH2      ARG  74  11.034   5.527  -9.818
  550    H    ASP  75             H      ASP  75   4.317   0.889  -8.301
  551    HA   ASP  75            HA      ASP  75   2.049   1.791  -6.847
  552   1HB   ASP  75           2HB      ASP  75   2.073  -0.493  -6.662
  553   2HB   ASP  75           1HB      ASP  75   3.778  -0.570  -6.688
  554    H    SER  76             H      SER  76   1.993   3.457  -5.627
  555    HA   SER  76            HA      SER  76   4.175   3.835  -3.606
  556   1HB   SER  76           2HB      SER  76   3.833   5.600  -5.731
  557   2HB   SER  76           1HB      SER  76   2.940   6.351  -4.437
  558    HG   SER  76            HG      SER  76   5.480   6.462  -4.781
  559    H    LEU  77             H      LEU  77   0.969   3.164  -4.145
  560    HA   LEU  77            HA      LEU  77  -0.793   4.655  -2.608
  561   1HB   LEU  77           2HB      LEU  77  -1.130   2.464  -3.895
  562   2HB   LEU  77           1HB      LEU  77  -0.533   1.620  -2.483
  563    HG   LEU  77            HG      LEU  77  -2.365   2.691  -1.174
  564   1HD1  LEU  77          1HD1      LEU  77  -3.157   3.557  -3.954
  565   2HD1  LEU  77          3HD1      LEU  77  -4.231   3.635  -2.561
  566   3HD1  LEU  77          2HD1      LEU  77  -2.771   4.624  -2.605
  567   1HD2  LEU  77          3HD2      LEU  77  -2.942   0.978  -3.613
  568   2HD2  LEU  77          2HD2      LEU  77  -2.695   0.445  -1.938
  569   3HD2  LEU  77          1HD2      LEU  77  -4.167   1.311  -2.374
  570    H    LEU  78             H      LEU  78   1.833   2.607  -1.440
  571    HA   LEU  78            HA      LEU  78   0.925   3.169   1.255
  572   1HB   LEU  78           2HB      LEU  78   2.959   1.356   0.267
  573   2HB   LEU  78           1HB      LEU  78   2.700   1.598   1.961
  574    HG   LEU  78            HG      LEU  78   0.526   0.778   0.010
  575   1HD1  LEU  78          2HD1      LEU  78   2.306  -0.981   0.240
  576   2HD1  LEU  78          1HD1      LEU  78   1.970  -1.017   1.972
  577   3HD1  LEU  78          3HD1      LEU  78   0.708  -1.487   0.822
  578   1HD2  LEU  78          2HD2      LEU  78   0.718   0.989   3.018
  579   2HD2  LEU  78          1HD2      LEU  78  -0.402   1.822   1.941
  580   3HD2  LEU  78          3HD2      LEU  78  -0.567   0.087   2.211
  581    H    GLN  79             H      GLN  79   1.704   4.743   2.330
  582    HA   GLN  79            HA      GLN  79   2.998   6.861   1.516
  583   1HB   GLN  79           2HB      GLN  79   3.251   7.486   3.920
  584   2HB   GLN  79           1HB      GLN  79   1.629   6.959   3.485
  585   1HG   GLN  79           2HG      GLN  79   2.262   4.668   4.255
  586   2HG   GLN  79           1HG      GLN  79   3.779   5.344   4.829
  587   1HE2  GLN  79          2HE2      GLN  79   0.334   6.122   6.887
  588   2HE2  GLN  79          1HE2      GLN  79   0.257   5.442   5.335
  589    H    ASP  80             H      ASP  80   4.638   6.010   0.395
  590    HA   ASP  80            HA      ASP  80   7.194   5.717   1.904
  591   1HB   ASP  80           2HB      ASP  80   6.824   4.002   0.134
  592   2HB   ASP  80           1HB      ASP  80   6.564   5.282  -1.048
  593    H    GLY  81             H      GLY  81   5.287   8.121   1.449
  594   1HA   GLY  81           2HA      GLY  81   5.864  10.440   1.383
  595   2HA   GLY  81           1HA      GLY  81   7.226  10.030   0.328
  596    H    GLU  82             H      GLU  82   4.030   8.533  -0.167
  597    HA   GLU  82            HA      GLU  82   3.396  10.289  -2.395
  598   1HB   GLU  82           2HB      GLU  82   4.478   7.584  -2.556
  599   2HB   GLU  82           1HB      GLU  82   3.236   8.033  -3.662
  600   1HG   GLU  82           2HG      GLU  82   4.988   8.700  -4.929
  601   2HG   GLU  82           1HG      GLU  82   4.782  10.177  -3.967
  602    H    PHE  83             H      PHE  83   2.485   7.075  -1.134
  603    HA   PHE  83            HA      PHE  83   0.458   5.933  -1.220
  604   1HB   PHE  83           2HB      PHE  83  -1.502   7.603  -0.543
  605   2HB   PHE  83           1HB      PHE  83  -0.693   6.658   0.506
  606    HD1  PHE  83           HD2      PHE  83   1.553   7.738   1.060
  607    HD2  PHE  83           HD1      PHE  83  -1.946   9.659   0.054
  608    HE1  PHE  83           HE2      PHE  83   2.413   9.716   2.327
  609    HE2  PHE  83           HE1      PHE  83  -1.247  11.725   1.299
  610    HZ   PHE  83            HZ      PHE  83   0.969  11.745   2.447
  611    H    SER  84             H      SER  84   1.110   6.539  -3.696
  612    HA   SER  84            HA      SER  84  -1.476   7.025  -5.089
  613   1HB   SER  84           2HB      SER  84  -0.145   8.435  -6.794
  614   2HB   SER  84           1HB      SER  84  -0.551   9.222  -5.271
  615    HG   SER  84            HG      SER  84   1.529   9.560  -5.201
  616    H    MET  85             H      MET  85  -1.682   5.660  -6.757
  617    HA   MET  85            HA      MET  85   0.667   3.988  -7.604
  618   1HB   MET  85           2HB      MET  85  -0.983   3.181  -5.743
  619   2HB   MET  85           1HB      MET  85  -2.082   2.985  -7.055
  620   1HG   MET  85           2HG      MET  85  -1.188   1.060  -7.613
  621   2HG   MET  85           1HG      MET  85   0.394   1.785  -7.743
  622   1HE   MET  85           2HE      MET  85  -1.515  -0.621  -6.702
  623   2HE   MET  85           1HE      MET  85   0.020  -1.433  -6.242
  624   3HE   MET  85           3HE      MET  85  -1.229  -1.096  -5.016
  625    H    ASP  86             H      ASP  86   0.703   3.775  -9.925
  626    HA   ASP  86            HA      ASP  86  -1.694   4.927 -11.316
  627   1HB   ASP  86           2HB      ASP  86   1.107   4.368 -11.954
  628   2HB   ASP  86           1HB      ASP  86  -0.031   4.345 -13.269
  629    H    LEU  87             H      LEU  87  -3.046   2.931 -10.724
  630    HA   LEU  87            HA      LEU  87  -2.270   0.627 -12.317
  631   1HB   LEU  87           2HB      LEU  87  -4.374  -0.467 -11.203
  632   2HB   LEU  87           1HB      LEU  87  -2.828  -0.452 -10.426
  633    HG   LEU  87            HG      LEU  87  -4.599   0.063  -8.846
  634   1HD1  LEU  87          3HD1      LEU  87  -2.288   1.572  -9.207
  635   2HD1  LEU  87          2HD1      LEU  87  -3.559   2.741  -8.822
  636   3HD1  LEU  87          1HD1      LEU  87  -3.239   1.390  -7.733
  637   1HD2  LEU  87          1HD2      LEU  87  -5.886   1.261 -10.861
  638   2HD2  LEU  87          3HD2      LEU  87  -6.239   1.598  -9.177
  639   3HD2  LEU  87          2HD2      LEU  87  -5.201   2.689 -10.088
  640    NH1  ARG  88           NH1      ARG  88  -0.253   3.862 -18.993
  641    NH2  ARG  88           NH2      ARG  88   0.722   2.243 -20.232
  642    H    ARG  88             H      ARG  88  -2.779   0.584 -14.281
  643    HA   ARG  88            HA      ARG  88  -5.343   1.920 -15.107
  644   1HB   ARG  88           2HB      ARG  88  -4.303   2.691 -17.042
  645   2HB   ARG  88           1HB      ARG  88  -2.928   2.637 -15.973
  646   1HG   ARG  88           2HG      ARG  88  -2.133   0.566 -17.005
  647   2HG   ARG  88           1HG      ARG  88  -3.637   0.371 -17.930
  648   1HD   ARG  88           2HD      ARG  88  -2.856   1.680 -19.555
  649   2HD   ARG  88           1HD      ARG  88  -2.547   3.013 -18.407
  650    HE   ARG  88            HE      ARG  88  -0.519   0.873 -18.441
  651   1HH1  ARG  88          2HH1      ARG  88  -0.920   4.142 -18.303
  652   2HH1  ARG  88          1HH1      ARG  88   0.332   4.546 -19.426
  653   1HH2  ARG  88          1HH2      ARG  88   0.802   1.281 -20.492
  654   2HH2  ARG  88          2HH2      ARG  88   1.307   2.929 -20.667
  655    H    THR  89             H      THR  89  -6.873   0.909 -16.268
  656    HA   THR  89            HA      THR  89  -7.016  -1.966 -16.431
  657    HB   THR  89            HB      THR  89  -9.124  -1.603 -17.486
  658    HG1  THR  89           HG1      THR  89  -8.069   0.749 -18.395
  659   1HG2  THR  89          1HG2      THR  89  -8.666  -0.193 -15.265
  660   2HG2  THR  89          3HG2      THR  89  -9.059   1.129 -16.375
  661   3HG2  THR  89          2HG2      THR  89 -10.229  -0.170 -16.083
  662    H    LYS  90             H      LYS  90  -5.150  -2.667 -17.587
  663    HA   LYS  90            HA      LYS  90  -4.399  -1.420 -20.023
  664   1HB   LYS  90           2HB      LYS  90  -3.302  -4.108 -19.407
  665   2HB   LYS  90           1HB      LYS  90  -2.519  -2.640 -19.953
  666   1HG   LYS  90           2HG      LYS  90  -2.910  -1.687 -17.670
  667   2HG   LYS  90           1HG      LYS  90  -3.258  -3.350 -17.155
  668   1HD   LYS  90           2HD      LYS  90  -0.802  -2.821 -18.837
  669   2HD   LYS  90           1HD      LYS  90  -0.735  -2.438 -17.131
  670   1HE   LYS  90           2HE      LYS  90  -1.393  -4.750 -16.561
  671   2HE   LYS  90           1HE      LYS  90  -1.508  -5.138 -18.274
  672   1HZ   LYS  90           2HZ      LYS  90   0.945  -4.199 -18.227
  673   2HZ   LYS  90           1HZ      LYS  90   0.859  -4.718 -16.611
  674   3HZ   LYS  90           3HZ      LYS  90   0.602  -5.824 -17.870
  675    H    SER  91             H      SER  91  -4.073  -2.783 -21.943
  676    HA   SER  91            HA      SER  91  -6.451  -4.507 -22.445
  677   1HB   SER  91           2HB      SER  91  -6.895  -2.720 -23.825
  678   2HB   SER  91           1HB      SER  91  -5.239  -2.273 -23.966
  679    HG   SER  91            HG      SER  91  -4.982  -3.607 -25.623
  680    H    THR  92             H      THR  92  -5.987  -5.864 -24.595
  681    HA   THR  92            HA      THR  92  -3.195  -6.899 -24.565
  682    HB   THR  92            HB      THR  92  -3.959  -9.216 -24.349
  683    HG1  THR  92           HG1      THR  92  -6.087  -9.683 -24.104
  684   1HG2  THR  92          2HG2      THR  92  -3.473  -7.786 -22.318
  685   2HG2  THR  92          1HG2      THR  92  -5.213  -7.544 -22.159
  686   3HG2  THR  92          3HG2      THR  92  -4.531  -9.164 -22.015
  687    H    GLY  93             H      GLY  93  -2.978  -5.983 -26.636
  688   1HA   GLY  93           2HA      GLY  93  -3.060  -5.915 -28.975
  689   2HA   GLY  93           1HA      GLY  93  -3.376  -7.642 -28.856
  690    H    GLY  94             H      GLY  94  -4.766  -4.503 -29.435
  691   1HA   GLY  94           2HA      GLY  94  -6.690  -4.166 -30.834
  692   2HA   GLY  94           1HA      GLY  94  -7.216  -5.805 -30.476
  693    H    ALA  95             H      ALA  95  -6.603  -4.923 -27.453
  694    HA   ALA  95            HA      ALA  95  -9.395  -3.998 -27.030
  695   1HB   ALA  95           1HB      ALA  95  -7.708  -5.720 -25.581
  696   2HB   ALA  95           3HB      ALA  95  -7.880  -4.282 -24.569
  697   3HB   ALA  95           2HB      ALA  95  -9.314  -5.158 -25.112
  698    HA   PRO  96            HA      PRO  96  -8.289   0.081 -25.824
  699   1HB   PRO  96           2HB      PRO  96 -10.475   0.682 -24.328
  700   2HB   PRO  96           1HB      PRO  96 -10.576   0.408 -26.079
  701   1HG   PRO  96           2HG      PRO  96 -11.496  -1.377 -23.874
  702   2HG   PRO  96           1HG      PRO  96 -12.024  -1.329 -25.553
  703   1HD   PRO  96           2HD      PRO  96 -10.166  -3.147 -24.359
  704   2HD   PRO  96           1HD      PRO  96 -10.682  -3.046 -26.054
  705    H    THR  97             H      THR  97  -7.487   1.346 -24.034
  706    HA   THR  97            HA      THR  97  -7.256  -0.138 -21.418
  707    HB   THR  97            HB      THR  97  -5.159   1.195 -21.041
  708    HG1  THR  97           HG1      THR  97  -4.951   2.854 -22.309
  709   1HG2  THR  97          2HG2      THR  97  -5.394  -1.099 -22.370
  710   2HG2  THR  97          1HG2      THR  97  -4.771  -0.126 -23.699
  711   3HG2  THR  97          3HG2      THR  97  -3.837  -0.284 -22.210
  712    H    PHE  98             H      PHE  98  -6.875   1.452 -19.620
  713    HA   PHE  98            HA      PHE  98  -8.031   4.122 -19.740
  714   1HB   PHE  98           2HB      PHE  98  -9.432   1.986 -18.075
  715   2HB   PHE  98           1HB      PHE  98  -9.842   3.697 -18.133
  716    HD1  PHE  98           HD1      PHE  98 -10.234   4.647 -20.617
  717    HD2  PHE  98           HD2      PHE  98 -10.645   0.538 -19.453
  718    HE1  PHE  98           HE1      PHE  98 -11.659   4.247 -22.590
  719    HE2  PHE  98           HE2      PHE  98 -12.075   0.126 -21.438
  720    HZ   PHE  98            HZ      PHE  98 -12.581   1.980 -23.007
  721    H    ASN  99             H      ASN  99  -7.476   5.300 -17.744
  722    HA   ASN  99            HA      ASN  99  -5.538   3.714 -16.098
  723   1HB   ASN  99           2HB      ASN  99  -4.994   6.638 -16.468
  724   2HB   ASN  99           1HB      ASN  99  -3.870   5.311 -16.163
  725   1HD2  ASN  99          2HD2      ASN  99  -2.948   5.698 -19.556
  726   2HD2  ASN  99          1HD2      ASN  99  -2.501   5.965 -17.939
  727    H    VAL 100             H      VAL 100  -5.394   4.042 -13.987
  728    HA   VAL 100            HA      VAL 100  -7.348   5.829 -12.638
  729    HB   VAL 100            HB      VAL 100  -6.605   3.061 -11.623
  730   1HG1  VAL 100          3HG1      VAL 100  -7.826   5.030 -10.355
  731   2HG1  VAL 100          2HG1      VAL 100  -9.233   4.377 -11.184
  732   3HG1  VAL 100          1HG1      VAL 100  -8.289   3.352 -10.118
  733   1HG2  VAL 100          3HG2      VAL 100  -8.779   3.800 -13.610
  734   2HG2  VAL 100          2HG2      VAL 100  -7.557   2.541 -13.760
  735   3HG2  VAL 100          1HG2      VAL 100  -8.874   2.356 -12.610
  736    H    THR 101             H      THR 101  -6.411   6.853 -10.852
  737    HA   THR 101            HA      THR 101  -3.743   5.895  -9.997
  738    HB   THR 101            HB      THR 101  -4.895   8.698  -9.723
  739    HG1  THR 101           HG1      THR 101  -2.719   7.749 -11.274
  740   1HG2  THR 101          1HG2      THR 101  -2.896   7.309  -8.234
  741   2HG2  THR 101          3HG2      THR 101  -2.067   8.461  -9.277
  742   3HG2  THR 101          2HG2      THR 101  -3.305   9.023  -8.159
  743    H    VAL 102             H      VAL 102  -3.850   5.041  -8.032
  744    HA   VAL 102            HA      VAL 102  -6.246   5.595  -6.405
  745    HB   VAL 102            HB      VAL 102  -4.681   3.093  -7.025
  746   1HG1  VAL 102          2HG1      VAL 102  -6.131   3.734  -4.461
  747   2HG1  VAL 102          1HG1      VAL 102  -6.359   2.131  -5.159
  748   3HG1  VAL 102          3HG1      VAL 102  -4.745   2.677  -4.725
  749   1HG2  VAL 102          1HG2      VAL 102  -7.520   4.045  -7.111
  750   2HG2  VAL 102          3HG2      VAL 102  -6.532   3.356  -8.383
  751   3HG2  VAL 102          2HG2      VAL 102  -7.151   2.319  -7.105
  752    H    THR 103             H      THR 103  -5.893   6.561  -4.561
  753    HA   THR 103            HA      THR 103  -3.159   6.639  -3.447
  754    HB   THR 103            HB      THR 103  -4.027   8.690  -2.197
  755    HG1  THR 103           HG1      THR 103  -6.094   8.912  -2.432
  756   1HG2  THR 103          3HG2      THR 103  -3.402   8.408  -5.077
  757   2HG2  THR 103          2HG2      THR 103  -4.184   9.928  -4.638
  758   3HG2  THR 103          1HG2      THR 103  -2.665   9.449  -3.853
  759    H    LYS 104             H      LYS 104  -3.175   6.938  -0.988
  760    HA   LYS 104            HA      LYS 104  -5.403   5.470   0.346
  761   1HB   LYS 104           2HB      LYS 104  -3.726   3.797  -0.306
  762   2HB   LYS 104           1HB      LYS 104  -2.490   4.701   0.536
  763   1HG   LYS 104           2HG      LYS 104  -2.978   3.375   2.321
  764   2HG   LYS 104           1HG      LYS 104  -4.403   4.383   2.506
  765   1HD   LYS 104           2HD      LYS 104  -5.062   2.044   2.480
  766   2HD   LYS 104           1HD      LYS 104  -5.656   2.842   1.026
  767   1HE   LYS 104           2HE      LYS 104  -3.971   1.870  -0.325
  768   2HE   LYS 104           1HE      LYS 104  -3.005   1.404   1.069
  769   1HZ   LYS 104           3HZ      LYS 104  -5.704   0.331   0.907
  770   2HZ   LYS 104           2HZ      LYS 104  -4.571  -0.263  -0.208
  771   3HZ   LYS 104           1HZ      LYS 104  -4.271  -0.391   1.456
  772    H    THR 105             H      THR 105  -5.719   6.002   2.449
  773    HA   THR 105            HA      THR 105  -3.958   8.112   3.645
  774    HB   THR 105            HB      THR 105  -5.937   8.832   4.910
  775    HG1  THR 105           HG1      THR 105  -7.558   7.552   5.146
  776   1HG2  THR 105          2HG2      THR 105  -5.865   8.776   1.998
  777   2HG2  THR 105          1HG2      THR 105  -7.514   8.888   2.612
  778   3HG2  THR 105          3HG2      THR 105  -6.314  10.097   3.080
  779    H    ASP 106             H      ASP 106  -5.443   7.518   6.301
  780    HA   ASP 106            HA      ASP 106  -3.831   5.130   7.025
  781   1HB   ASP 106           2HB      ASP 106  -3.568   7.265   8.333
  782   2HB   ASP 106           1HB      ASP 106  -5.235   7.065   8.879
  783    H    LYS 107             H      LYS 107  -7.119   6.122   6.464
  784    HA   LYS 107            HA      LYS 107  -8.062   3.450   7.342
  785   1HB   LYS 107           2HB      LYS 107  -9.583   5.925   8.195
  786   2HB   LYS 107           1HB      LYS 107  -9.818   4.271   8.731
  787   1HG   LYS 107           2HG      LYS 107  -7.490   4.366   9.717
  788   2HG   LYS 107           1HG      LYS 107  -7.517   6.090   9.376
  789   1HD   LYS 107           2HD      LYS 107  -9.281   6.504  10.889
  790   2HD   LYS 107           1HD      LYS 107  -9.767   4.811  10.912
  791   1HE   LYS 107           2HE      LYS 107  -7.242   4.559  11.841
  792   2HE   LYS 107           1HE      LYS 107  -7.613   6.180  12.429
  793   1HZ   LYS 107           1HZ      LYS 107  -9.697   5.241  13.363
  794   2HZ   LYS 107           3HZ      LYS 107  -9.148   3.690  12.945
  795   3HZ   LYS 107           2HZ      LYS 107  -8.285   4.619  14.077
  796    H    THR 108             H      THR 108  -7.781   5.132   4.715
  797    HA   THR 108            HA      THR 108 -10.443   4.380   3.663
  798    HB   THR 108            HB      THR 108 -10.947   6.499   2.713
  799    HG1  THR 108           HG1      THR 108  -8.909   7.112   2.036
  800   1HG2  THR 108          1HG2      THR 108 -11.216   6.209   5.252
  801   2HG2  THR 108          3HG2      THR 108  -9.790   7.241   5.405
  802   3HG2  THR 108          2HG2      THR 108 -11.251   7.864   4.637
  803    H    LEU 109             H      LEU 109 -10.384   4.097   1.382
  804    HA   LEU 109            HA      LEU 109  -7.704   3.835   0.120
  805   1HB   LEU 109           2HB      LEU 109  -9.350   1.810   0.741
  806   2HB   LEU 109           1HB      LEU 109 -10.057   2.195  -0.802
  807    HG   LEU 109            HG      LEU 109  -7.609   0.738  -0.169
  808   1HD1  LEU 109          1HD1      LEU 109  -9.776   0.385  -1.742
  809   2HD1  LEU 109          3HD1      LEU 109  -8.624   0.968  -2.943
  810   3HD1  LEU 109          2HD1      LEU 109  -8.256  -0.465  -1.993
  811   1HD2  LEU 109          2HD2      LEU 109  -7.466   2.995  -2.130
  812   2HD2  LEU 109          1HD2      LEU 109  -6.383   2.646  -0.793
  813   3HD2  LEU 109          3HD2      LEU 109  -6.403   1.596  -2.200
  814    H    VAL 110             H      VAL 110  -7.835   5.960  -1.004
  815    HA   VAL 110            HA      VAL 110 -10.348   6.533  -2.426
  816    HB   VAL 110            HB      VAL 110  -7.785   8.056  -1.829
  817   1HG1  VAL 110          2HG1      VAL 110  -9.510   8.437  -4.220
  818   2HG1  VAL 110          1HG1      VAL 110  -9.108   9.889  -3.316
  819   3HG1  VAL 110          3HG1      VAL 110  -7.831   8.879  -3.975
  820   1HG2  VAL 110          1HG2      VAL 110 -10.382   7.985  -0.763
  821   2HG2  VAL 110          3HG2      VAL 110  -9.164   9.229  -0.450
  822   3HG2  VAL 110          2HG2      VAL 110 -10.370   9.471  -1.730
  823    H    LEU 111             H      LEU 111 -10.520   6.586  -4.641
  824    HA   LEU 111            HA      LEU 111  -8.211   5.649  -6.229
  825   1HB   LEU 111           2HB      LEU 111 -11.010   4.721  -6.920
  826   2HB   LEU 111           1HB      LEU 111  -9.483   4.088  -7.509
  827    HG   LEU 111            HG      LEU 111 -10.788   3.620  -4.845
  828   1HD1  LEU 111          3HD1      LEU 111 -10.828   2.193  -7.177
  829   2HD1  LEU 111          2HD1      LEU 111  -9.498   1.407  -6.310
  830   3HD1  LEU 111          1HD1      LEU 111 -11.106   1.493  -5.584
  831   1HD2  LEU 111          1HD2      LEU 111  -7.999   3.886  -5.250
  832   2HD2  LEU 111          3HD2      LEU 111  -8.842   3.506  -3.772
  833   3HD2  LEU 111          2HD2      LEU 111  -8.356   2.218  -4.872
  834    H    LEU 112             H      LEU 112  -8.315   6.413  -8.379
  835    HA   LEU 112            HA      LEU 112 -10.252   8.570  -8.927
  836   1HB   LEU 112           2HB      LEU 112  -7.799   9.214  -8.242
  837   2HB   LEU 112           1HB      LEU 112  -7.397   8.689  -9.845
  838    HG   LEU 112            HG      LEU 112  -7.725  10.939 -10.260
  839   1HD1  LEU 112          2HD1      LEU 112 -10.564   9.854 -10.417
  840   2HD1  LEU 112          1HD1      LEU 112 -10.063  11.419 -11.075
  841   3HD1  LEU 112          3HD1      LEU 112  -9.382   9.928 -11.729
  842   1HD2  LEU 112          1HD2      LEU 112  -9.697  10.829  -7.990
  843   2HD2  LEU 112          3HD2      LEU 112  -8.120  11.618  -8.025
  844   3HD2  LEU 112          2HD2      LEU 112  -9.456  12.272  -8.981
  845    H    MET 113             H      MET 113 -11.410   7.454 -10.522
  846    HA   MET 113            HA      MET 113  -9.799   5.761 -12.387
  847   1HB   MET 113           2HB      MET 113 -12.152   5.181 -11.392
  848   2HB   MET 113           1HB      MET 113 -12.710   6.149 -12.717
  849   1HG   MET 113           2HG      MET 113 -10.680   4.082 -13.331
  850   2HG   MET 113           1HG      MET 113 -12.326   3.548 -13.027
  851   1HE   MET 113           2HE      MET 113 -13.775   3.194 -14.382
  852   2HE   MET 113           1HE      MET 113 -14.158   3.891 -15.955
  853   3HE   MET 113           3HE      MET 113 -12.850   2.709 -15.801
  854    H    GLY 114             H      GLY 114  -9.718   6.046 -14.536
  855   1HA   GLY 114           2HA      GLY 114 -10.758   8.526 -15.666
  856   2HA   GLY 114           1HA      GLY 114  -9.020   8.270 -15.723
  857    H    LYS 115             H      LYS 115 -10.880   8.505 -17.867
  858    HA   LYS 115            HA      LYS 115 -10.250   6.108 -19.385
  859   1HB   LYS 115           2HB      LYS 115 -12.950   7.409 -19.211
  860   2HB   LYS 115           1HB      LYS 115 -12.452   6.529 -20.651
  861   1HG   LYS 115           2HG      LYS 115 -11.752   4.705 -18.820
  862   2HG   LYS 115           1HG      LYS 115 -13.036   5.495 -17.915
  863   1HD   LYS 115           2HD      LYS 115 -14.649   5.042 -19.667
  864   2HD   LYS 115           1HD      LYS 115 -13.387   4.458 -20.742
  865   1HE   LYS 115           2HE      LYS 115 -13.647   2.384 -19.905
  866   2HE   LYS 115           1HE      LYS 115 -13.189   2.974 -18.307
  867   1HZ   LYS 115           2HZ      LYS 115 -15.920   3.416 -19.319
  868   2HZ   LYS 115           1HZ      LYS 115 -15.500   1.914 -18.646
  869   3HZ   LYS 115           3HZ      LYS 115 -15.372   3.326 -17.714
  870    H    GLU 116             H      GLU 116 -10.323   6.713 -21.726
  871    HA   GLU 116            HA      GLU 116  -8.534   8.210 -22.813
  872   1HB   GLU 116           2HB      GLU 116 -10.261   7.238 -23.781
  873   2HB   GLU 116           1HB      GLU 116 -11.296   8.547 -23.451
  874   1HG   GLU 116           2HG      GLU 116 -10.649   8.843 -25.744
  875   2HG   GLU 116           1HG      GLU 116  -9.654   9.967 -24.833
  876    H    GLY 117             H      GLY 117  -7.854  10.131 -23.494
  877   1HA   GLY 117           2HA      GLY 117  -7.465  12.468 -23.386
  878   2HA   GLY 117           1HA      GLY 117  -9.036  12.658 -22.553
  879    H    VAL 118             H      VAL 118  -7.326   9.862 -21.613
  880    HA   VAL 118            HA      VAL 118  -6.795  10.881 -18.964
  881    HB   VAL 118            HB      VAL 118  -8.407   9.034 -19.812
  882   1HG1  VAL 118          1HG1      VAL 118  -6.728   7.737 -21.007
  883   2HG1  VAL 118          3HG1      VAL 118  -6.013   7.314 -19.451
  884   3HG1  VAL 118          2HG1      VAL 118  -7.684   6.843 -19.809
  885   1HG2  VAL 118          1HG2      VAL 118  -6.582   8.820 -17.391
  886   2HG2  VAL 118          3HG2      VAL 118  -8.256   9.386 -17.455
  887   3HG2  VAL 118          2HG2      VAL 118  -7.895   7.668 -17.645
  888    H    HIS 119             H      HIS 119  -4.695  11.718 -19.007
  889    HA   HIS 119            HA      HIS 119  -2.509  10.249 -20.290
  890   1HB   HIS 119           2HB      HIS 119  -2.605  12.784 -19.998
  891   2HB   HIS 119           1HB      HIS 119  -2.184  12.501 -18.309
  892    HD1  HIS 119           HD1      HIS 119  -0.915  11.400 -21.735
  893    HD2  HIS 119           HD2      HIS 119   0.541  12.346 -17.949
  894    HE1  HIS 119           HE1      HIS 119   1.606  11.232 -21.876
  895    H    GLY 120             H      GLY 120  -3.784  10.770 -17.055
  896   1HA   GLY 120           2HA      GLY 120  -3.690   9.057 -15.346
  897   2HA   GLY 120           1HA      GLY 120  -2.218   8.435 -16.094
  898    H    GLY 121             H      GLY 121  -1.274  11.394 -16.321
  899   1HA   GLY 121           2HA      GLY 121   0.056  11.448 -13.678
  900   2HA   GLY 121           1HA      GLY 121   0.459  12.472 -15.058
  901    H    LEU 122             H      LEU 122  -2.458  13.192 -15.387
  902    HA   LEU 122            HA      LEU 122  -2.493  15.437 -13.459
  903   1HB   LEU 122           2HB      LEU 122  -4.880  14.989 -15.228
  904   2HB   LEU 122           1HB      LEU 122  -4.021  16.480 -14.889
  905    HG   LEU 122            HG      LEU 122  -2.399  14.654 -16.516
  906   1HD1  LEU 122          1HD1      LEU 122  -4.877  14.118 -17.139
  907   2HD1  LEU 122          3HD1      LEU 122  -4.821  15.700 -17.926
  908   3HD1  LEU 122          2HD1      LEU 122  -3.708  14.426 -18.431
  909   1HD2  LEU 122          1HD2      LEU 122  -3.355  17.488 -16.598
  910   2HD2  LEU 122          3HD2      LEU 122  -1.702  16.878 -16.536
  911   3HD2  LEU 122          2HD2      LEU 122  -2.623  16.781 -18.036
  912    H    ILE 123             H      ILE 123  -4.107  12.382 -14.111
  913    HA   ILE 123            HA      ILE 123  -6.237  12.722 -12.159
  914    HB   ILE 123            HB      ILE 123  -4.940  10.395 -13.560
  915   1HG1  ILE 123          2HG1      ILE 123  -7.793  11.401 -13.857
  916   2HG1  ILE 123          1HG1      ILE 123  -6.470  12.081 -14.811
  917   1HG2  ILE 123          3HG2      ILE 123  -6.228  10.012 -11.142
  918   2HG2  ILE 123          2HG2      ILE 123  -7.553   9.854 -12.272
  919   3HG2  ILE 123          1HG2      ILE 123  -6.161   8.797 -12.415
  920   1HD1  ILE 123          3HD1      ILE 123  -6.604   9.124 -14.737
  921   2HD1  ILE 123          2HD1      ILE 123  -7.925   9.941 -15.571
  922   3HD1  ILE 123          1HD1      ILE 123  -6.261  10.226 -16.068
  923    H    ASN 124             H      ASN 124  -2.938  11.459 -12.277
  924    HA   ASN 124            HA      ASN 124  -2.866  10.403  -9.638
  925   1HB   ASN 124           2HB      ASN 124  -1.150   9.837 -11.361
  926   2HB   ASN 124           1HB      ASN 124  -0.596  11.508 -11.309
  927   1HD2  ASN 124          2HD2      ASN 124   1.751  10.412  -8.889
  928   2HD2  ASN 124          1HD2      ASN 124   1.519  11.013 -10.459
  929    H    LYS 125             H      LYS 125  -2.562  13.580 -11.025
  930    HA   LYS 125            HA      LYS 125  -1.451  14.785  -8.520
  931   1HB   LYS 125           2HB      LYS 125  -1.210  16.703  -9.858
  932   2HB   LYS 125           1HB      LYS 125  -1.384  15.534 -11.166
  933   1HG   LYS 125           2HG      LYS 125  -2.926  17.058 -11.877
  934   2HG   LYS 125           1HG      LYS 125  -3.948  16.139 -10.812
  935   1HD   LYS 125           2HD      LYS 125  -4.399  18.092  -9.788
  936   2HD   LYS 125           1HD      LYS 125  -2.812  17.871  -9.040
  937   1HE   LYS 125           2HE      LYS 125  -3.371  19.370 -11.626
  938   2HE   LYS 125           1HE      LYS 125  -2.978  20.104 -10.072
  939   1HZ   LYS 125           3HZ      LYS 125  -0.896  18.681 -10.171
  940   2HZ   LYS 125           2HZ      LYS 125  -1.255  18.451 -11.814
  941   3HZ   LYS 125           1HZ      LYS 125  -0.967  20.014 -11.215
  942    H    LYS 126             H      LYS 126  -4.583  14.317 -10.069
  943    HA   LYS 126            HA      LYS 126  -6.123  15.906  -8.148
  944   1HB   LYS 126           2HB      LYS 126  -6.884  14.087 -10.422
  945   2HB   LYS 126           1HB      LYS 126  -8.071  14.903  -9.403
  946   1HG   LYS 126           2HG      LYS 126  -7.162  17.081 -10.007
  947   2HG   LYS 126           1HG      LYS 126  -5.870  16.321 -10.925
  948   1HD   LYS 126           2HD      LYS 126  -8.498  15.362 -11.730
  949   2HD   LYS 126           1HD      LYS 126  -8.331  17.101 -11.929
  950   1HE   LYS 126           2HE      LYS 126  -6.495  14.971 -13.071
  951   2HE   LYS 126           1HE      LYS 126  -7.610  15.994 -13.976
  952   1HZ   LYS 126           3HZ      LYS 126  -6.021  17.719 -12.486
  953   2HZ   LYS 126           2HZ      LYS 126  -4.964  16.567 -13.142
  954   3HZ   LYS 126           1HZ      LYS 126  -5.975  17.467 -14.161
  955    H    CYS 127             H      CYS 127  -4.876  12.739  -8.198
  956    HA   CYS 127            HA      CYS 127  -6.936  11.546  -6.463
  957   1HB   CYS 127           2HB      CYS 127  -5.475  10.259  -8.209
  958   2HB   CYS 127           1HB      CYS 127  -4.228  10.345  -6.997
  959    HG   CYS 127            HG      CYS 127  -6.993   9.026  -6.407
  960    OH   TYR 128            OH      TYR 128   2.561  13.716  -1.733
  961    H    TYR 128             H      TYR 128  -3.777  12.994  -6.485
  962    HA   TYR 128            HA      TYR 128  -3.012  12.507  -3.762
  963   1HB   TYR 128           2HB      TYR 128  -1.827  13.543  -5.970
  964   2HB   TYR 128           1HB      TYR 128  -2.311  15.042  -5.195
  965    HD1  TYR 128           HD1      TYR 128  -1.960  13.640  -2.280
  966    HD2  TYR 128           HD2      TYR 128   0.471  14.177  -5.793
  967    HE1  TYR 128           HE1      TYR 128   0.071  13.516  -0.867
  968    HE2  TYR 128           HE2      TYR 128   2.520  14.056  -4.365
  969    HH   TYR 128            HH      TYR 128   3.235  13.242  -2.218
  970    H    GLU 129             H      GLU 129  -4.969  14.937  -5.497
  971    HA   GLU 129            HA      GLU 129  -5.410  16.667  -3.145
  972   1HB   GLU 129           2HB      GLU 129  -6.944  16.560  -5.766
  973   2HB   GLU 129           1HB      GLU 129  -6.957  17.884  -4.599
  974   1HG   GLU 129           2HG      GLU 129  -4.233  17.462  -5.129
  975   2HG   GLU 129           1HG      GLU 129  -5.014  17.297  -6.700
  976    H    MET 130             H      MET 130  -7.121  14.024  -4.729
  977    HA   MET 130            HA      MET 130  -9.664  14.243  -3.403
  978   1HB   MET 130           2HB      MET 130  -8.680  12.711  -5.427
  979   2HB   MET 130           1HB      MET 130  -8.507  11.554  -4.122
  980   1HG   MET 130           2HG      MET 130 -11.000  12.022  -3.593
  981   2HG   MET 130           1HG      MET 130 -11.059  12.835  -5.178
  982   1HE   MET 130           3HE      MET 130 -12.926  11.220  -4.746
  983   2HE   MET 130           2HE      MET 130 -12.984  10.279  -6.233
  984   3HE   MET 130           1HE      MET 130 -12.790   9.458  -4.687
  985    H    ALA 131             H      ALA 131  -6.626  12.566  -2.645
  986    HA   ALA 131            HA      ALA 131  -7.483  11.610  -0.002
  987   1HB   ALA 131           2HB      ALA 131  -4.993  11.383  -1.692
  988   2HB   ALA 131           1HB      ALA 131  -4.863  11.148   0.060
  989   3HB   ALA 131           3HB      ALA 131  -5.931  10.114  -0.888
  990    H    SER 132             H      SER 132  -6.107  14.498  -1.363
  991    HA   SER 132            HA      SER 132  -4.587  15.441   0.866
  992   1HB   SER 132           2HB      SER 132  -6.108  16.906  -1.294
  993   2HB   SER 132           1HB      SER 132  -5.229  17.753  -0.040
  994    HG   SER 132            HG      SER 132  -3.364  16.619  -0.715
  995    H    HIS 133             H      HIS 133  -8.055  15.372   0.063
  996    HA   HIS 133            HA      HIS 133  -8.755  16.923   2.448
  997   1HB   HIS 133           2HB      HIS 133 -10.247  16.758   0.374
  998   2HB   HIS 133           1HB      HIS 133 -10.725  15.151   0.986
  999    HD1  HIS 133           HD1      HIS 133 -10.477  18.760   2.235
 1000    HD2  HIS 133           HD2      HIS 133 -12.620  15.261   2.990
 1001    HE1  HIS 133           HE1      HIS 133 -12.214  19.348   3.982
 1002    H    LEU 134             H      LEU 134  -8.636  13.473   1.435
 1003    HA   LEU 134            HA      LEU 134  -9.724  12.559   3.984
 1004   1HB   LEU 134           2HB      LEU 134  -8.166  11.221   1.797
 1005   2HB   LEU 134           1HB      LEU 134  -8.612  10.372   3.269
 1006    HG   LEU 134            HG      LEU 134 -10.953  11.629   2.578
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.369  11.136   0.152
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.052  10.631   0.101
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.645  12.313   0.444
 1010   1HD2  LEU 134          1HD2      LEU 134 -10.308   9.177   3.245
 1011   2HD2  LEU 134          3HD2      LEU 134 -11.803   9.475   2.362
 1012   3HD2  LEU 134          2HD2      LEU 134 -10.372   8.902   1.508
 1013    NH1  ARG 135           NH1      ARG 135  -2.280  13.231   7.373
 1014    NH2  ARG 135           NH2      ARG 135  -3.565  11.372   7.453
 1015    H    ARG 135             H      ARG 135  -6.779  13.959   3.285
 1016    HA   ARG 135            HA      ARG 135  -5.371  12.692   5.571
 1017   1HB   ARG 135           2HB      ARG 135  -4.546  14.492   3.315
 1018   2HB   ARG 135           1HB      ARG 135  -3.641  14.591   4.823
 1019   1HG   ARG 135           2HG      ARG 135  -4.067  11.808   4.128
 1020   2HG   ARG 135           1HG      ARG 135  -3.343  12.657   2.764
 1021   1HD   ARG 135           2HD      ARG 135  -1.371  12.336   3.846
 1022   2HD   ARG 135           1HD      ARG 135  -1.895  13.648   4.899
 1023    HE   ARG 135            HE      ARG 135  -1.846  10.797   5.589
 1024   1HH1  ARG 135          2HH1      ARG 135  -1.597  13.794   6.907
 1025   2HH1  ARG 135          1HH1      ARG 135  -2.662  13.530   8.249
 1026   1HH2  ARG 135          1HH2      ARG 135  -3.870  10.510   7.049
 1027   2HH2  ARG 135          2HH2      ARG 135  -3.940  11.673   8.330
 1028    NH1  ARG 136           NH2      ARG 136  -5.902  22.581   4.335
 1029    NH2  ARG 136           NH1      ARG 136  -4.167  21.708   3.183
 1030    H    ARG 136             H      ARG 136  -6.854  15.670   4.434
 1031    HA   ARG 136            HA      ARG 136  -6.443  17.072   6.964
 1032   1HB   ARG 136           2HB      ARG 136  -7.987  17.681   4.443
 1033   2HB   ARG 136           1HB      ARG 136  -8.083  18.718   5.867
 1034   1HG   ARG 136           2HG      ARG 136  -5.312  18.068   5.142
 1035   2HG   ARG 136           1HG      ARG 136  -6.170  18.900   3.846
 1036   1HD   ARG 136           2HD      ARG 136  -6.887  20.638   5.510
 1037   2HD   ARG 136           1HD      ARG 136  -5.869  19.844   6.713
 1038    HE   ARG 136            HE      ARG 136  -3.920  20.564   5.481
 1039   1HH1  ARG 136          1HH2      ARG 136  -6.511  22.565   5.127
 1040   2HH1  ARG 136          2HH2      ARG 136  -6.014  23.283   3.633
 1041   1HH2  ARG 136          2HH1      ARG 136  -3.446  21.022   3.094
 1042   2HH2  ARG 136          1HH1      ARG 136  -4.280  22.411   2.480
 1043    H    SER 137             H      SER 137  -8.389  14.566   5.943
 1044    HA   SER 137            HA      SER 137 -10.864  15.287   7.295
 1045   1HB   SER 137           2HB      SER 137 -11.649  13.153   6.485
 1046   2HB   SER 137           1HB      SER 137 -10.677  13.820   5.197
 1047    HG   SER 137            HG      SER 137 -10.298  11.551   5.836
 1048    H    GLN 138             H      GLN 138  -7.767  13.944   8.145
 1049    HA   GLN 138            HA      GLN 138  -6.941  13.216  10.223
 1050   1HB   GLN 138           2HB      GLN 138  -9.452  14.550  10.923
 1051   2HB   GLN 138           1HB      GLN 138  -9.125  13.197  12.001
 1052   1HG   GLN 138           2HG      GLN 138  -6.929  14.099  12.540
 1053   2HG   GLN 138           1HG      GLN 138  -7.128  15.381  11.342
 1054   1HE2  GLN 138          2HE2      GLN 138  -9.829  16.916  13.397
 1055   2HE2  GLN 138          1HE2      GLN 138  -9.689  16.332  11.810
 1056    OH   TYR 139            OH      TYR 139 -15.014   9.276   9.320
 1057    H    TYR 139             H      TYR 139  -8.032  11.437   8.234
 1058    HA   TYR 139            HA      TYR 139  -9.179   9.218   9.876
 1059   1HB   TYR 139           2HB      TYR 139  -9.378  10.023   7.019
 1060   2HB   TYR 139           1HB      TYR 139  -9.297   8.290   7.330
 1061    HD1  TYR 139           HD1      TYR 139 -10.993   7.198   8.793
 1062    HD2  TYR 139           HD2      TYR 139 -11.310  11.322   7.639
 1063    HE1  TYR 139           HE1      TYR 139 -13.376   7.206   9.475
 1064    HE2  TYR 139           HE2      TYR 139 -13.691  11.333   8.320
 1065    HH   TYR 139            HH      TYR 139 -15.532   9.605   8.581
   
  Start of MODEL          17
 Raw file had 1065 H/Q atoms
  Start of MODEL   17
    1   1H    ALA   1            2H      ALA   1 -19.922  20.880   0.699
    2   2H    ALA   1            1H      ALA   1 -21.269  20.999  -0.331
    3   3H    ALA   1            3H      ALA   1 -21.398  20.158   1.135
    4    HA   ALA   1            HA      ALA   1 -21.176  18.428  -0.338
    5   1HB   ALA   1           3HB      ALA   1 -19.248  20.248  -1.806
    6   2HB   ALA   1           2HB      ALA   1 -19.522  18.564  -2.244
    7   3HB   ALA   1           1HB      ALA   1 -20.844  19.729  -2.350
    8    H    GLY   2             H      GLY   2 -19.955  16.687   0.286
    9   1HA   GLY   2           2HA      GLY   2 -17.256  17.209   1.502
   10   2HA   GLY   2           1HA      GLY   2 -18.401  16.064   2.206
   11    CH2  TRP   3           CH2      TRP   3 -13.286  11.518   3.547
   12    H    TRP   3             H      TRP   3 -18.305  13.966   1.514
   13    HA   TRP   3            HA      TRP   3 -16.284  12.895  -0.072
   14   1HB   TRP   3           2HB      TRP   3 -18.839  11.956   0.835
   15   2HB   TRP   3           1HB      TRP   3 -18.058  11.028  -0.403
   16    HD1  TRP   3           HD1      TRP   3 -18.275   9.404   1.853
   17    HE1  TRP   3           HE1      TRP   3 -16.449   8.756   3.524
   18    HE3  TRP   3           HE3      TRP   3 -14.927  13.304   1.169
   19    HZ2  TRP   3           HZ2      TRP   3 -13.965   9.700   4.449
   20    HZ3  TRP   3           HZ3      TRP   3 -12.856  13.328   2.482
   21    HH2  TRP   3           HH2      TRP   3 -12.371  11.545   4.117
   22    H    ASN   4             H      ASN   4 -19.601  13.705  -1.038
   23    HA   ASN   4            HA      ASN   4 -19.422  12.808  -3.747
   24   1HB   ASN   4           2HB      ASN   4 -21.217  14.718  -2.281
   25   2HB   ASN   4           1HB      ASN   4 -21.325  14.609  -4.037
   26   1HD2  ASN   4          2HD2      ASN   4 -22.308  11.060  -3.845
   27   2HD2  ASN   4          1HD2      ASN   4 -21.174  12.005  -4.684
   28    H    ALA   5             H      ALA   5 -18.127  15.615  -2.274
   29    HA   ALA   5            HA      ALA   5 -17.873  17.249  -4.709
   30   1HB   ALA   5           1HB      ALA   5 -17.555  17.721  -1.921
   31   2HB   ALA   5           3HB      ALA   5 -15.958  17.962  -2.629
   32   3HB   ALA   5           2HB      ALA   5 -17.337  18.883  -3.226
   33    OH   TYR   6            OH      TYR   6 -13.818  17.904   1.058
   34    H    TYR   6             H      TYR   6 -15.857  15.023  -2.761
   35    HA   TYR   6            HA      TYR   6 -13.537  15.334  -4.547
   36   1HB   TYR   6           2HB      TYR   6 -13.986  13.054  -2.617
   37   2HB   TYR   6           1HB      TYR   6 -12.447  13.715  -3.195
   38    HD1  TYR   6           HD1      TYR   6 -12.172  16.330  -2.857
   39    HD2  TYR   6           HD2      TYR   6 -14.791  13.829  -0.666
   40    HE1  TYR   6           HE1      TYR   6 -12.364  18.088  -1.124
   41    HE2  TYR   6           HE2      TYR   6 -14.982  15.542   1.114
   42    HH   TYR   6            HH      TYR   6 -14.540  18.479   0.794
   43    H    ILE   7             H      ILE   7 -16.525  13.824  -4.728
   44    HA   ILE   7            HA      ILE   7 -15.698  11.860  -6.771
   45    HB   ILE   7            HB      ILE   7 -18.305  12.460  -5.427
   46   1HG1  ILE   7          2HG1      ILE   7 -16.478  10.943  -4.487
   47   2HG1  ILE   7          1HG1      ILE   7 -18.079  10.235  -4.603
   48   1HG2  ILE   7          1HG2      ILE   7 -17.828  11.176  -8.066
   49   2HG2  ILE   7          3HG2      ILE   7 -19.013  10.411  -6.998
   50   3HG2  ILE   7          2HG2      ILE   7 -19.231  12.089  -7.508
   51   1HD1  ILE   7          2HD1      ILE   7 -16.451   9.903  -7.013
   52   2HD1  ILE   7          1HD1      ILE   7 -15.774   9.119  -5.589
   53   3HD1  ILE   7          3HD1      ILE   7 -17.401   8.715  -6.130
   54    H    ASP   8             H      ASP   8 -17.034  15.058  -6.266
   55    HA   ASP   8            HA      ASP   8 -17.938  15.654  -8.859
   56   1HB   ASP   8           2HB      ASP   8 -17.292  17.191  -6.471
   57   2HB   ASP   8           1HB      ASP   8 -17.323  18.074  -7.939
   58    H    ASN   9             H      ASN   9 -14.871  15.253  -7.454
   59    HA   ASN   9            HA      ASN   9 -13.124  16.751  -8.931
   60   1HB   ASN   9           2HB      ASN   9 -11.896  15.554  -7.440
   61   2HB   ASN   9           1HB      ASN   9 -13.142  14.501  -7.175
   62   1HD2  ASN   9          2HD2      ASN   9 -11.333  11.568  -8.588
   63   2HD2  ASN   9          1HD2      ASN   9 -12.500  12.175  -7.454
   64    H    LEU  10             H      LEU  10 -14.340  13.719  -9.501
   65    HA   LEU  10            HA      LEU  10 -13.288  12.995 -11.944
   66   1HB   LEU  10           2HB      LEU  10 -15.917  12.376 -10.710
   67   2HB   LEU  10           1HB      LEU  10 -15.287  11.542 -12.101
   68    HG   LEU  10            HG      LEU  10 -14.608  10.124 -10.559
   69   1HD1  LEU  10          3HD1      LEU  10 -12.410  12.182 -10.389
   70   2HD1  LEU  10          2HD1      LEU  10 -12.291  10.583  -9.743
   71   3HD1  LEU  10          1HD1      LEU  10 -12.498  10.793 -11.457
   72   1HD2  LEU  10          1HD2      LEU  10 -14.761  12.380  -8.611
   73   2HD2  LEU  10          3HD2      LEU  10 -15.577  10.858  -8.550
   74   3HD2  LEU  10          2HD2      LEU  10 -13.871  10.999  -8.167
   75    H    MET  11             H      MET  11 -16.123  14.588 -11.057
   76    HA   MET  11            HA      MET  11 -16.987  14.576 -13.837
   77   1HB   MET  11           2HB      MET  11 -18.069  15.993 -11.380
   78   2HB   MET  11           1HB      MET  11 -18.946  15.667 -12.881
   79   1HG   MET  11           2HG      MET  11 -17.626  13.260 -11.309
   80   2HG   MET  11           1HG      MET  11 -19.266  13.885 -10.892
   81   1HE   MET  11           2HE      MET  11 -17.145  11.849 -12.618
   82   2HE   MET  11           1HE      MET  11 -18.131  10.833 -13.662
   83   3HE   MET  11           3HE      MET  11 -17.300  12.253 -14.322
   84    H    ALA  12             H      ALA  12 -15.168  16.748 -11.815
   85    HA   ALA  12            HA      ALA  12 -15.216  19.044 -13.594
   86   1HB   ALA  12           3HB      ALA  12 -13.995  18.399 -10.939
   87   2HB   ALA  12           2HB      ALA  12 -13.332  19.746 -11.887
   88   3HB   ALA  12           1HB      ALA  12 -15.029  19.765 -11.403
   89    H    ASP  13             H      ASP  13 -13.032  16.430 -12.967
   90    HA   ASP  13            HA      ASP  13 -10.616  17.525 -14.022
   91   1HB   ASP  13           2HB      ASP  13  -9.907  14.956 -14.057
   92   2HB   ASP  13           1HB      ASP  13 -10.092  15.833 -12.556
   93    H    GLY  14             H      GLY  14 -13.198  16.524 -15.956
   94   1HA   GLY  14           2HA      GLY  14 -13.216  15.504 -18.202
   95   2HA   GLY  14           1HA      GLY  14 -12.262  16.956 -18.481
   96    H    THR  15             H      THR  15 -11.337  14.101 -16.657
   97    HA   THR  15            HA      THR  15  -9.301  13.185 -18.559
   98    HB   THR  15            HB      THR  15  -8.816  14.236 -15.775
   99    HG1  THR  15           HG1      THR  15  -7.825  14.945 -18.329
  100   1HG2  THR  15          3HG2      THR  15  -7.055  12.721 -17.654
  101   2HG2  THR  15          2HG2      THR  15  -6.460  13.616 -16.254
  102   3HG2  THR  15          1HG2      THR  15  -7.561  12.263 -16.035
  103    H    CYS  16             H      CYS  16 -10.971  12.810 -15.513
  104    HA   CYS  16            HA      CYS  16 -10.169  10.155 -14.976
  105   1HB   CYS  16           2HB      CYS  16 -11.411  10.515 -13.029
  106   2HB   CYS  16           1HB      CYS  16 -11.244  12.130 -13.543
  107    HG   CYS  16            HG      CYS  16 -13.827  10.496 -14.159
  108    H    GLN  17             H      GLN  17 -12.342   8.701 -14.472
  109    HA   GLN  17            HA      GLN  17 -14.262   8.603 -16.657
  110   1HB   GLN  17           2HB      GLN  17 -12.063   7.225 -17.091
  111   2HB   GLN  17           1HB      GLN  17 -12.852   6.036 -16.129
  112   1HG   GLN  17           2HG      GLN  17 -14.318   7.339 -18.351
  113   2HG   GLN  17           1HG      GLN  17 -13.058   6.150 -18.755
  114   1HE2  GLN  17          2HE2      GLN  17 -15.117   3.418 -17.856
  115   2HE2  GLN  17          1HE2      GLN  17 -13.697   3.966 -18.605
  116    H    ASP  18             H      ASP  18 -12.805   7.019 -13.795
  117    HA   ASP  18            HA      ASP  18 -15.445   6.887 -12.498
  118   1HB   ASP  18           2HB      ASP  18 -14.590   4.640 -13.533
  119   2HB   ASP  18           1HB      ASP  18 -13.657   4.571 -12.053
  120    H    ALA  19             H      ALA  19 -14.945   6.100 -10.048
  121    HA   ALA  19            HA      ALA  19 -12.471   7.321  -8.863
  122   1HB   ALA  19           1HB      ALA  19 -15.064   8.726  -9.291
  123   2HB   ALA  19           3HB      ALA  19 -14.218   8.938  -7.740
  124   3HB   ALA  19           2HB      ALA  19 -13.398   9.253  -9.232
  125    H    ALA  20             H      ALA  20 -12.236   6.024  -6.865
  126    HA   ALA  20            HA      ALA  20 -14.884   5.611  -5.446
  127   1HB   ALA  20           1HB      ALA  20 -13.084   3.466  -6.319
  128   2HB   ALA  20           3HB      ALA  20 -13.926   3.271  -4.790
  129   3HB   ALA  20           2HB      ALA  20 -14.819   3.547  -6.264
  130    H    ILE  21             H      ILE  21 -14.725   6.630  -3.672
  131    HA   ILE  21            HA      ILE  21 -12.284   6.507  -1.998
  132    HB   ILE  21            HB      ILE  21 -15.005   7.750  -1.398
  133   1HG1  ILE  21          2HG1      ILE  21 -12.459   8.873  -2.628
  134   2HG1  ILE  21          1HG1      ILE  21 -14.078   8.887  -3.318
  135   1HG2  ILE  21          2HG2      ILE  21 -12.275   7.989  -0.068
  136   2HG2  ILE  21          1HG2      ILE  21 -13.663   8.993   0.349
  137   3HG2  ILE  21          3HG2      ILE  21 -13.710   7.249   0.627
  138   1HD1  ILE  21          2HD1      ILE  21 -14.630  10.236  -1.104
  139   2HD1  ILE  21          1HD1      ILE  21 -12.908  10.596  -1.182
  140   3HD1  ILE  21          3HD1      ILE  21 -13.963  11.053  -2.519
  141    H    VAL  22             H      VAL  22 -12.158   4.586  -0.824
  142    HA   VAL  22            HA      VAL  22 -14.724   3.203  -0.173
  143    HB   VAL  22            HB      VAL  22 -12.048   1.916  -0.815
  144   1HG1  VAL  22          3HG1      VAL  22 -13.664   0.635   0.657
  145   2HG1  VAL  22          2HG1      VAL  22 -14.802   0.659  -0.687
  146   3HG1  VAL  22          1HG1      VAL  22 -13.254  -0.176  -0.858
  147   1HG2  VAL  22          2HG2      VAL  22 -13.184   3.180  -2.724
  148   2HG2  VAL  22          1HG2      VAL  22 -12.881   1.462  -3.015
  149   3HG2  VAL  22          3HG2      VAL  22 -14.504   2.019  -2.587
  150    H    GLY  23             H      GLY  23 -15.042   3.186   2.033
  151   1HA   GLY  23           2HA      GLY  23 -12.925   3.431   4.019
  152   2HA   GLY  23           1HA      GLY  23 -14.593   2.934   4.362
  153    OH   TYR  24            OH      TYR  24  -5.464   1.569   4.947
  154    H    TYR  24             H      TYR  24 -11.502   1.788   3.278
  155    HA   TYR  24            HA      TYR  24 -12.184  -0.993   3.057
  156   1HB   TYR  24           2HB      TYR  24 -10.050  -1.213   2.042
  157   2HB   TYR  24           1HB      TYR  24 -10.516   0.417   1.654
  158    HD1  TYR  24           HD2      TYR  24  -9.962   1.760   4.349
  159    HD2  TYR  24           HD1      TYR  24  -7.757  -1.101   2.110
  160    HE1  TYR  24           HE2      TYR  24  -7.876   2.536   5.418
  161    HE2  TYR  24           HE1      TYR  24  -5.678  -0.350   3.141
  162    HH   TYR  24            HH      TYR  24  -5.486   1.305   5.869
  163    H    LYS  25             H      LYS  25 -12.491   0.099   5.800
  164    HA   LYS  25            HA      LYS  25 -10.318  -0.684   7.466
  165   1HB   LYS  25           2HB      LYS  25 -13.193  -0.192   7.964
  166   2HB   LYS  25           1HB      LYS  25 -12.128  -0.681   9.246
  167   1HG   LYS  25           2HG      LYS  25 -12.136   1.686   9.346
  168   2HG   LYS  25           1HG      LYS  25 -10.626   1.267   8.535
  169   1HD   LYS  25           2HD      LYS  25 -11.409   1.898   6.455
  170   2HD   LYS  25           1HD      LYS  25 -13.104   1.729   6.929
  171   1HE   LYS  25           2HE      LYS  25 -11.211   3.827   8.006
  172   2HE   LYS  25           1HE      LYS  25 -12.406   4.100   6.747
  173   1HZ   LYS  25           3HZ      LYS  25 -14.039   3.143   8.474
  174   2HZ   LYS  25           2HZ      LYS  25 -12.829   3.522   9.603
  175   3HZ   LYS  25           1HZ      LYS  25 -13.516   4.743   8.649
  176    H    ASP  26             H      ASP  26 -11.808  -2.434   9.269
  177    HA   ASP  26            HA      ASP  26 -11.063  -5.017   8.555
  178   1HB   ASP  26           2HB      ASP  26 -13.245  -5.736   9.828
  179   2HB   ASP  26           1HB      ASP  26 -11.904  -5.034  10.705
  180    H    SER  27             H      SER  27 -14.342  -3.764   8.072
  181    HA   SER  27            HA      SER  27 -14.721  -5.593   5.796
  182   1HB   SER  27           2HB      SER  27 -17.130  -4.847   6.158
  183   2HB   SER  27           1HB      SER  27 -16.474  -5.912   7.370
  184    HG   SER  27            HG      SER  27 -16.539  -4.327   8.773
  185    HA   PRO  28            HA      PRO  28 -14.116  -1.762   3.652
  186   1HB   PRO  28           2HB      PRO  28 -14.142  -2.780   1.111
  187   2HB   PRO  28           1HB      PRO  28 -12.735  -2.817   2.187
  188   1HG   PRO  28           2HG      PRO  28 -14.493  -5.040   1.384
  189   2HG   PRO  28           1HG      PRO  28 -12.887  -5.082   2.083
  190   1HD   PRO  28           2HD      PRO  28 -15.363  -5.556   3.396
  191   2HD   PRO  28           1HD      PRO  28 -13.734  -5.544   4.104
  192    H    SER  29             H      SER  29 -15.329  -0.310   2.417
  193    HA   SER  29            HA      SER  29 -17.868  -1.063   1.310
  194   1HB   SER  29           2HB      SER  29 -19.005   0.759   2.687
  195   2HB   SER  29           1HB      SER  29 -18.683  -0.758   3.512
  196    HG   SER  29            HG      SER  29 -16.952   1.502   3.535
  197    H    VAL  30             H      VAL  30 -18.774   0.684   0.090
  198    HA   VAL  30            HA      VAL  30 -16.693   2.389  -0.996
  199    HB   VAL  30            HB      VAL  30 -19.512   1.696  -1.786
  200   1HG1  VAL  30          3HG1      VAL  30 -18.972   4.051  -2.429
  201   2HG1  VAL  30          2HG1      VAL  30 -17.535   3.456  -3.253
  202   3HG1  VAL  30          1HG1      VAL  30 -19.131   2.987  -3.830
  203   1HG2  VAL  30          2HG2      VAL  30 -16.824   0.649  -2.280
  204   2HG2  VAL  30          1HG2      VAL  30 -18.391  -0.072  -2.647
  205   3HG2  VAL  30          3HG2      VAL  30 -17.650   1.048  -3.776
  206    CH2  TRP  31           CH2      TRP  31 -13.721   6.155   6.542
  207    H    TRP  31             H      TRP  31 -16.355   4.108   0.280
  208    HA   TRP  31            HA      TRP  31 -18.342   5.456   1.817
  209   1HB   TRP  31           2HB      TRP  31 -15.463   5.906   1.121
  210   2HB   TRP  31           1HB      TRP  31 -16.378   7.249   1.807
  211    HD1  TRP  31           HD1      TRP  31 -17.723   4.060   3.089
  212    HE1  TRP  31           HE1      TRP  31 -16.925   3.623   5.453
  213    HE3  TRP  31           HE3      TRP  31 -13.931   7.484   3.424
  214    HZ2  TRP  31           HZ2      TRP  31 -14.970   4.577   7.303
  215    HZ3  TRP  31           HZ3      TRP  31 -12.642   7.702   5.518
  216    HH2  TRP  31           HH2      TRP  31 -13.143   6.248   7.448
  217    H    ALA  32             H      ALA  32 -17.123   5.803  -1.423
  218    HA   ALA  32            HA      ALA  32 -19.310   7.370  -2.326
  219   1HB   ALA  32           1HB      ALA  32 -18.211   9.137  -0.901
  220   2HB   ALA  32           3HB      ALA  32 -16.771   9.005  -1.919
  221   3HB   ALA  32           2HB      ALA  32 -18.296   9.589  -2.607
  222    H    ALA  33             H      ALA  33 -19.047   5.737  -3.989
  223    HA   ALA  33            HA      ALA  33 -16.823   6.297  -5.888
  224   1HB   ALA  33           1HB      ALA  33 -16.757   3.971  -4.972
  225   2HB   ALA  33           3HB      ALA  33 -18.386   3.701  -5.603
  226   3HB   ALA  33           2HB      ALA  33 -17.041   4.000  -6.706
  227    H    VAL  34             H      VAL  34 -17.460   6.945  -7.885
  228    HA   VAL  34            HA      VAL  34 -20.073   7.793  -8.548
  229    HB   VAL  34            HB      VAL  34 -17.946   6.785 -10.516
  230   1HG1  VAL  34          1HG1      VAL  34 -20.292   7.171 -11.412
  231   2HG1  VAL  34          3HG1      VAL  34 -20.136   8.860 -10.900
  232   3HG1  VAL  34          2HG1      VAL  34 -19.049   8.206 -12.129
  233   1HG2  VAL  34          3HG2      VAL  34 -17.093   8.524  -8.938
  234   2HG2  VAL  34          2HG2      VAL  34 -17.221   9.147 -10.580
  235   3HG2  VAL  34          1HG2      VAL  34 -18.440   9.572  -9.376
  236    HA   PRO  35            HA      PRO  35 -21.658   3.523  -8.631
  237   1HB   PRO  35           2HB      PRO  35 -24.320   4.166  -8.360
  238   2HB   PRO  35           1HB      PRO  35 -23.187   4.011  -7.002
  239   1HG   PRO  35           2HG      PRO  35 -24.321   6.486  -8.227
  240   2HG   PRO  35           1HG      PRO  35 -23.708   6.227  -6.583
  241   1HD   PRO  35           2HD      PRO  35 -22.323   7.541  -8.689
  242   2HD   PRO  35           1HD      PRO  35 -21.617   6.992  -7.156
  243    H    GLY  36             H      GLY  36 -22.826   2.205 -10.048
  244   1HA   GLY  36           2HA      GLY  36 -24.216   1.780 -11.974
  245   2HA   GLY  36           1HA      GLY  36 -23.961   3.447 -12.491
  246    H    LYS  37             H      LYS  37 -20.949   3.003 -11.736
  247    HA   LYS  37            HA      LYS  37 -20.204   2.049 -14.425
  248   1HB   LYS  37           2HB      LYS  37 -18.284   3.010 -12.304
  249   2HB   LYS  37           1HB      LYS  37 -18.067   3.014 -14.050
  250   1HG   LYS  37           2HG      LYS  37 -20.176   4.653 -12.602
  251   2HG   LYS  37           1HG      LYS  37 -18.603   5.282 -13.098
  252   1HD   LYS  37           2HD      LYS  37 -20.259   3.890 -15.165
  253   2HD   LYS  37           1HD      LYS  37 -20.745   5.514 -14.675
  254   1HE   LYS  37           2HE      LYS  37 -17.848   5.164 -15.198
  255   2HE   LYS  37           1HE      LYS  37 -18.892   5.020 -16.611
  256   1HZ   LYS  37           2HZ      LYS  37 -19.888   7.152 -16.049
  257   2HZ   LYS  37           1HZ      LYS  37 -18.870   7.293 -14.696
  258   3HZ   LYS  37           3HZ      LYS  37 -18.209   7.308 -16.257
  259    H    THR  38             H      THR  38 -18.597   1.379 -11.254
  260    HA   THR  38            HA      THR  38 -18.858  -1.467 -11.331
  261    HB   THR  38            HB      THR  38 -16.719  -0.278 -12.990
  262    HG1  THR  38           HG1      THR  38 -17.330  -1.790 -14.330
  263   1HG2  THR  38          3HG2      THR  38 -16.167  -2.639 -11.200
  264   2HG2  THR  38          2HG2      THR  38 -15.353  -2.481 -12.752
  265   3HG2  THR  38          1HG2      THR  38 -15.126  -1.237 -11.510
  266    H    PHE  39             H      PHE  39 -16.803   1.215 -10.485
  267    HA   PHE  39            HA      PHE  39 -15.174   0.104  -8.485
  268   1HB   PHE  39           2HB      PHE  39 -16.204   2.806  -9.135
  269   2HB   PHE  39           1HB      PHE  39 -15.339   2.551  -7.643
  270    HD1  PHE  39           HD2      PHE  39 -14.713   0.689 -10.807
  271    HD2  PHE  39           HD1      PHE  39 -13.306   3.720  -8.137
  272    HE1  PHE  39           HE2      PHE  39 -12.551   0.699 -11.959
  273    HE2  PHE  39           HE1      PHE  39 -11.123   3.741  -9.278
  274    HZ   PHE  39            HZ      PHE  39 -10.776   2.180 -11.182
  275    H    VAL  40             H      VAL  40 -18.301   1.648  -8.094
  276    HA   VAL  40            HA      VAL  40 -18.447   1.730  -5.312
  277    HB   VAL  40            HB      VAL  40 -20.094   2.955  -6.504
  278   1HG1  VAL  40          1HG1      VAL  40 -20.566   0.335  -7.891
  279   2HG1  VAL  40          3HG1      VAL  40 -21.799   1.597  -7.909
  280   3HG1  VAL  40          2HG1      VAL  40 -20.195   1.916  -8.584
  281   1HG2  VAL  40          3HG2      VAL  40 -20.791   1.292  -4.455
  282   2HG2  VAL  40          2HG2      VAL  40 -21.903   2.459  -5.184
  283   3HG2  VAL  40          1HG2      VAL  40 -21.936   0.770  -5.692
  284    H    ASN  41             H      ASN  41 -18.666  -0.999  -7.446
  285    HA   ASN  41            HA      ASN  41 -19.940  -2.751  -5.490
  286   1HB   ASN  41           2HB      ASN  41 -18.856  -3.036  -8.271
  287   2HB   ASN  41           1HB      ASN  41 -19.227  -4.441  -7.301
  288   1HD2  ASN  41          2HD2      ASN  41 -22.243  -2.270  -8.891
  289   2HD2  ASN  41          1HD2      ASN  41 -20.623  -1.817  -9.108
  290    H    ILE  42             H      ILE  42 -17.175  -1.332  -5.029
  291    HA   ILE  42            HA      ILE  42 -15.243  -3.446  -5.137
  292    HB   ILE  42            HB      ILE  42 -15.325  -0.636  -4.097
  293   1HG1  ILE  42          2HG1      ILE  42 -13.066  -2.046  -5.508
  294   2HG1  ILE  42          1HG1      ILE  42 -14.527  -1.615  -6.396
  295   1HG2  ILE  42          2HG2      ILE  42 -13.408  -2.737  -3.057
  296   2HG2  ILE  42          1HG2      ILE  42 -12.943  -1.043  -3.161
  297   3HG2  ILE  42          3HG2      ILE  42 -14.300  -1.521  -2.149
  298   1HD1  ILE  42          2HD1      ILE  42 -14.253   0.740  -5.652
  299   2HD1  ILE  42          1HD1      ILE  42 -12.750   0.290  -4.846
  300   3HD1  ILE  42          3HD1      ILE  42 -12.875   0.178  -6.605
  301    H    THR  43             H      THR  43 -15.149  -5.093  -3.893
  302    HA   THR  43            HA      THR  43 -16.327  -5.288  -1.157
  303    HB   THR  43            HB      THR  43 -15.887  -7.829  -1.845
  304    HG1  THR  43           HG1      THR  43 -15.992  -8.113  -4.086
  305   1HG2  THR  43          3HG2      THR  43 -18.020  -5.991  -2.795
  306   2HG2  THR  43          2HG2      THR  43 -18.032  -7.670  -3.339
  307   3HG2  THR  43          1HG2      THR  43 -18.128  -7.303  -1.618
  308    HA   PRO  44            HA      PRO  44 -12.221  -6.046   0.519
  309   1HB   PRO  44           2HB      PRO  44 -12.295  -8.429   1.758
  310   2HB   PRO  44           1HB      PRO  44 -12.933  -6.963   2.453
  311   1HG   PRO  44           2HG      PRO  44 -14.400  -9.254   1.216
  312   2HG   PRO  44           1HG      PRO  44 -14.927  -8.151   2.500
  313   1HD   PRO  44           2HD      PRO  44 -15.767  -7.965  -0.120
  314   2HD   PRO  44           1HD      PRO  44 -15.787  -6.613   1.003
  315    H    ALA  45             H      ALA  45 -13.262  -7.901  -1.951
  316    HA   ALA  45            HA      ALA  45 -10.974  -9.676  -2.244
  317   1HB   ALA  45           1HB      ALA  45 -13.605  -9.599  -3.248
  318   2HB   ALA  45           3HB      ALA  45 -12.549  -9.347  -4.639
  319   3HB   ALA  45           2HB      ALA  45 -12.362 -10.789  -3.642
  320    H    GLU  46             H      GLU  46 -12.448  -7.257  -4.270
  321    HA   GLU  46            HA      GLU  46 -10.129  -6.655  -5.851
  322   1HB   GLU  46           2HB      GLU  46 -11.430  -4.311  -6.106
  323   2HB   GLU  46           1HB      GLU  46 -11.977  -5.750  -6.944
  324   1HG   GLU  46           2HG      GLU  46 -13.017  -5.392  -4.206
  325   2HG   GLU  46           1HG      GLU  46 -13.519  -4.182  -5.374
  326    H    VAL  47             H      VAL  47 -11.281  -5.467  -2.770
  327    HA   VAL  47            HA      VAL  47  -9.197  -3.472  -2.524
  328    HB   VAL  47            HB      VAL  47 -11.635  -4.122  -1.085
  329   1HG1  VAL  47          3HG1      VAL  47  -9.984  -4.490   0.697
  330   2HG1  VAL  47          2HG1      VAL  47  -9.357  -2.885   0.336
  331   3HG1  VAL  47          1HG1      VAL  47 -10.991  -3.064   0.956
  332   1HG2  VAL  47          3HG2      VAL  47 -10.912  -2.064  -2.530
  333   2HG2  VAL  47          2HG2      VAL  47 -11.896  -1.802  -1.087
  334   3HG2  VAL  47          1HG2      VAL  47 -10.124  -1.530  -1.014
  335    H    GLY  48             H      GLY  48  -9.669  -6.782  -1.752
  336   1HA   GLY  48           2HA      GLY  48  -7.759  -7.139   0.317
  337   2HA   GLY  48           1HA      GLY  48  -8.252  -8.378  -0.835
  338    H    VAL  49             H      VAL  49  -7.430  -6.692  -3.118
  339    HA   VAL  49            HA      VAL  49  -4.520  -7.273  -3.019
  340    HB   VAL  49            HB      VAL  49  -5.813  -8.273  -4.909
  341   1HG1  VAL  49          3HG1      VAL  49  -6.169  -5.357  -5.683
  342   2HG1  VAL  49          2HG1      VAL  49  -6.522  -6.721  -6.743
  343   3HG1  VAL  49          1HG1      VAL  49  -7.451  -6.491  -5.261
  344   1HG2  VAL  49          3HG2      VAL  49  -3.514  -6.379  -5.293
  345   2HG2  VAL  49          2HG2      VAL  49  -3.568  -8.128  -5.492
  346   3HG2  VAL  49          1HG2      VAL  49  -4.257  -7.082  -6.730
  347    H    LEU  50             H      LEU  50  -6.747  -4.678  -3.563
  348    HA   LEU  50            HA      LEU  50  -4.901  -2.626  -4.322
  349   1HB   LEU  50           2HB      LEU  50  -7.648  -2.832  -3.336
  350   2HB   LEU  50           1HB      LEU  50  -6.899  -1.309  -3.157
  351    HG   LEU  50            HG      LEU  50  -6.924  -2.677  -5.808
  352   1HD1  LEU  50          2HD1      LEU  50  -9.126  -0.944  -4.561
  353   2HD1  LEU  50          1HD1      LEU  50  -9.068  -1.460  -6.261
  354   3HD1  LEU  50          3HD1      LEU  50  -9.270  -2.662  -4.987
  355   1HD2  LEU  50          1HD2      LEU  50  -5.606  -0.533  -5.206
  356   2HD2  LEU  50          3HD2      LEU  50  -6.648  -0.457  -6.627
  357   3HD2  LEU  50          2HD2      LEU  50  -7.184   0.255  -5.099
  358    H    VAL  51             H      VAL  51  -5.588  -4.202  -1.367
  359    HA   VAL  51            HA      VAL  51  -3.973  -2.243   0.184
  360    HB   VAL  51            HB      VAL  51  -5.783  -1.610   1.595
  361   1HG1  VAL  51          2HG1      VAL  51  -7.143  -2.341  -0.996
  362   2HG1  VAL  51          1HG1      VAL  51  -7.931  -1.438   0.270
  363   3HG1  VAL  51          3HG1      VAL  51  -6.512  -0.769  -0.521
  364   1HG2  VAL  51          1HG2      VAL  51  -6.765  -4.404   1.160
  365   2HG2  VAL  51          3HG2      VAL  51  -6.660  -3.463   2.652
  366   3HG2  VAL  51          2HG2      VAL  51  -7.981  -3.172   1.525
  367    H    GLY  52             H      GLY  52  -4.655  -5.518  -0.431
  368   1HA   GLY  52           2HA      GLY  52  -4.481  -6.730   2.097
  369   2HA   GLY  52           1HA      GLY  52  -3.997  -7.493   0.592
  370    H    LYS  53             H      LYS  53  -2.539  -8.222   2.491
  371    HA   LYS  53            HA      LYS  53  -0.281  -6.574   3.076
  372   1HB   LYS  53           2HB      LYS  53   0.579  -8.553   4.259
  373   2HB   LYS  53           1HB      LYS  53  -1.086  -8.222   4.709
  374   1HG   LYS  53           2HG      LYS  53  -1.384 -10.443   4.248
  375   2HG   LYS  53           1HG      LYS  53  -1.480  -9.876   2.582
  376   1HD   LYS  53           2HD      LYS  53   0.891 -10.311   2.238
  377   2HD   LYS  53           1HD      LYS  53   1.088 -10.747   3.935
  378   1HE   LYS  53           2HE      LYS  53  -0.873 -12.460   3.322
  379   2HE   LYS  53           1HE      LYS  53  -0.172 -12.287   1.712
  380   1HZ   LYS  53           1HZ      LYS  53   2.042 -12.640   2.995
  381   2HZ   LYS  53           3HZ      LYS  53   1.045 -13.360   4.164
  382   3HZ   LYS  53           2HZ      LYS  53   1.081 -13.979   2.582
  383    H    ASP  54             H      ASP  54  -1.144  -8.425   0.416
  384    HA   ASP  54            HA      ASP  54   1.054  -9.789  -0.465
  385   1HB   ASP  54           2HB      ASP  54  -1.177  -9.621  -1.622
  386   2HB   ASP  54           1HB      ASP  54  -0.647  -8.073  -2.257
  387    NH1  ARG  55           NH1      ARG  55   8.345  -4.587   2.128
  388    NH2  ARG  55           NH2      ARG  55   7.152  -2.870   1.257
  389    H    ARG  55             H      ARG  55   3.040  -9.149  -0.740
  390    HA   ARG  55            HA      ARG  55   3.676  -6.373  -1.300
  391   1HB   ARG  55           2HB      ARG  55   4.376  -7.824   0.896
  392   2HB   ARG  55           1HB      ARG  55   5.787  -8.049  -0.133
  393   1HG   ARG  55           2HG      ARG  55   6.319  -5.783  -0.134
  394   2HG   ARG  55           1HG      ARG  55   4.659  -5.290   0.208
  395   1HD   ARG  55           2HD      ARG  55   4.889  -6.293   2.500
  396   2HD   ARG  55           1HD      ARG  55   6.590  -6.604   2.148
  397    HE   ARG  55            HE      ARG  55   5.479  -4.055   2.915
  398   1HH1  ARG  55          2HH1      ARG  55   8.380  -5.455   2.624
  399   2HH1  ARG  55          1HH1      ARG  55   9.191  -4.164   1.802
  400   1HH2  ARG  55          1HH2      ARG  55   6.274  -2.424   1.087
  401   2HH2  ARG  55          2HH2      ARG  55   7.998  -2.450   0.930
  402    H    SER  56             H      SER  56   3.219  -8.456  -3.417
  403    HA   SER  56            HA      SER  56   5.627  -7.934  -4.955
  404   1HB   SER  56           2HB      SER  56   6.479  -9.753  -3.604
  405   2HB   SER  56           1HB      SER  56   5.127 -10.765  -4.091
  406    HG   SER  56            HG      SER  56   7.192 -10.988  -5.289
  407    H    SER  57             H      SER  57   3.394 -10.616  -5.070
  408    HA   SER  57            HA      SER  57   3.055 -10.962  -7.740
  409   1HB   SER  57           2HB      SER  57   0.631 -11.585  -7.282
  410   2HB   SER  57           1HB      SER  57   1.882 -12.472  -6.429
  411    HG   SER  57            HG      SER  57   0.192 -11.730  -5.066
  412    H    PHE  58             H      PHE  58   0.165  -9.406  -6.579
  413    HA   PHE  58            HA      PHE  58  -0.691  -8.243  -8.857
  414   1HB   PHE  58           2HB      PHE  58  -2.137  -6.822  -7.678
  415   2HB   PHE  58           1HB      PHE  58  -1.863  -8.176  -6.604
  416    HD1  PHE  58           HD2      PHE  58  -0.714  -4.701  -7.340
  417    HD2  PHE  58           HD1      PHE  58  -1.073  -7.820  -4.407
  418    HE1  PHE  58           HE2      PHE  58  -0.019  -3.119  -5.564
  419    HE2  PHE  58           HE1      PHE  58  -0.382  -6.223  -2.640
  420    HZ   PHE  58            HZ      PHE  58   0.143  -3.885  -3.213
  421    OH   TYR  59            OH      TYR  59   3.156  -3.838  -2.213
  422    H    TYR  59             H      TYR  59   2.173  -6.923  -7.232
  423    HA   TYR  59            HA      TYR  59   2.053  -4.362  -8.390
  424   1HB   TYR  59           2HB      TYR  59   4.565  -5.892  -7.807
  425   2HB   TYR  59           1HB      TYR  59   4.455  -4.168  -8.124
  426    HD1  TYR  59           HD1      TYR  59   2.126  -3.391  -6.630
  427    HD2  TYR  59           HD2      TYR  59   5.278  -6.058  -5.576
  428    HE1  TYR  59           HE1      TYR  59   1.778  -2.831  -4.229
  429    HE2  TYR  59           HE2      TYR  59   4.949  -5.495  -3.185
  430    HH   TYR  59            HH      TYR  59   3.068  -2.886  -2.128
  431    H    VAL  60             H      VAL  60   2.328  -7.159 -10.078
  432    HA   VAL  60            HA      VAL  60   3.420  -5.753 -12.407
  433    HB   VAL  60            HB      VAL  60   4.085  -8.230 -13.003
  434   1HG1  VAL  60          2HG1      VAL  60   5.548  -6.369 -11.139
  435   2HG1  VAL  60          1HG1      VAL  60   6.315  -7.765 -11.900
  436   3HG1  VAL  60          3HG1      VAL  60   5.693  -6.448 -12.898
  437   1HG2  VAL  60          1HG2      VAL  60   3.101  -9.244 -10.969
  438   2HG2  VAL  60          3HG2      VAL  60   4.847  -9.495 -11.026
  439   3HG2  VAL  60          2HG2      VAL  60   4.170  -8.248  -9.977
  440    H    ASN  61             H      ASN  61   1.027  -8.100 -11.218
  441    HA   ASN  61            HA      ASN  61   0.033  -8.547 -13.900
  442   1HB   ASN  61           2HB      ASN  61  -1.567 -10.044 -12.839
  443   2HB   ASN  61           1HB      ASN  61   0.051 -10.431 -12.357
  444   1HD2  ASN  61          2HD2      ASN  61  -0.746 -10.200  -8.993
  445   2HD2  ASN  61          1HD2      ASN  61   0.237 -10.856 -10.208
  446    H    GLY  62             H      GLY  62  -0.985  -6.856 -10.961
  447   1HA   GLY  62           2HA      GLY  62  -2.062  -4.664 -11.411
  448   2HA   GLY  62           1HA      GLY  62  -3.061  -5.506 -12.598
  449    H    LEU  63             H      LEU  63  -3.789  -3.960 -10.152
  450    HA   LEU  63            HA      LEU  63  -4.823  -5.837  -8.177
  451   1HB   LEU  63           2HB      LEU  63  -5.746  -2.962  -8.540
  452   2HB   LEU  63           1HB      LEU  63  -5.813  -3.923  -7.055
  453    HG   LEU  63            HG      LEU  63  -3.178  -3.304  -8.362
  454   1HD1  LEU  63          3HD1      LEU  63  -4.922  -1.295  -7.743
  455   2HD1  LEU  63          2HD1      LEU  63  -4.156  -1.547  -6.170
  456   3HD1  LEU  63          1HD1      LEU  63  -3.176  -1.152  -7.580
  457   1HD2  LEU  63          2HD2      LEU  63  -4.210  -3.952  -5.594
  458   2HD2  LEU  63          1HD2      LEU  63  -3.112  -4.906  -6.588
  459   3HD2  LEU  63          3HD2      LEU  63  -2.564  -3.386  -5.889
  460    H    THR  64             H      THR  64  -7.432  -4.590  -7.895
  461    HA   THR  64            HA      THR  64  -8.905  -5.009 -10.327
  462    HB   THR  64            HB      THR  64 -10.320  -6.782  -9.199
  463    HG1  THR  64           HG1      THR  64  -9.527  -7.745  -7.425
  464   1HG2  THR  64          1HG2      THR  64  -8.568  -7.145 -10.983
  465   2HG2  THR  64          3HG2      THR  64  -7.453  -7.601  -9.688
  466   3HG2  THR  64          2HG2      THR  64  -8.919  -8.549  -9.975
  467    H    LEU  65             H      LEU  65 -10.503  -3.634 -10.176
  468    HA   LEU  65            HA      LEU  65 -11.546  -2.879  -7.529
  469   1HB   LEU  65           2HB      LEU  65 -11.713  -0.494  -8.660
  470   2HB   LEU  65           1HB      LEU  65 -10.343  -0.999  -7.727
  471    HG   LEU  65            HG      LEU  65  -9.252  -1.745  -9.904
  472   1HD1  LEU  65          3HD1      LEU  65 -11.790  -0.865 -10.929
  473   2HD1  LEU  65          2HD1      LEU  65 -10.494   0.023 -11.683
  474   3HD1  LEU  65          1HD1      LEU  65 -10.517  -1.728 -11.739
  475   1HD2  LEU  65          2HD2      LEU  65  -9.749   0.994  -8.903
  476   2HD2  LEU  65          1HD2      LEU  65  -8.222   0.174  -9.246
  477   3HD2  LEU  65          3HD2      LEU  65  -9.135   0.919 -10.559
  478    H    GLY  66             H      GLY  66 -13.482  -3.684  -7.548
  479   1HA   GLY  66           2HA      GLY  66 -15.766  -3.855  -8.046
  480   2HA   GLY  66           1HA      GLY  66 -15.509  -2.693  -9.353
  481    H    GLY  67             H      GLY  67 -13.384  -5.456  -9.150
  482   1HA   GLY  67           2HA      GLY  67 -13.413  -7.514 -10.324
  483   2HA   GLY  67           1HA      GLY  67 -14.934  -7.039 -11.080
  484    H    GLN  68             H      GLN  68 -12.603  -4.466 -11.171
  485    HA   GLN  68            HA      GLN  68 -12.032  -5.196 -14.022
  486   1HB   GLN  68           2HB      GLN  68 -13.249  -3.037 -13.235
  487   2HB   GLN  68           1HB      GLN  68 -11.615  -2.474 -13.176
  488   1HG   GLN  68           2HG      GLN  68 -13.040  -3.633 -15.576
  489   2HG   GLN  68           1HG      GLN  68 -12.478  -1.972 -15.395
  490   1HE2  GLN  68          2HE2      GLN  68  -8.955  -2.972 -15.818
  491   2HE2  GLN  68          1HE2      GLN  68  -9.892  -1.990 -14.788
  492    H    LYS  69             H      LYS  69 -10.088  -6.233 -14.055
  493    HA   LYS  69            HA      LYS  69  -7.919  -5.801 -12.295
  494   1HB   LYS  69           2HB      LYS  69  -8.544  -7.541 -14.323
  495   2HB   LYS  69           1HB      LYS  69  -7.222  -6.621 -15.036
  496   1HG   LYS  69           2HG      LYS  69  -5.683  -7.365 -13.489
  497   2HG   LYS  69           1HG      LYS  69  -6.900  -7.606 -12.234
  498   1HD   LYS  69           2HD      LYS  69  -7.806  -9.529 -13.466
  499   2HD   LYS  69           1HD      LYS  69  -6.590  -9.295 -14.726
  500   1HE   LYS  69           2HE      LYS  69  -5.497 -10.890 -13.440
  501   2HE   LYS  69           1HE      LYS  69  -4.914  -9.423 -12.646
  502   1HZ   LYS  69           3HZ      LYS  69  -7.398 -10.773 -11.777
  503   2HZ   LYS  69           2HZ      LYS  69  -5.878 -11.253 -11.188
  504   3HZ   LYS  69           1HZ      LYS  69  -6.435  -9.671 -10.919
  505    H    CYS  70             H      CYS  70  -6.789  -3.878 -12.050
  506    HA   CYS  70            HA      CYS  70  -6.070  -2.349 -14.581
  507   1HB   CYS  70           2HB      CYS  70  -5.595  -0.463 -12.975
  508   2HB   CYS  70           1HB      CYS  70  -7.278  -0.927 -13.039
  509    HG   CYS  70            HG      CYS  70  -7.025  -2.130 -10.746
  510    H    SER  71             H      SER  71  -3.810  -1.832 -14.568
  511    HA   SER  71            HA      SER  71  -2.077  -3.697 -13.079
  512   1HB   SER  71           2HB      SER  71  -0.497  -3.473 -14.867
  513   2HB   SER  71           1HB      SER  71  -2.101  -3.890 -15.482
  514    HG   SER  71            HG      SER  71  -2.405  -1.644 -15.878
  515    H    VAL  72             H      VAL  72  -0.850  -2.959 -11.551
  516    HA   VAL  72            HA      VAL  72  -0.517  -0.271 -10.847
  517    HB   VAL  72            HB      VAL  72   1.529  -2.306 -10.199
  518   1HG1  VAL  72          3HG1      VAL  72   1.884   0.022  -9.502
  519   2HG1  VAL  72          2HG1      VAL  72   0.330  -0.018  -8.666
  520   3HG1  VAL  72          1HG1      VAL  72   1.644  -1.049  -8.137
  521   1HG2  VAL  72          2HG2      VAL  72  -1.262  -2.062  -9.220
  522   2HG2  VAL  72          1HG2      VAL  72  -0.372  -3.515  -9.657
  523   3HG2  VAL  72          3HG2      VAL  72   0.007  -2.669  -8.159
  524    H    ILE  73             H      ILE  73   0.281   1.132 -12.165
  525    HA   ILE  73            HA      ILE  73   2.837   0.745 -13.345
  526    HB   ILE  73            HB      ILE  73   0.475   2.362 -14.080
  527   1HG1  ILE  73          2HG1      ILE  73   2.053   1.224 -16.268
  528   2HG1  ILE  73          1HG1      ILE  73   1.690  -0.009 -15.068
  529   1HG2  ILE  73          3HG2      ILE  73   3.289   3.153 -14.459
  530   2HG2  ILE  73          2HG2      ILE  73   2.280   3.262 -15.902
  531   3HG2  ILE  73          1HG2      ILE  73   1.838   4.159 -14.450
  532   1HD1  ILE  73          1HD1      ILE  73  -0.557   1.755 -16.077
  533   2HD1  ILE  73          3HD1      ILE  73  -0.012   0.401 -17.094
  534   3HD1  ILE  73          2HD1      ILE  73  -0.632   0.110 -15.469
  535    NH1  ARG  74           NH1      ARG  74   7.212   5.719  -7.569
  536    NH2  ARG  74           NH2      ARG  74   8.758   4.279  -8.378
  537    H    ARG  74             H      ARG  74   3.230   1.023 -10.976
  538    HA   ARG  74            HA      ARG  74   4.883   2.402  -9.733
  539   1HB   ARG  74           2HB      ARG  74   2.789   4.488 -10.256
  540   2HB   ARG  74           1HB      ARG  74   3.943   4.645  -8.944
  541   1HG   ARG  74           2HG      ARG  74   5.248   3.848 -11.439
  542   2HG   ARG  74           1HG      ARG  74   4.391   5.380 -11.607
  543   1HD   ARG  74           2HD      ARG  74   6.625   5.882 -10.838
  544   2HD   ARG  74           1HD      ARG  74   5.532   6.144  -9.480
  545    HE   ARG  74            HE      ARG  74   6.576   3.442  -9.490
  546   1HH1  ARG  74          2HH1      ARG  74   6.296   6.119  -7.611
  547   2HH1  ARG  74          1HH1      ARG  74   7.860   6.022  -6.868
  548   1HH2  ARG  74          1HH2      ARG  74   9.025   3.574  -9.035
  549   2HH2  ARG  74          2HH2      ARG  74   9.408   4.589  -7.684
  550    H    ASP  75             H      ASP  75   4.877   1.673  -7.719
  551    HA   ASP  75            HA      ASP  75   2.328   1.658  -6.287
  552   1HB   ASP  75           2HB      ASP  75   2.425  -0.562  -6.571
  553   2HB   ASP  75           1HB      ASP  75   4.110  -0.594  -6.769
  554    H    SER  76             H      SER  76   2.681   3.505  -5.263
  555    HA   SER  76            HA      SER  76   4.601   3.382  -2.988
  556   1HB   SER  76           2HB      SER  76   3.829   5.875  -4.592
  557   2HB   SER  76           1HB      SER  76   4.824   5.868  -3.141
  558    HG   SER  76            HG      SER  76   6.453   5.320  -4.336
  559    H    LEU  77             H      LEU  77   1.944   2.388  -3.266
  560    HA   LEU  77            HA      LEU  77  -0.112   4.214  -2.292
  561   1HB   LEU  77           2HB      LEU  77  -0.458   2.143  -3.732
  562   2HB   LEU  77           1HB      LEU  77  -0.032   1.161  -2.335
  563    HG   LEU  77            HG      LEU  77  -1.954   1.915  -1.103
  564   1HD1  LEU  77          2HD1      LEU  77  -2.260   3.907  -3.366
  565   2HD1  LEU  77          1HD1      LEU  77  -3.567   3.544  -2.237
  566   3HD1  LEU  77          3HD1      LEU  77  -2.059   4.245  -1.649
  567   1HD2  LEU  77          2HD2      LEU  77  -2.273   0.972  -3.916
  568   2HD2  LEU  77          1HD2      LEU  77  -2.815   0.225  -2.402
  569   3HD2  LEU  77          3HD2      LEU  77  -3.743   1.548  -3.116
  570    H    LEU  78             H      LEU  78   2.462   2.714  -0.643
  571    HA   LEU  78            HA      LEU  78   0.867   2.886   1.801
  572   1HB   LEU  78           2HB      LEU  78   3.073   1.149   1.140
  573   2HB   LEU  78           1HB      LEU  78   2.709   1.458   2.807
  574    HG   LEU  78            HG      LEU  78   0.582   0.616   0.812
  575   1HD1  LEU  78          1HD1      LEU  78   2.300  -1.180   0.912
  576   2HD1  LEU  78          3HD1      LEU  78   2.087  -1.247   2.665
  577   3HD1  LEU  78          2HD1      LEU  78   0.736  -1.684   1.595
  578   1HD2  LEU  78          2HD2      LEU  78  -0.162   1.666   2.918
  579   2HD2  LEU  78          1HD2      LEU  78  -0.645  -0.028   2.847
  580   3HD2  LEU  78          3HD2      LEU  78   0.732   0.459   3.837
  581    H    GLN  79             H      GLN  79   1.217   4.539   2.952
  582    HA   GLN  79            HA      GLN  79   2.495   6.748   2.424
  583   1HB   GLN  79           2HB      GLN  79   2.018   7.478   4.729
  584   2HB   GLN  79           1HB      GLN  79   0.650   6.632   4.011
  585   1HG   GLN  79           2HG      GLN  79   2.014   4.552   5.149
  586   2HG   GLN  79           1HG      GLN  79   2.358   5.855   6.285
  587   1HE2  GLN  79          2HE2      GLN  79  -1.041   4.095   6.887
  588   2HE2  GLN  79          1HE2      GLN  79   0.445   3.418   6.422
  589    H    ASP  80             H      ASP  80   4.450   6.017   1.786
  590    HA   ASP  80            HA      ASP  80   6.569   6.022   3.895
  591   1HB   ASP  80           2HB      ASP  80   6.645   4.254   1.997
  592   2HB   ASP  80           1HB      ASP  80   6.953   5.603   0.904
  593    H    GLY  81             H      GLY  81   4.639   8.204   2.903
  594   1HA   GLY  81           2HA      GLY  81   5.000  10.567   2.838
  595   2HA   GLY  81           1HA      GLY  81   6.594  10.268   2.129
  596    H    GLU  82             H      GLU  82   3.777   8.402   1.018
  597    HA   GLU  82            HA      GLU  82   3.524  10.000  -1.412
  598   1HB   GLU  82           2HB      GLU  82   4.747   7.361  -1.120
  599   2HB   GLU  82           1HB      GLU  82   3.744   7.640  -2.505
  600   1HG   GLU  82           2HG      GLU  82   5.570   8.513  -3.490
  601   2HG   GLU  82           1HG      GLU  82   5.274   9.923  -2.465
  602    H    PHE  83             H      PHE  83   2.549   6.737  -0.429
  603    HA   PHE  83            HA      PHE  83   0.580   5.530  -0.685
  604   1HB   PHE  83           2HB      PHE  83  -1.542   7.237  -0.647
  605   2HB   PHE  83           1HB      PHE  83  -0.929   6.311   0.649
  606    HD1  PHE  83           HD1      PHE  83   0.731   7.365   2.220
  607    HD2  PHE  83           HD2      PHE  83  -1.424   9.619  -0.681
  608    HE1  PHE  83           HE1      PHE  83   1.264   9.430   3.475
  609    HE2  PHE  83           HE2      PHE  83  -0.905  11.709   0.549
  610    HZ   PHE  83            HZ      PHE  83   0.439  11.612   2.635
  611    H    SER  84             H      SER  84   1.463   7.638  -3.140
  612    HA   SER  84            HA      SER  84  -0.992   7.246  -4.698
  613   1HB   SER  84           2HB      SER  84   0.292   8.603  -6.424
  614   2HB   SER  84           1HB      SER  84  -0.140   9.427  -4.926
  615    HG   SER  84            HG      SER  84   2.168   9.485  -5.827
  616    H    MET  85             H      MET  85  -1.227   5.751  -6.145
  617    HA   MET  85            HA      MET  85   1.154   4.279  -7.245
  618   1HB   MET  85           2HB      MET  85   0.362   2.986  -5.322
  619   2HB   MET  85           1HB      MET  85  -1.270   3.195  -5.863
  620   1HG   MET  85           2HG      MET  85  -0.187   1.943  -8.030
  621   2HG   MET  85           1HG      MET  85   0.664   1.205  -6.703
  622   1HE   MET  85           1HE      MET  85   0.272  -0.710  -6.670
  623   2HE   MET  85           3HE      MET  85  -0.896  -1.187  -5.413
  624   3HE   MET  85           2HE      MET  85  -1.245  -1.533  -7.110
  625    H    ASP  86             H      ASP  86   0.853   4.025  -9.497
  626    HA   ASP  86            HA      ASP  86  -1.871   4.751 -10.450
  627   1HB   ASP  86           2HB      ASP  86   0.764   4.398 -11.773
  628   2HB   ASP  86           1HB      ASP  86  -0.710   4.442 -12.698
  629    H    LEU  87             H      LEU  87  -3.048   3.334 -11.651
  630    HA   LEU  87            HA      LEU  87  -1.979   0.882 -12.434
  631   1HB   LEU  87           2HB      LEU  87  -3.905  -0.467 -11.330
  632   2HB   LEU  87           1HB      LEU  87  -2.435  -0.126 -10.520
  633    HG   LEU  87            HG      LEU  87  -4.236   0.085  -8.962
  634   1HD1  LEU  87          1HD1      LEU  87  -2.255   1.735  -9.010
  635   2HD1  LEU  87          3HD1      LEU  87  -3.477   2.926  -9.450
  636   3HD1  LEU  87          2HD1      LEU  87  -3.616   2.026  -7.941
  637   1HD2  LEU  87          3HD2      LEU  87  -5.530   1.388 -11.179
  638   2HD2  LEU  87          2HD2      LEU  87  -6.226   0.789  -9.674
  639   3HD2  LEU  87          1HD2      LEU  87  -5.584   2.424  -9.751
  640    NH1  ARG  88           NH2      ARG  88  -0.777  -0.193 -19.683
  641    NH2  ARG  88           NH1      ARG  88   0.647   1.509 -20.117
  642    H    ARG  88             H      ARG  88  -3.020   0.051 -14.297
  643    HA   ARG  88            HA      ARG  88  -5.426   1.625 -15.087
  644   1HB   ARG  88           2HB      ARG  88  -4.475   2.473 -17.023
  645   2HB   ARG  88           1HB      ARG  88  -3.069   2.422 -15.994
  646   1HG   ARG  88           2HG      ARG  88  -2.279   0.379 -17.115
  647   2HG   ARG  88           1HG      ARG  88  -3.792   0.228 -18.035
  648   1HD   ARG  88           2HD      ARG  88  -2.905   1.526 -19.637
  649   2HD   ARG  88           1HD      ARG  88  -2.870   2.894 -18.455
  650    HE   ARG  88            HE      ARG  88  -0.543   2.346 -17.996
  651   1HH1  ARG  88          1HH2      ARG  88  -1.562  -0.559 -19.185
  652   2HH1  ARG  88          2HH2      ARG  88  -0.288  -0.768 -20.338
  653   1HH2  ARG  88          2HH1      ARG  88   0.946   2.449 -19.955
  654   2HH2  ARG  88          1HH1      ARG  88   1.149   0.927 -20.756
  655    H    THR  89             H      THR  89  -6.958   0.681 -16.187
  656    HA   THR  89            HA      THR  89  -7.156  -2.132 -16.474
  657    HB   THR  89            HB      THR  89  -9.242  -1.732 -17.399
  658    HG1  THR  89           HG1      THR  89  -9.565  -0.634 -19.116
  659   1HG2  THR  89          1HG2      THR  89  -8.887  -0.189 -15.366
  660   2HG2  THR  89          3HG2      THR  89  -8.911   1.115 -16.569
  661   3HG2  THR  89          2HG2      THR  89 -10.326   0.057 -16.356
  662    H    LYS  90             H      LYS  90  -5.249  -2.882 -17.592
  663    HA   LYS  90            HA      LYS  90  -4.665  -1.785 -20.172
  664   1HB   LYS  90           2HB      LYS  90  -3.366  -4.332 -19.401
  665   2HB   LYS  90           1HB      LYS  90  -2.711  -2.867 -20.087
  666   1HG   LYS  90           2HG      LYS  90  -2.940  -1.787 -17.853
  667   2HG   LYS  90           1HG      LYS  90  -3.158  -3.427 -17.206
  668   1HD   LYS  90           2HD      LYS  90  -0.918  -3.068 -19.188
  669   2HD   LYS  90           1HD      LYS  90  -0.661  -2.347 -17.614
  670   1HE   LYS  90           2HE      LYS  90  -0.135  -4.378 -16.779
  671   2HE   LYS  90           1HE      LYS  90  -1.753  -4.955 -17.185
  672   1HZ   LYS  90           1HZ      LYS  90   0.563  -4.877 -19.044
  673   2HZ   LYS  90           3HZ      LYS  90  -0.029  -6.266 -18.273
  674   3HZ   LYS  90           2HZ      L-8.045   4.985 -10.761
  731   2HG1  VAL 100          2HG1      VAL 100  -8.008   3.306 -10.258
  732   3HG1  VAL 100          1HG1      VAL 100  -6.738   4.405  -9.763
  733   1HG2  VAL 100          3HG2      VAL 100  -6.898   2.521 -13.489
  734   2HG2  VAL 100          2HG2      VAL 100  -7.667   1.950 -12.016
  735   3HG2  VAL 100          1HG2      VAL 100  -8.378   3.285 -12.909
  736    H    THR 101             H      THR 101  -6.247   6.259 -10.416
  737    HA   THR 101            HA      THR 101  -3.374   6.038  -9.911
  738    HB   THR 101            HB      THR 101  -5.019   8.631  -9.762
  739    HG1  THR 101           HG1      THR 101  -3.605   8.002 -11.593
  740   1HG2  THR 101          2HG2      THR 101  -3.902   8.188  -7.561
  741   2HG2  THR 101          1HG2      THR 101  -2.352   8.157  -8.407
  742   3HG2  THR 101          3HG2      THR 101  -3.326   9.623  -8.373
  743    H    VAL 102             H      VAL 102  -3.183   6.051  -7.414
  744    HA   VAL 102            HA      VAL 102  -5.744   5.706  -6.030
  745    HB   VAL 102            HB      VAL 102  -3.823   3.543  -6.781
  746   1HG1  VAL 102          3HG1      VAL 102  -5.482   3.623  -4.239
  747   2HG1  VAL 102          2HG1      VAL 102  -5.036   2.103  -5.017
  748   3HG1  VAL 102          1HG1      VAL 102  -3.784   3.179  -4.416
  749   1HG2  VAL 102          2HG2      VAL 102  -6.773   4.003  -6.673
  750   2HG2  VAL 102          1HG2      VAL 102  -5.744   3.685  -8.070
  751   3HG2  VAL 102          3HG2      VAL 102  -6.098   2.393  -6.926
  752    H    THR 103             H      THR 103  -5.616   6.865  -4.324
  753    HA   THR 103            HA      THR 103  -3.003   7.233  -2.924
  754    HB   THR 103            HB      THR 103  -4.203   9.253  -1.950
  755    HG1  THR 103           HG1      THR 103  -5.966   9.938  -3.091
  756   1HG2  THR 103          3HG2      THR 103  -2.602   8.918  -4.114
  757   2HG2  THR 103          2HG2      THR 103  -4.031   9.653  -4.883
  758   3HG2  THR 103          1HG2      THR 103  -3.187  10.489  -3.567
  759    H    LYS 104             H      LYS 104  -2.869   5.974  -1.188
  760    HA   LYS 104            HA      LYS 104  -5.268   5.165   0.349
  761   1HB   LYS 104           2HB      LYS 104  -3.744   3.385  -0.253
  762   2HB   LYS 104           1HB      LYS 104  -2.373   4.291   0.345
  763   1HG   LYS 104           2HG      LYS 104  -2.774   2.715   2.046
  764   2HG   LYS 104           1HG      LYS 104  -3.569   4.159   2.656
  765   1HD   LYS 104           2HD      LYS 104  -5.202   2.540   2.947
  766   2HD   LYS 104           1HD      LYS 104  -5.650   3.226   1.394
  767   1HE   LYS 104           2HE      LYS 104  -5.682   0.794   1.214
  768   2HE   LYS 104           1HE      LYS 104  -4.333   1.420   0.271
  769   1HZ   LYS 104           3HZ      LYS 104  -3.913   0.670   3.084
  770   2HZ   LYS 104           2HZ      LYS 104  -3.961  -0.542   1.893
  771   3HZ   LYS 104           1HZ      LYS 104  -2.804   0.698   1.802
  772    H    THR 105             H      THR 105  -5.845   6.493   2.021
  773    HA   THR 105            HA      THR 105  -3.924   8.328   3.293
  774    HB   THR 105            HB      THR 105  -5.856   9.044   4.639
  775    HG1  THR 105           HG1      THR 105  -7.545   7.822   4.863
  776   1HG2  THR 105          2HG2      THR 105  -5.898   8.938   1.726
  777   2HG2  THR 105          1HG2      THR 105  -7.517   9.059   2.408
  778   3HG2  THR 105          3HG2      THR 105  -6.306  10.276   2.805
  779    H    ASP 106             H      ASP 106  -5.285   7.822   6.039
  780    HA   ASP 106            HA      ASP 106  -3.542   5.571   6.840
  781   1HB   ASP 106           2HB      ASP 106  -3.465   7.793   8.046
  782   2HB   ASP 106           1HB      ASP 106  -5.092   7.460   8.629
  783    H    LYS 107             H      LYS 107  -6.911   6.315   6.274
  784    HA   LYS 107            HA      LYS 107  -7.675   3.598   7.185
  785   1HB   LYS 107           2HB      LYS 107  -9.241   5.996   8.193
  786   2HB   LYS 107           1HB      LYS 107  -9.413   4.311   8.682
  787   1HG   LYS 107           2HG      LYS 107  -7.120   4.373   9.628
  788   2HG   LYS 107           1HG      LYS 107  -7.015   6.078   9.196
  789   1HD   LYS 107           2HD      LYS 107  -9.315   6.179  10.541
  790   2HD   LYS 107           1HD      LYS 107  -8.619   4.769  11.337
  791   1HE   LYS 107           2HE      LYS 107  -6.653   6.004  11.972
  792   2HE   LYS 107           1HE      LYS 107  -7.145   7.388  10.995
  793   1HZ   LYS 107           3HZ      LYS 107  -9.178   7.486  12.424
  794   2HZ   LYS 107           2HZ      LYS 107  -8.444   6.346  13.447
  795   3HZ   LYS 107           1HZ      LYS 107  -7.730   7.871  13.216
  796    H    THR 108             H      THR 108  -7.606   5.299   4.597
  797    HA   THR 108            HA      THR 108 -10.323   4.518   3.677
  798    HB   THR 108            HB      THR 108 -10.862   6.620   2.743
  799    HG1  THR 108           HG1      THR 108  -8.895   7.167   1.846
  800   1HG2  THR 108          1HG2      THR 108 -10.975   6.470   5.271
  801   2HG2  THR 108          3HG2      THR 108  -9.442   7.355   5.317
  802   3HG2  THR 108          2HG2      THR 108 -10.878   8.117   4.628
  803    H    LEU 109             H      LEU 109 -10.336   4.195   1.386
  804    HA   LEU 109            HA      LEU 109  -7.689   3.802   0.101
  805   1HB   LEU 109           2HB      LEU 109  -9.418   1.865   0.874
  806   2HB   LEU 109           1HB      LEU 109 -10.112   2.202  -0.691
  807    HG   LEU 109            HG      LEU 109  -8.049   0.448  -0.086
  808   1HD1  LEU 109          1HD1      LEU 109  -9.813   0.746  -2.034
  809   2HD1  LEU 109          3HD1      LEU 109  -8.359   1.264  -2.891
  810   3HD1  LEU 109          2HD1      LEU 109  -8.426  -0.337  -2.151
  811   1HD2  LEU 109          2HD2      LEU 109  -6.472   2.323  -0.128
  812   2HD2  LEU 109          1HD2      LEU 109  -6.145   1.112  -1.350
  813   3HD2  LEU 109          3HD2      LEU 109  -6.923   2.628  -1.797
  814    H    VAL 110             H      VAL 110  -7.881   6.040  -0.979
  815    HA   VAL 110            HA      VAL 110 -10.361   6.528  -2.481
  816    HB   VAL 110            HB      VAL 110  -7.865   8.125  -1.817
  817   1HG1  VAL 110          2HG1      VAL 110  -9.434   8.420  -4.342
  818   2HG1  VAL 110          1HG1      VAL 110  -9.047   9.893  -3.465
  819   3HG1  VAL 110          3HG1      VAL 110  -7.763   8.831  -4.012
  820   1HG2  VAL 110          3HG2      VAL 110 -10.739   8.154  -1.277
  821   2HG2  VAL 110          2HG2      VAL 110  -9.440   8.997  -0.436
  822   3HG2  VAL 110          1HG2      VAL 110 -10.191   9.738  -1.852
  823    H    LEU 111             H      LEU 111 -10.602   6.297  -4.623
  824    HA   LEU 111            HA      LEU 111  -8.282   5.398  -6.244
  825   1HB   LEU 111           2HB      LEU 111 -11.165   4.481  -6.629
  826   2HB   LEU 111           1HB      LEU 111  -9.753   3.910  -7.506
  827    HG   LEU 111            HG      LEU 111  -9.699   3.716  -4.576
  828   1HD1  LEU 111          2HD1      LEU 111 -11.532   2.144  -6.327
  829   2HD1  LEU 111          1HD1      LEU 111 -10.835   1.406  -4.885
  830   3HD1  LEU 111          3HD1      LEU 111 -11.842   2.847  -4.738
  831   1HD2  LEU 111          1HD2      LEU 111  -8.408   2.520  -6.916
  832   2HD2  LEU 111          3HD2      LEU 111  -7.835   2.585  -5.248
  833   3HD2  LEU 111          2HD2      LEU 111  -8.924   1.290  -5.756
  834    H    LEU 112             H      LEU 112  -8.125   6.441  -8.150
  835    HA   LEU 112            HA      LEU 112 -10.273   8.289  -8.907
  836   1HB   LEU 112           2HB      LEU 112  -8.363   9.602  -7.981
  837   2HB   LEU 112           1HB      LEU 112  -7.289   8.700  -9.001
  838    HG   LEU 112            HG      LEU 112  -8.006   9.777 -10.978
  839   1HD1  LEU 112          3HD1      LEU 112 -10.495  10.013  -9.609
  840   2HD1  LEU 112          2HD1      LEU 112 -10.026  11.590 -10.238
  841   3HD1  LEU 112          1HD1      LEU 112 -10.156  10.206 -11.325
  842   1HD2  LEU 112          2HD2      LEU 112  -6.741  11.143  -9.195
  843   2HD2  LEU 112          1HD2      LEU 112  -7.402  11.963 -10.607
  844   3HD2  LEU 112          3HD2      LEU 112  -8.251  12.041  -9.062
  845    H    MET 113             H      MET 113 -11.043   6.963 -10.414
  846    HA   MET 113            HA      MET 113  -9.159   5.576 -12.281
  847   1HB   MET 113           2HB      MET 113 -11.380   4.623 -11.326
  848   2HB   MET 113           1HB      MET 113 -12.124   5.541 -12.609
  849   1HG   MET 113           2HG      MET 113 -10.121   4.318 -13.981
  850   2HG   MET 113           1HG      MET 113 -10.454   3.104 -12.779
  851   1HE   MET 113           2HE      MET 113 -10.952   1.485 -14.135
  852   2HE   MET 113           1HE      MET 113 -12.528   1.139 -14.848
  853   3HE   MET 113           3HE      MET 113 -11.282   1.971 -15.795
  854    H    GLY 114             H      GLY 114  -9.280   5.851 -14.507
  855   1HA   GLY 114           2HA      GLY 114 -10.888   7.390 -15.868
  856   2HA   GLY 114           1HA      GLY 114  -9.786   8.474 -15.227
  857    H    LYS 115             H      LYS 115 -10.547   7.580 -17.920
  858    HA   LYS 115            HA      LYS 115  -8.327   8.198 -19.104
  859   1HB   LYS 115           2HB      LYS 115  -8.962   5.519 -19.315
  860   2HB   LYS 115           1HB      LYS 115  -8.392   6.220 -20.764
  861   1HG   LYS 115           2HG      LYS 115  -6.544   6.536 -18.536
  862   2HG   LYS 115           1HG      LYS 115  -6.912   4.965 -18.883
  863   1HD   LYS 115           2HD      LYS 115  -6.337   6.613 -21.215
  864   2HD   LYS 115           1HD      LYS 115  -4.991   6.025 -20.244
  865   1HE   LYS 115           2HE      LYS 115  -5.170   4.050 -21.367
  866   2HE   LYS 115           1HE      LYS 115  -6.697   3.777 -20.493
  867   1HZ   LYS 115           3HZ      LYS 115  -7.723   5.206 -22.322
  868   2HZ   LYS 115           2HZ      LYS 115  -6.283   4.982 -23.187
  869   3HZ   LYS 115           1HZ      LYS 115  -7.235   3.649 -22.760
  870    H    GLU 116             H      GLU 116  -9.047   9.538 -20.478
  871    HA   GLU 116            HA      GLU 116 -10.845   8.428 -22.512
  872   1HB   GLU 116           2HB      GLU 116 -11.465  10.452 -20.975
  873   2HB   GLU 116           1HB      GLU 116 -10.529  11.237 -22.115
  874   1HG   GLU 116           2HG      GLU 116 -12.119  11.228 -23.712
  875   2HG   GLU 116           1HG      GLU 116 -12.332   9.489 -23.475
  876    H    GLY 117             H      GLY 117  -8.650   7.655 -23.609
  877   1HA   GLY 117           2HA      GLY 117  -6.560   8.156 -24.738
  878   2HA   GLY 117           1HA      GLY 117  -7.254   9.744 -25.047
  879    H    VAL 118             H      VAL 118  -7.260   9.550 -21.639
  880    HA   VAL 118            HA      VAL 118  -5.807  11.586 -20.809
  881    HB   VAL 118            HB      VAL 118  -7.331  10.346 -19.351
  882   1HG1  VAL 118          1HG1      VAL 118  -5.189   8.269 -19.582
  883   2HG1  VAL 118          3HG1      VAL 118  -6.568   8.223 -18.487
  884   3HG1  VAL 118          2HG1      VAL 118  -6.825   8.223 -20.239
  885   1HG2  VAL 118          1HG2      VAL 118  -4.598  10.954 -18.338
  886   2HG2  VAL 118          3HG2      VAL 118  -6.121  11.046 -17.486
  887   3HG2  VAL 118          2HG2      VAL 118  -5.214   9.498 -17.484
  888    H    HIS 119             H      HIS 119  -3.965  12.007 -19.929
  889    HA   HIS 119            HA      HIS 119  -1.532  10.851 -21.031
  890   1HB   HIS 119           2HB      HIS 119  -1.752  13.282 -20.683
  891   2HB   HIS 119           1HB      HIS 119  -2.030  13.038 -18.963
  892    HD1  HIS 119           HD1      HIS 119   0.677  12.164 -21.505
  893    HD2  HIS 119           HD2      HIS 119   0.293  13.301 -17.516
  894    HE1  HIS 119           HE1      HIS 119   3.031  12.416 -20.602
  895    H    GLY 120             H      GLY 120  -2.773  11.310 -17.668
  896   1HA   GLY 120           2HA      GLY 120  -2.798   9.415 -16.071
  897   2HA   GLY 120           1HA      GLY 120  -1.317   8.832 -16.832
  898    H    GLY 121             H      GLY 121  -1.407  12.260 -16.414
  899   1HA   GLY 121           2HA      GLY 121   0.356  12.046 -13.990
  900   2HA   GLY 121           1HA      GLY 121   0.588  13.257 -15.254
  901    H    LEU 122             H      LEU 122  -2.419  13.613 -15.417
  902    HA   LEU 122            HA      LEU 122  -2.686  15.654 -13.336
  903   1HB   LEU 122           2HB      LEU 122  -4.940  14.951 -15.218
  904   2HB   LEU 122           1HB      LEU 122  -4.520  16.514 -14.544
  905    HG   LEU 122            HG      LEU 122  -3.851  16.838 -16.741
  906   1HD1  LEU 122          2HD1      LEU 122  -1.739  16.594 -15.020
  907   2HD1  LEU 122          1HD1      LEU 122  -1.268  15.465 -16.291
  908   3HD1  LEU 122          3HD1      LEU 122  -1.596  17.151 -16.690
  909   1HD2  LEU 122          2HD2      LEU 122  -4.295  14.158 -17.002
  910   2HD2  LEU 122          1HD2      LEU 122  -3.644  15.181 -18.287
  911   3HD2  LEU 122          3HD2      LEU 122  -2.551  14.235 -17.276
  912    H    ILE 123             H      ILE 123  -3.914  12.470 -14.182
  913    HA   ILE 123            HA      ILE 123  -6.040  12.364 -12.208
  914    HB   ILE 123            HB      ILE 123  -4.422  10.248 -13.632
  915   1HG1  ILE 123          2HG1      ILE 123  -7.281  11.262 -14.099
  916   2HG1  ILE 123          1HG1      ILE 123  -5.896  11.555 -15.157
  917   1HG2  ILE 123          2HG2      ILE 123  -6.035   9.857 -11.291
  918   2HG2  ILE 123          1HG2      ILE 123  -6.982   9.235 -12.641
  919   3HG2  ILE 123          3HG2      ILE 123  -5.366   8.602 -12.332
  920   1HD1  ILE 123          2HD1      ILE 123  -5.679   9.064 -15.462
  921   2HD1  ILE 123          1HD1      ILE 123  -7.167   8.864 -14.540
  922   3HD1  ILE 123          3HD1      ILE 123  -7.194   9.717 -16.082
  923    H    ASN 124             H      ASN 124  -2.604  11.492 -12.397
  924    HA   ASN 124            HA      ASN 124  -2.353  10.267  -9.844
  925   1HB   ASN 124           2HB      ASN 124  -0.624  10.273 -11.702
  926   2HB   ASN 124           1HB      ASN 124  -0.215  11.908 -11.188
  927   1HD2  ASN 124          2HD2      ASN 124   1.710   9.084  -9.321
  928   2HD2  ASN 124          1HD2      ASN 124   1.229   9.124 -10.949
  929    H    LYS 125             H      LYS 125  -2.290  13.567 -11.002
  930    HA   LYS 125            HA      LYS 125  -1.602  14.689  -8.285
  931   1HB   LYS 125           2HB      LYS 125  -2.202  15.854 -11.026
  932   2HB   LYS 125           1HB      LYS 125  -2.180  16.887  -9.588
  933   1HG   LYS 125           2HG      LYS 125   0.112  15.007  -9.958
  934   2HG   LYS 125           1HG      LYS 125   0.042  16.420 -11.014
  935   1HD   LYS 125           2HD      LYS 125  -0.317  17.808  -8.886
  936   2HD   LYS 125           1HD      LYS 125   0.147  16.363  -7.987
  937   1HE   LYS 125           2HE      LYS 125   2.306  16.945  -8.283
  938   2HE   LYS 125           1HE      LYS 125   2.101  16.661 -10.011
  939   1HZ   LYS 125           3HZ      LYS 125   1.333  18.937 -10.256
  940   2HZ   LYS 125           2HZ      LYS 125   1.538  19.210  -8.591
  941   3HZ   LYS 125           1HZ      LYS 125   2.887  18.897  -9.578
  942    H    LYS 126             H      LYS 126  -4.474  13.814 -10.054
  943    HA   LYS 126            HA      LYS 126  -6.249  15.580  -8.515
  944   1HB   LYS 126           2HB      LYS 126  -6.576  13.697 -10.824
  945   2HB   LYS 126           1HB      LYS 126  -7.997  14.188  -9.890
  946   1HG   LYS 126           2HG      LYS 126  -7.523  16.534 -10.276
  947   2HG   LYS 126           1HG      LYS 126  -5.977  16.145 -11.029
  948   1HD   LYS 126           2HD      LYS 126  -8.298  14.806 -12.254
  949   2HD   LYS 126           1HD      LYS 126  -8.309  16.562 -12.387
  950   1HE   LYS 126           2HE      LYS 126  -5.730  16.078 -13.022
  951   2HE   LYS 126           1HE      LYS 126  -6.470  14.588 -13.617
  952   1HZ   LYS 126           3HZ      LYS 126  -8.078  15.958 -14.829
  953   2HZ   LYS 126           2HZ      LYS 126  -7.277  17.364 -14.309
  954   3HZ   LYS 126           1HZ      LYS 126  -6.489  16.260 -15.328
  955    H    CYS 127             H      CYS 127  -4.885  12.460  -8.222
  956    HA   CYS 127            HA      CYS 127  -6.994  11.459  -6.413
  957   1HB   CYS 127           2HB      CYS 127  -5.493  10.072  -8.148
  958   2HB   CYS 127           1HB      CYS 127  -4.410  10.047  -6.787
  959    HG   CYS 127            HG      CYS 127  -5.919   8.027  -6.373
  960    OH   TYR 128            OH      TYR 128   2.205  15.139  -1.559
  961    H    TYR 128             H      TYR 128  -3.771  12.829  -6.598
  962    HA   TYR 128            HA      TYR 128  -2.985  12.433  -3.857
  963   1HB   TYR 128           2HB      TYR 128  -1.543  13.045  -5.902
  964   2HB   TYR 128           1HB      TYR 128  -2.201  14.665  -5.777
  965    HD1  TYR 128           HD1      TYR 128  -1.431  12.651  -2.725
  966    HD2  TYR 128           HD2      TYR 128  -0.073  15.661  -5.487
  967    HE1  TYR 128           HE1      TYR 128   0.393  13.254  -1.160
  968    HE2  TYR 128           HE2      TYR 128   1.746  16.271  -3.902
  969    HH   TYR 128            HH      TYR 128   3.038  15.056  -2.031
  970    H    GLU 129             H      GLU 129  -4.949  14.788  -5.667
  971    HA   GLU 129            HA      GLU 129  -5.250  16.620  -3.348
  972   1HB   GLU 129           2HB      GLU 129  -6.614  16.530  -6.068
  973   2HB   GLU 129           1HB      GLU 129  -6.884  17.791  -4.862
  974   1HG   GLU 129           2HG      GLU 129  -4.059  17.179  -5.641
  975   2HG   GLU 129           1HG      GLU 129  -5.050  18.095  -6.774
  976    H    MET 130             H      MET 130  -7.075  14.046  -4.980
  977    HA   MET 130            HA      MET 130  -9.617  14.319  -3.677
  978   1HB   MET 130           2HB      MET 130  -8.638  12.694  -5.619
  979   2HB   MET 130           1HB      MET 130  -8.497  11.583  -4.275
  980   1HG   MET 130           2HG      MET 130 -10.989  12.151  -3.799
  981   2HG   MET 130           1HG      MET 130 -11.007  12.845  -5.436
  982   1HE   MET 130           3HE      MET 130 -12.669  10.821  -4.114
  983   2HE   MET 130           2HE      MET 130 -13.107  10.511  -5.792
  984   3HE   MET 130           1HE      MET 130 -12.614   9.172  -4.759
  985    H    ALA 131             H      ALA 131  -6.660  12.560  -2.807
  986    HA   ALA 131            HA      ALA 131  -7.606  11.657  -0.190
  987   1HB   ALA 131           3HB      ALA 131  -4.972  11.485  -1.696
  988   2HB   ALA 131           2HB      ALA 131  -5.074  11.077   0.029
  989   3HB   ALA 131           1HB      ALA 131  -6.028  10.173  -1.142
  990    H    SER 132             H      SER 132  -6.080  14.511  -1.512
  991    HA   SER 132            HA      SER 132  -4.705  15.420   0.833
  992   1HB   SER 132           2HB      SER 132  -5.951  16.896  -1.492
  993   2HB   SER 132           1HB      SER 132  -5.234  17.762  -0.144
  994    HG   SER 132            HG      SER 132  -3.280  16.862  -0.617
  995    H    HIS 133             H      HIS 133  -8.129  15.359  -0.165
  996    HA   HIS 133            HA      HIS 133  -8.885  16.991   2.160
  997   1HB   HIS 133           2HB      HIS 133 -10.314  16.815   0.016
  998   2HB   HIS 133           1HB      HIS 133 -10.908  15.276   0.707
  999    HD1  HIS 133           HD1      HIS 133 -12.379  15.400   2.773
 1000    HD2  HIS 133           HD2      HIS 133 -10.863  19.132   1.688
 1001    HE1  HIS 133           HE1      HIS 133 -13.528  17.097   4.264
 1002    H    LEU 134             H      LEU 134  -8.839  13.527   1.202
 1003    HA   LEU 134            HA      LEU 134 -10.059  12.620   3.658
 1004   1HB   LEU 134           2HB      LEU 134  -8.299  11.306   1.633
 1005   2HB   LEU 134           1HB      LEU 134  -8.821  10.459   3.088
 1006    HG   LEU 134            HG      LEU 134 -11.162  11.564   2.277
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.471  11.190  -0.132
 1008   2HD1  LEU 134          1HD1      LEU 134 -11.196  10.882  -0.225
 1009   3HD1  LEU 134          3HD1      LEU 134 -10.610  12.473   0.240
 1010   1HD2  LEU 134          2HD2      LEU 134  -9.970   8.924   1.474
 1011   2HD2  LEU 134          1HD2      LEU 134 -10.924   9.251   2.913
 1012   3HD2  LEU 134          3HD2      LEU 134 -11.679   9.308   1.322
 1013    NH1  ARG 135           NH2      ARG 135  -3.506   9.898   5.466
 1014    NH2  ARG 135           NH1      ARG 135  -1.737  10.322   6.809
 1015    H    ARG 135             H      ARG 135  -7.033  13.971   3.121
 1016    HA   ARG 135            HA      ARG 135  -5.787  12.830   5.539
 1017   1HB   ARG 135           2HB      ARG 135  -4.908  14.702   3.352
 1018   2HB   ARG 135           1HB      ARG 135  -4.107  14.816   4.918
 1019   1HG   ARG 135           2HG      ARG 135  -4.410  12.044   3.971
 1020   2HG   ARG 135           1HG      ARG 135  -3.426  13.041   2.901
 1021   1HD   ARG 135           2HD      ARG 135  -1.796  12.354   4.392
 1022   2HD   ARG 135           1HD      ARG 135  -2.338  13.821   5.204
 1023    HE   ARG 135            HE      ARG 135  -3.505  12.451   6.815
 1024   1HH1  ARG 135          1HH2      ARG 135  -4.287  10.226   4.935
 1025   2HH1  ARG 135          2HH2      ARG 135  -3.297   8.921   5.499
 1026   1HH2  ARG 135          2HH1      ARG 135  -1.163  10.972   7.307
 1027   2HH2  ARG 135          1HH1      ARG 135  -1.526   9.344   6.841
 1028    NH1  ARG 136           NH1      ARG 136  -5.749  22.505   2.640
 1029    NH2  ARG 136           NH2      ARG 136  -7.953  22.424   2.140
 1030    H    ARG 136             H      ARG 136  -7.246  15.768   4.259
 1031    HA   ARG 136            HA      ARG 136  -7.115  17.227   6.780
 1032   1HB   ARG 136           2HB      ARG 136  -8.471  17.688   4.126
 1033   2HB   ARG 136           1HB      ARG 136  -8.797  18.734   5.507
 1034   1HG   ARG 136           2HG      ARG 136  -6.586  19.543   5.577
 1035   2HG   ARG 136           1HG      ARG 136  -5.959  18.176   4.658
 1036   1HD   ARG 136           2HD      ARG 136  -6.066  19.532   2.843
 1037   2HD   ARG 136           1HD      ARG 136  -7.813  19.310   2.918
 1038    HE   ARG 136            HE      ARG 136  -7.353  21.379   4.688
 1039   1HH1  ARG 136          2HH1      ARG 136  -4.973  22.188   3.183
 1040   2HH1  ARG 136          1HH1      ARG 136  -5.615  23.199   1.933
 1041   1HH2  ARG 136          1HH2      ARG 136  -8.864  22.045   2.300
 1042   2HH2  ARG 136          2HH2      ARG 136  -7.819  23.124   1.437
 1043    H    SER 137             H      SER 137  -8.898  14.613   5.734
 1044    HA   SER 137            HA      SER 137 -11.456  15.309   6.944
 1045   1HB   SER 137           2HB      SER 137 -12.228  13.298   5.946
 1046   2HB   SER 137           1HB      SER 137 -11.032  13.858   4.809
 1047    HG   SER 137            HG      SER 137 -10.806  11.628   5.343
 1048    H    GLN 138             H      GLN 138  -8.399  13.963   7.916
 1049    HA   GLN 138            HA      GLN 138  -7.694  13.258  10.063
 1050   1HB   GLN 138           2HB      GLN 138  -9.896  14.703  10.743
 1051   2HB   GLN 138           1HB      GLN 138 -10.436  13.098  11.235
 1052   1HG   GLN 138           2HG      GLN 138  -7.980  13.006  12.289
 1053   2HG   GLN 138           1HG      GLN 138  -8.196  14.757  12.311
 1054   1HE2  GLN 138          2HE2      GLN 138 -10.736  12.457  14.610
 1055   2HE2  GLN 138          1HE2      GLN 138 -10.048  11.775  13.216
 1056    OH   TYR 139            OH      TYR 139 -15.297   8.979  10.053
 1057    H    TYR 139             H      TYR 139  -8.714  11.533   7.846
 1058    HA   TYR 139            HA      TYR 139  -9.435   9.093   9.423
 1059   1HB   TYR 139           2HB      TYR 139 -10.261  10.092   6.728
 1060   2HB   TYR 139           1HB      TYR 139 -10.062   8.353   6.925
 1061    HD1  TYR 139           HD2      TYR 139 -11.052   7.487   9.327
 1062    HD2  TYR 139           HD1      TYR 139 -12.411  10.898   7.096
 1063    HE1  TYR 139           HE2      TYR 139 -13.254   7.355  10.463
 1064    HE2  TYR 139           HE1      TYR 139 -14.610  10.762   8.232
 1065    HH   TYR 139            HH      TYR 139 -15.143   9.026  10.998
   
  Start of MODEL          18
 Raw file had 1065 H/Q atoms
  Start of MODEL   18
    1   1H    ALA   1            1H      ALA   1 -19.987  14.822   3.403
    2   2H    ALA   1            3H      ALA   1 -20.123  15.491   4.957
    3   3H    ALA   1            2H      ALA   1 -21.417  15.616   3.864
    4    HA   ALA   1            HA      ALA   1 -20.307  17.154   2.515
    5   1HB   ALA   1           1HB      ALA   1 -21.127  17.962   4.796
    6   2HB   ALA   1           3HB      ALA   1 -19.448  17.869   5.328
    7   3HB   ALA   1           2HB      ALA   1 -19.899  18.970   4.027
    8    H    GLY   2             H      GLY   2 -18.519  17.061   1.269
    9   1HA   GLY   2           2HA      GLY   2 -16.078  17.671   1.198
   10   2HA   GLY   2           1HA      GLY   2 -15.866  16.594   2.580
   11    CH2  TRP   3           CH2      TRP   3 -12.462  11.123   3.797
   12    H    TRP   3             H      TRP   3 -16.953  14.288   2.044
   13    HA   TRP   3            HA      TRP   3 -15.374  12.917   0.210
   14   1HB   TRP   3           2HB      TRP   3 -17.952  12.318   1.390
   15   2HB   TRP   3           1HB      TRP   3 -17.437  11.320   0.091
   16    HD1  TRP   3           HD1      TRP   3 -17.665   9.608   2.156
   17    HE1  TRP   3           HE1      TRP   3 -15.865   8.662   3.706
   18    HE3  TRP   3           HE3      TRP   3 -14.017  13.213   1.612
   19    HZ2  TRP   3           HZ2      TRP   3 -13.270   9.315   4.597
   20    HZ3  TRP   3           HZ3      TRP   3 -11.909  12.962   2.842
   21    HH2  TRP   3           HH2      TRP   3 -11.528  11.029   4.331
   22    H    ASN   4             H      ASN   4 -18.695  14.126  -0.262
   23    HA   ASN   4            HA      ASN   4 -19.085  13.218  -2.904
   24   1HB   ASN   4           2HB      ASN   4 -20.334  15.433  -1.332
   25   2HB   ASN   4           1HB      ASN   4 -20.803  15.133  -3.005
   26   1HD2  ASN   4          2HD2      ASN   4 -22.635  12.963  -0.309
   27   2HD2  ASN   4          1HD2      ASN   4 -22.045  14.540  -0.113
   28    H    ALA   5             H      ALA   5 -17.802  16.300  -1.837
   29    HA   ALA   5            HA      ALA   5 -17.590  17.542  -4.495
   30   1HB   ALA   5           2HB      ALA   5 -17.027  18.343  -1.857
   31   2HB   ALA   5           1HB      ALA   5 -15.431  18.268  -2.606
   32   3HB   ALA   5           3HB      ALA   5 -16.690  19.283  -3.312
   33    OH   TYR   6            OH      TYR   6 -12.807  17.556   1.322
   34    H    TYR   6             H      TYR   6 -15.762  15.133  -2.744
   35    HA   TYR   6            HA      TYR   6 -13.458  15.214  -4.516
   36   1HB   TYR   6           2HB      TYR   6 -14.284  13.085  -2.560
   37   2HB   TYR   6           1HB      TYR   6 -12.674  13.358  -3.179
   38    HD1  TYR   6           HD1      TYR   6 -13.104  16.547  -3.062
   39    HD2  TYR   6           HD2      TYR   6 -13.510  13.349  -0.261
   40    HE1  TYR   6           HE1      TYR   6 -12.776  18.152  -1.222
   41    HE2  TYR   6           HE2      TYR   6 -13.186  14.958   1.597
   42    HH   TYR   6            HH      TYR   6 -13.628  18.038   1.423
   43    H    ILE   7             H      ILE   7 -16.468  13.580  -4.175
   44    HA   ILE   7            HA      ILE   7 -16.050  11.663  -6.290
   45    HB   ILE   7            HB      ILE   7 -18.666  12.703  -5.433
   46   1HG1  ILE   7          2HG1      ILE   7 -17.486  11.812  -3.469
   47   2HG1  ILE   7          1HG1      ILE   7 -18.835  10.794  -3.916
   48   1HG2  ILE   7          1HG2      ILE   7 -17.803  10.243  -6.864
   49   2HG2  ILE   7          3HG2      ILE   7 -19.446  10.509  -6.276
   50   3HG2  ILE   7          2HG2      ILE   7 -18.766  11.579  -7.513
   51   1HD1  ILE   7          2HD1      ILE   7 -16.453  10.011  -5.346
   52   2HD1  ILE   7          1HD1      ILE   7 -16.163   9.996  -3.611
   53   3HD1  ILE   7          3HD1      ILE   7 -17.470   9.074  -4.306
   54    H    ASP   8             H      ASP   8 -16.698  15.038  -6.025
   55    HA   ASP   8            HA      ASP   8 -17.985  15.387  -8.496
   56   1HB   ASP   8           2HB      ASP   8 -17.028  17.101  -6.345
   57   2HB   ASP   8           1HB      ASP   8 -17.158  17.881  -7.868
   58    H    ASN   9             H      ASN   9 -14.648  15.594  -7.402
   59    HA   ASN   9            HA      ASN   9 -13.469  16.360  -9.895
   60   1HB   ASN   9           2HB      ASN   9 -11.830  16.277  -8.168
   61   2HB   ASN   9           1HB      ASN   9 -12.554  14.924  -7.387
   62   1HD2  ASN   9          2HD2      ASN   9 -10.853  12.194  -9.489
   63   2HD2  ASN   9          1HD2      ASN   9 -11.940  12.515  -8.226
   64    H    LEU  10             H      LEU  10 -13.765  13.539  -8.208
   65    HA   LEU  10            HA      LEU  10 -12.976  11.570  -9.567
   66   1HB   LEU  10           2HB      LEU  10 -15.023  12.136  -7.669
   67   2HB   LEU  10           1HB      LEU  10 -15.187  10.626  -8.305
   68    HG   LEU  10            HG      LEU  10 -12.864  11.730  -6.730
   69   1HD1  LEU  10          2HD1      LEU  10 -14.791   9.471  -6.304
   70   2HD1  LEU  10          1HD1      LEU  10 -13.301   9.618  -5.375
   71   3HD1  LEU  10          3HD1      LEU  10 -14.522  10.890  -5.291
   72   1HD2  LEU  10          3HD2      LEU  10 -12.180  10.163  -8.761
   73   2HD2  LEU  10          2HD2      LEU  10 -11.455   9.927  -7.187
   74   3HD2  LEU  10          1HD2      LEU  10 -12.773   8.887  -7.709
   75    H    MET  11             H      MET  11 -15.913  13.110 -10.272
   76    HA   MET  11            HA      MET  11 -16.136  11.331 -12.647
   77   1HB   MET  11           2HB      MET  11 -18.438  11.535 -12.564
   78   2HB   MET  11           1HB      MET  11 -18.005  11.638 -10.867
   79   1HG   MET  11           2HG      MET  11 -19.069  13.475 -10.798
   80   2HG   MET  11           1HG      MET  11 -17.817  14.170 -11.747
   81   1HE   MET  11           1HE      MET  11 -18.093  12.282 -14.284
   82   2HE   MET  11           3HE      MET  11 -19.298  12.957 -15.392
   83   3HE   MET  11           2HE      MET  11 -18.004  13.968 -14.785
   84    H    ALA  12             H      ALA  12 -15.887  14.596 -11.695
   85    HA   ALA  12            HA      ALA  12 -15.918  15.882 -14.254
   86   1HB   ALA  12           1HB      ALA  12 -16.880  16.825 -12.090
   87   2HB   ALA  12           3HB      ALA  12 -15.207  17.160 -11.636
   88   3HB   ALA  12           2HB      ALA  12 -15.903  17.917 -13.069
   89    H    ASP  13             H      ASP  13 -13.306  14.186 -12.873
   90    HA   ASP  13            HA      ASP  13 -11.299  16.168 -12.701
   91   1HB   ASP  13           2HB      ASP  13  -9.783  14.457 -12.308
   92   2HB   ASP  13           1HB      ASP  13 -11.188  13.565 -12.140
   93    H    GLY  14             H      GLY  14 -12.987  15.609 -15.556
   94   1HA   GLY  14           2HA      GLY  14 -12.635  16.368 -17.810
   95   2HA   GLY  14           1HA      GLY  14 -11.264  17.291 -17.198
   96    H    THR  15             H      THR  15 -11.136  14.040 -16.530
   97    HA   THR  15            HA      THR  15  -9.784  12.958 -18.748
   98    HB   THR  15            HB      THR  15  -8.284  13.920 -16.365
   99    HG1  THR  15           HG1      THR  15  -7.269  14.991 -17.850
  100   1HG2  THR  15          2HG2      THR  15  -7.619  11.618 -18.170
  101   2HG2  THR  15          1HG2      THR  15  -6.450  12.407 -17.081
  102   3HG2  THR  15          3HG2      THR  15  -7.868  11.587 -16.426
  103    H    CYS  16             H      CYS  16 -11.592  12.610 -15.871
  104    HA   CYS  16            HA      CYS  16 -10.837   9.933 -15.255
  105   1HB   CYS  16           2HB      CYS  16 -12.053  10.396 -13.291
  106   2HB   CYS  16           1HB      CYS  16 -11.890  11.978 -13.828
  107    HG   CYS  16            HG      CYS  16 -14.492  10.532 -13.832
  108    H    GLN  17             H      GLN  17 -12.990   8.598 -14.868
  109    HA   GLN  17            HA      GLN  17 -15.134   8.837 -16.768
  110   1HB   GLN  17           2HB      GLN  17 -13.211   7.436 -17.822
  111   2HB   GLN  17           1HB      GLN  17 -13.760   6.169 -16.732
  112   1HG   GLN  17           2HG      GLN  17 -15.537   7.667 -18.682
  113   2HG   GLN  17           1HG      GLN  17 -14.864   6.074 -18.976
  114   1HE2  GLN  17          2HE2      GLN  17 -17.006   4.467 -16.539
  115   2HE2  GLN  17          1HE2      GLN  17 -15.444   4.373 -17.197
  116    H    ASP  18             H      ASP  18 -13.407   6.868 -14.361
  117    HA   ASP  18            HA      ASP  18 -15.927   6.607 -12.791
  118   1HB   ASP  18           2HB      ASP  18 -14.882   4.434 -13.840
  119   2HB   ASP  18           1HB      ASP  18 -13.835   4.542 -12.460
  120    H    ALA  19             H      ALA  19 -15.309   6.211 -10.432
  121    HA   ALA  19            HA      ALA  19 -12.869   7.748  -9.472
  122   1HB   ALA  19           3HB      ALA  19 -15.162   8.971 -10.550
  123   2HB   ALA  19           2HB      ALA  19 -15.360   9.055  -8.799
  124   3HB   ALA  19           1HB      ALA  19 -13.884   9.616  -9.569
  125    H    ALA  20             H      ALA  20 -12.620   6.719  -7.242
  126    HA   ALA  20            HA      ALA  20 -15.185   6.560  -5.716
  127   1HB   ALA  20           2HB      ALA  20 -13.819   4.091  -6.642
  128   2HB   ALA  20           1HB      ALA  20 -14.800   4.084  -5.150
  129   3HB   ALA  20           3HB      ALA  20 -15.525   4.528  -6.710
  130    H    ILE  21             H      ILE  21 -14.877   7.213  -3.775
  131    HA   ILE  21            HA      ILE  21 -12.353   6.725  -2.314
  132    HB   ILE  21            HB      ILE  21 -14.917   7.977  -1.325
  133   1HG1  ILE  21          2HG1      ILE  21 -12.374   9.177  -2.482
  134   2HG1  ILE  21          1HG1      ILE  21 -13.981   9.257  -3.193
  135   1HG2  ILE  21          2HG2      ILE  21 -12.161   7.527  -0.187
  136   2HG2  ILE  21          1HG2      ILE  21 -13.047   8.970   0.308
  137   3HG2  ILE  21          3HG2      ILE  21 -13.724   7.368   0.611
  138   1HD1  ILE  21          1HD1      ILE  21 -14.724  10.472  -1.113
  139   2HD1  ILE  21          3HD1      ILE  21 -13.029  10.552  -0.650
  140   3HD1  ILE  21          2HD1      ILE  21 -13.577  11.348  -2.117
  141    H    VAL  22             H      VAL  22 -12.253   5.015  -0.680
  142    HA   VAL  22            HA      VAL  22 -14.748   3.403  -0.376
  143    HB   VAL  22            HB      VAL  22 -12.056   2.324  -1.259
  144   1HG1  VAL  22          2HG1      VAL  22 -13.426   0.773   0.186
  145   2HG1  VAL  22          1HG1      VAL  22 -14.710   0.870  -1.020
  146   3HG1  VAL  22          3HG1      VAL  22 -13.147   0.163  -1.445
  147   1HG2  VAL  22          3HG2      VAL  22 -14.663   2.824  -2.732
  148   2HG2  VAL  22          2HG2      VAL  22 -13.071   3.490  -3.120
  149   3HG2  VAL  22          1HG2      VAL  22 -13.400   1.771  -3.362
  150    H    GLY  23             H      GLY  23 -15.037   3.088   1.892
  151   1HA   GLY  23           2HA      GLY  23 -12.848   3.302   3.813
  152   2HA   GLY  23           1HA      GLY  23 -14.492   2.762   4.182
  153    OH   TYR  24            OH      TYR  24  -5.529   1.226   5.295
  154    H    TYR  24             H      TYR  24 -11.417   1.740   2.935
  155    HA   TYR  24            HA      TYR  24 -11.982  -1.041   2.566
  156   1HB   TYR  24           2HB      TYR  24  -9.829  -1.084   1.575
  157   2HB   TYR  24           1HB      TYR  24 -10.278   0.579   1.423
  158    HD1  TYR  24           HD1      TYR  24  -9.722   2.024   3.713
  159    HD2  TYR  24           HD2      TYR  24  -7.719  -1.511   2.413
  160    HE1  TYR  24           HE1      TYR  24  -7.762   2.627   5.098
  161    HE2  TYR  24           HE2      TYR  24  -5.756  -0.921   3.766
  162    HH   TYR  24            HH      TYR  24  -5.849   1.551   6.138
  163    H    LYS  25             H      LYS  25 -12.238   0.031   5.480
  164    HA   LYS  25            HA      LYS  25 -10.154  -0.876   7.110
  165   1HB   LYS  25           2HB      LYS  25 -13.042  -0.442   7.557
  166   2HB   LYS  25           1HB      LYS  25 -12.043  -1.061   8.829
  167   1HG   LYS  25           2HG      LYS  25 -11.971   1.240   9.195
  168   2HG   LYS  25           1HG      LYS  25 -10.490   0.934   8.291
  169   1HD   LYS  25           2HD      LYS  25 -11.370   1.764   6.320
  170   2HD   LYS  25           1HD      LYS  25 -13.038   1.593   6.876
  171   1HE   LYS  25           2HE      LYS  25 -11.013   3.483   8.052
  172   2HE   LYS  25           1HE      LYS  25 -12.267   3.946   6.926
  173   1HZ   LYS  25           3HZ      LYS  25 -13.811   2.822   8.655
  174   2HZ   LYS  25           2HZ      LYS  25 -12.515   3.070   9.722
  175   3HZ   LYS  25           1HZ      LYS  25 -13.245   4.393   8.949
  176    H    ASP  26             H      ASP  26 -11.448  -2.715   8.851
  177    HA   ASP  26            HA      ASP  26 -10.790  -5.281   7.952
  178   1HB   ASP  26           2HB      ASP  26 -12.802  -6.031   9.462
  179   2HB   ASP  26           1HB      ASP  26 -11.361  -5.370  10.199
  180    H    SER  27             H      SER  27 -14.002  -3.854   7.912
  181    HA   SER  27            HA      SER  27 -14.834  -5.660   5.745
  182   1HB   SER  27           2HB      SER  27 -17.091  -4.635   6.378
  183   2HB   SER  27           1HB      SER  27 -16.417  -5.768   7.517
  184    HG   SER  27            HG      SER  27 -17.163  -3.832   8.516
  185    HA   PRO  28            HA      PRO  28 -13.992  -1.908   3.524
  186   1HB   PRO  28           2HB      PRO  28 -14.142  -2.980   1.013
  187   2HB   PRO  28           1HB      PRO  28 -12.709  -3.072   2.055
  188   1HG   PRO  28           2HG      PRO  28 -14.620  -5.206   1.371
  189   2HG   PRO  28           1HG      PRO  28 -12.991  -5.325   1.991
  190   1HD   PRO  28           2HD      PRO  28 -15.401  -5.653   3.431
  191   2HD   PRO  28           1HD      PRO  28 -13.742  -5.668   4.072
  192    H    SER  29             H      SER  29 -15.156  -0.488   2.120
  193    HA   SER  29            HA      SER  29 -17.718  -1.184   1.090
  194   1HB   SER  29           2HB      SER  29 -19.059   0.263   2.555
  195   2HB   SER  29           1HB      SER  29 -18.302  -1.026   3.486
  196    HG   SER  29            HG      SER  29 -18.144   1.255   4.275
  197    H    VAL  30             H      VAL  30 -18.793   0.833   0.270
  198    HA   VAL  30            HA      VAL  30 -16.728   2.554  -0.858
  199    HB   VAL  30            HB      VAL  30 -19.553   1.825  -1.584
  200   1HG1  VAL  30          3HG1      VAL  30 -19.168   4.325  -1.931
  201   2HG1  VAL  30          2HG1      VAL  30 -17.872   3.879  -3.041
  202   3HG1  VAL  30          1HG1      VAL  30 -19.534   3.404  -3.390
  203   1HG2  VAL  30          1HG2      VAL  30 -17.251   0.594  -2.103
  204   2HG2  VAL  30          3HG2      VAL  30 -18.518   0.693  -3.317
  205   3HG2  VAL  30          2HG2      VAL  30 -17.167   1.808  -3.379
  206    CH2  TRP  31           CH2      TRP  31 -13.571   6.011   6.932
  207    H    TRP  31             H      TRP  31 -16.298   4.198   0.535
  208    HA   TRP  31            HA      TRP  31 -18.219   5.443   2.294
  209   1HB   TRP  31           2HB      TRP  31 -15.379   5.964   1.467
  210   2HB   TRP  31           1HB      TRP  31 -16.263   7.252   2.290
  211    HD1  TRP  31           HD1      TRP  31 -17.393   3.853   3.312
  212    HE1  TRP  31           HE1      TRP  31 -16.541   3.301   5.621
  213    HE3  TRP  31           HE3      TRP  31 -13.919   7.564   3.928
  214    HZ2  TRP  31           HZ2      TRP  31 -14.677   4.274   7.550
  215    HZ3  TRP  31           HZ3      TRP  31 -12.633   7.729   6.038
  216    HH2  TRP  31           HH2      TRP  31 -13.000   6.076   7.847
  217    H    ALA  32             H      ALA  32 -17.079   5.996  -0.924
  218    HA   ALA  32            HA      ALA  32 -19.311   7.653  -1.648
  219   1HB   ALA  32           2HB      ALA  32 -17.754   9.359  -0.466
  220   2HB   ALA  32           1HB      ALA  32 -16.559   9.006  -1.736
  221   3HB   ALA  32           3HB      ALA  32 -18.117   9.739  -2.163
  222    H    ALA  33             H      ALA  33 -19.492   7.571  -3.992
  223    HA   ALA  33            HA      ALA  33 -17.243   6.941  -5.715
  224   1HB   ALA  33           1HB      ALA  33 -19.019   4.645  -4.858
  225   2HB   ALA  33           3HB      ALA  33 -18.088   4.604  -6.353
  226   3HB   ALA  33           2HB      ALA  33 -17.259   4.736  -4.800
  227    H    VAL  34             H      VAL  34 -17.802   7.168  -7.885
  228    HA   VAL  34            HA      VAL  34 -20.280   8.368  -8.604
  229    HB   VAL  34            HB      VAL  34 -18.228   6.953 -10.427
  230   1HG1  VAL  34          1HG1      VAL  34 -20.700   7.549 -11.216
  231   2HG1  VAL  34          3HG1      VAL  34 -20.075   9.200 -11.245
  232   3HG1  VAL  34          2HG1      VAL  34 -19.319   7.952 -12.239
  233   1HG2  VAL  34          1HG2      VAL  34 -17.489   8.914  -8.886
  234   2HG2  VAL  34          3HG2      VAL  34 -17.201   9.114 -10.618
  235   3HG2  VAL  34          2HG2      VAL  34 -18.563   9.934  -9.846
  236    HA   PRO  35            HA      PRO  35 -22.436   4.390  -8.266
  237   1HB   PRO  35           2HB      PRO  35 -24.989   5.401  -8.353
  238   2HB   PRO  35           1HB      PRO  35 -23.986   5.371  -6.893
  239   1HG   PRO  35           2HG      PRO  35 -24.660   7.691  -8.660
  240   2HG   PRO  35           1HG      PRO  35 -24.264   7.676  -6.932
  241   1HD   PRO  35           2HD      PRO  35 -22.500   8.406  -9.009
  242   2HD   PRO  35           1HD      PRO  35 -22.032   8.018  -7.342
  243    H    GLY  36             H      GLY  36 -23.397   2.975  -9.692
  244   1HA   GLY  36           2HA      GLY  36 -24.662   2.350 -11.642
  245   2HA   GLY  36           1HA      GLY  36 -24.451   3.982 -12.274
  246    H    LYS  37             H      LYS  37 -21.421   3.447 -11.280
  247    HA   LYS  37            HA      LYS  37 -20.562   2.537 -13.931
  248   1HB   LYS  37           2HB      LYS  37 -19.295   3.976 -11.645
  249   2HB   LYS  37           1HB      LYS  37 -18.261   3.134 -12.802
  250   1HG   LYS  37           2HG      LYS  37 -18.523   5.343 -13.651
  251   2HG   LYS  37           1HG      LYS  37 -19.568   4.322 -14.625
  252   1HD   LYS  37           2HD      LYS  37 -20.815   5.457 -12.193
  253   2HD   LYS  37           1HD      LYS  37 -20.405   6.619 -13.452
  254   1HE   LYS  37           2HE      LYS  37 -21.651   4.208 -14.549
  255   2HE   LYS  37           1HE      LYS  37 -22.688   5.033 -13.388
  256   1HZ   LYS  37           3HZ      LYS  37 -21.283   6.585 -15.451
  257   2HZ   LYS  37           2HZ      LYS  37 -22.713   5.758 -15.848
  258   3HZ   LYS  37           1HZ      LYS  37 -22.725   6.945 -14.633
  259    H    THR  38             H      THR  38 -18.715   1.873 -10.917
  260    HA   THR  38            HA      THR  38 -19.246  -0.983 -10.993
  261    HB   THR  38            HB      THR  38 -16.944   0.185 -12.448
  262    HG1  THR  38           HG1      THR  38 -18.098  -0.650 -13.943
  263   1HG2  THR  38          1HG2      THR  38 -16.858  -2.377 -10.921
  264   2HG2  THR  38          3HG2      THR  38 -16.010  -2.273 -12.461
  265   3HG2  THR  38          2HG2      THR  38 -15.577  -1.185 -11.139
  266    H    PHE  39             H      PHE  39 -17.072   1.601  -9.862
  267    HA   PHE  39            HA      PHE  39 -15.648   0.145  -7.848
  268   1HB   PHE  39           2HB      PHE  39 -16.408   3.048  -7.865
  269   2HB   PHE  39           1HB      PHE  39 -15.143   2.303  -6.889
  270    HD1  PHE  39           HD2      PHE  39 -14.795   0.386  -9.706
  271    HD2  PHE  39           HD1      PHE  39 -14.312   4.492  -8.525
  272    HE1  PHE  39           HE2      PHE  39 -13.178   0.723 -11.527
  273    HE2  PHE  39           HE1      PHE  39 -12.696   4.819 -10.323
  274    HZ   PHE  39            HZ      PHE  39 -12.129   2.924 -11.833
  275    H    VAL  40             H      VAL  40 -18.637   1.949  -7.598
  276    HA   VAL  40            HA      VAL  40 -18.957   1.923  -4.808
  277    HB   VAL  40            HB      VAL  40 -20.407   3.350  -6.046
  278   1HG1  VAL  40          2HG1      VAL  40 -21.012   0.841  -7.582
  279   2HG1  VAL  40          1HG1      VAL  40 -22.114   2.221  -7.629
  280   3HG1  VAL  40          3HG1      VAL  40 -20.445   2.410  -8.178
  281   1HG2  VAL  40          3HG2      VAL  40 -21.386   1.582  -4.161
  282   2HG2  VAL  40          2HG2      VAL  40 -22.279   2.969  -4.798
  283   3HG2  VAL  40          1HG2      VAL  40 -22.524   1.369  -5.493
  284    H    ASN  41             H      ASN  41 -19.234  -0.642  -7.139
  285    HA   ASN  41            HA      ASN  41 -20.645  -2.402  -5.263
  286   1HB   ASN  41           2HB      ASN  41 -19.938  -2.495  -8.153
  287   2HB   ASN  41           1HB      ASN  41 -20.107  -3.996  -7.276
  288   1HD2  ASN  41          2HD2      ASN  41 -23.437  -2.204  -8.469
  289   2HD2  ASN  41          1HD2      ASN  41 -21.897  -1.903  -9.115
  290    H    ILE  42             H      ILE  42 -17.915  -1.278  -4.702
  291    HA   ILE  42            HA      ILE  42 -15.982  -3.354  -5.156
  292    HB   ILE  42            HB      ILE  42 -16.064  -0.695  -3.732
  293   1HG1  ILE  42          2HG1      ILE  42 -13.865  -1.924  -5.405
  294   2HG1  ILE  42          1HG1      ILE  42 -15.327  -1.301  -6.161
  295   1HG2  ILE  42          2HG2      ILE  42 -14.131  -2.919  -3.009
  296   2HG2  ILE  42          1HG2      ILE  42 -13.658  -1.230  -2.889
  297   3HG2  ILE  42          3HG2      ILE  42 -15.008  -1.837  -1.935
  298   1HD1  ILE  42          3HD1      ILE  42 -14.870   0.879  -4.889
  299   2HD1  ILE  42          2HD1      ILE  42 -13.274   0.216  -4.547
  300   3HD1  ILE  42          1HD1      ILE  42 -13.766   0.504  -6.224
  301    H    THR  43             H      THR  43 -15.103  -4.587  -3.466
  302    HA   THR  43            HA      THR  43 -16.607  -5.264  -1.023
  303    HB   THR  43            HB      THR  43 -16.448  -7.684  -1.901
  304    HG1  THR  43           HG1      THR  43 -14.857  -7.134  -3.480
  305   1HG2  THR  43          1HG2      THR  43 -18.358  -5.730  -2.352
  306   2HG2  THR  43          3HG2      THR  43 -18.086  -6.451  -3.940
  307   3HG2  THR  43          2HG2      THR  43 -18.583  -7.465  -2.586
  308    HA   PRO  44            HA      PRO  44 -12.463  -6.222   0.431
  309   1HB   PRO  44           2HB      PRO  44 -12.538  -8.655   1.559
  310   2HB   PRO  44           1HB      PRO  44 -13.150  -7.218   2.336
  311   1HG   PRO  44           2HG      PRO  44 -14.662  -9.462   1.101
  312   2HG   PRO  44           1HG      PRO  44 -15.178  -8.323   2.360
  313   1HD   PRO  44           2HD      PRO  44 -15.900  -8.217  -0.341
  314   2HD   PRO  44           1HD      PRO  44 -16.127  -6.909   0.817
  315    H    ALA  45             H      ALA  45 -13.637  -7.925  -2.068
  316    HA   ALA  45            HA      ALA  45 -11.378  -9.681  -2.566
  317   1HB   ALA  45           3HB      ALA  45 -13.986  -9.080  -3.862
  318   2HB   ALA  45           2HB      ALA  45 -12.689  -9.700  -4.891
  319   3HB   ALA  45           1HB      ALA  45 -13.253 -10.650  -3.518
  320    H    GLU  46             H      GLU  46 -12.963  -7.182  -4.398
  321    HA   GLU  46            HA      GLU  46 -10.711  -6.488  -6.021
  322   1HB   GLU  46           2HB      GLU  46 -12.024  -4.157  -6.164
  323   2HB   GLU  46           1HB      GLU  46 -12.578  -5.568  -7.033
  324   1HG   GLU  46           2HG      GLU  46 -13.557  -5.375  -4.282
  325   2HG   GLU  46           1HG      GLU  46 -14.064  -4.041  -5.309
  326    H    VAL  47             H      VAL  47 -11.665  -5.468  -2.832
  327    HA   VAL  47            HA      VAL  47  -9.564  -3.472  -2.672
  328    HB   VAL  47            HB      VAL  47 -11.972  -3.990  -1.168
  329   1HG1  VAL  47          2HG1      VAL  47  -9.540  -3.032   0.203
  330   2HG1  VAL  47          1HG1      VAL  47 -11.171  -2.857   0.830
  331   3HG1  VAL  47          3HG1      VAL  47 -10.459  -4.466   0.650
  332   1HG2  VAL  47          2HG2      VAL  47 -11.219  -2.004  -2.613
  333   2HG2  VAL  47          1HG2      VAL  47 -12.001  -1.640  -1.076
  334   3HG2  VAL  47          3HG2      VAL  47 -10.223  -1.571  -1.186
  335    H    GLY  48             H      GLY  48  -9.973  -6.793  -1.918
  336   1HA   GLY  48           2HA      GLY  48  -7.969  -7.086   0.115
  337   2HA   GLY  48           1HA      GLY  48  -8.447  -8.340  -1.021
  338    H    VAL  49             H      VAL  49  -7.824  -6.665  -3.330
  339    HA   VAL  49            HA      VAL  49  -4.912  -7.106  -3.375
  340    HB   VAL  49            HB      VAL  49  -6.361  -8.068  -5.179
  341   1HG1  VAL  49          3HG1      VAL  49  -6.570  -5.147  -5.994
  342   2HG1  VAL  49          2HG1      VAL  49  -7.055  -6.517  -6.997
  343   3HG1  VAL  49          1HG1      VAL  49  -7.908  -6.181  -5.489
  344   1HG2  VAL  49          3HG2      VAL  49  -4.000  -6.288  -5.598
  345   2HG2  VAL  49          2HG2      VAL  49  -4.160  -8.041  -5.783
  346   3HG2  VAL  49          1HG2      VAL  49  -4.810  -6.968  -7.017
  347    H    LEU  50             H      LEU  50  -7.205  -4.518  -3.872
  348    HA   LEU  50            HA      LEU  50  -5.418  -2.446  -4.636
  349   1HB   LEU  50           2HB      LEU  50  -8.096  -2.695  -3.558
  350   2HB   LEU  50           1HB      LEU  50  -7.362  -1.172  -3.330
  351    HG   LEU  50            HG      LEU  50  -7.375  -2.414  -6.027
  352   1HD1  LEU  50          1HD1      LEU  50  -9.708  -2.410  -4.843
  353   2HD1  LEU  50          3HD1      LEU  50  -9.623  -0.650  -4.997
  354   3HD1  LEU  50          2HD1      LEU  50  -9.594  -1.684  -6.437
  355   1HD2  LEU  50          3HD2      LEU  50  -6.167  -0.234  -5.290
  356   2HD2  LEU  50          2HD2      LEU  50  -7.180  -0.146  -6.732
  357   3HD2  LEU  50          1HD2      LEU  50  -7.787   0.468  -5.183
  358    H    VAL  51             H      VAL  51  -6.011  -3.964  -1.645
  359    HA   VAL  51            HA      VAL  51  -4.264  -1.999  -0.249
  360    HB   VAL  51            HB      VAL  51  -5.857  -1.769   1.530
  361   1HG1  VAL  51          1HG1      VAL  51  -6.611  -0.779  -0.676
  362   2HG1  VAL  51          3HG1      VAL  51  -7.711  -2.150  -0.802
  363   3HG1  VAL  51          2HG1      VAL  51  -7.870  -1.011   0.532
  364   1HG2  VAL  51          3HG2      VAL  51  -6.651  -4.476   0.766
  365   2HG2  VAL  51          2HG2      VAL  51  -6.775  -3.680   2.334
  366   3HG2  VAL  51          1HG2      VAL  51  -8.028  -3.436   1.123
  367    H    GLY  52             H      GLY  52  -4.841  -5.295  -0.991
  368   1HA   GLY  52           2HA      GLY  52  -4.102  -6.861   1.149
  369   2HA   GLY  52           1HA      GLY  52  -3.547  -7.191  -0.493
  370    H    LYS  53             H      LYS  53  -2.394  -6.985   2.406
  371    HA   LYS  53            HA      LYS  53  -0.317  -5.121   2.456
  372   1HB   LYS  53           2HB      LYS  53   0.686  -6.511   4.253
  373   2HB   LYS  53           1HB      LYS  53  -1.029  -6.205   4.504
  374   1HG   LYS  53           2HG      LYS  53  -0.907  -8.500   4.904
  375   2HG   LYS  53           1HG      LYS  53  -1.331  -8.467   3.192
  376   1HD   LYS  53           2HD      LYS  53   0.673  -9.322   2.553
  377   2HD   LYS  53           1HD      LYS  53   1.569  -8.315   3.691
  378   1HE   LYS  53           2HE      LYS  53   0.884  -9.831   5.538
  379   2HE   LYS  53           1HE      LYS  53   0.064 -10.865   4.365
  380   1HZ   LYS  53           2HZ      LYS  53   2.430 -10.719   3.220
  381   2HZ   LYS  53           1HZ      LYS  53   2.921 -10.469   4.828
  382   3HZ   LYS  53           3HZ      LYS  53   2.078 -11.878   4.412
  383    H    ASP  54             H      ASP  54  -0.502  -7.942   0.596
  384    HA   ASP  54            HA      ASP  54   2.072  -8.870   0.422
  385   1HB   ASP  54           2HB      ASP  54  -0.125  -9.614  -0.781
  386   2HB   ASP  54           1HB      ASP  54   0.510  -8.637  -2.086
  387    NH1  ARG  55           NH2      ARG  55   8.197  -8.216   2.016
  388    NH2  ARG  55           NH1      ARG  55   6.831  -9.117   3.577
  389    H    ARG  55             H      ARG  55   3.850  -8.098  -0.495
  390    HA   ARG  55            HA      ARG  55   3.834  -5.454  -1.668
  391   1HB   ARG  55           2HB      ARG  55   6.281  -6.669  -0.413
  392   2HB   ARG  55           1HB      ARG  55   5.905  -4.965  -0.631
  393   1HG   ARG  55           2HG      ARG  55   5.361  -5.101   1.595
  394   2HG   ARG  55           1HG      ARG  55   3.828  -5.685   0.955
  395   1HD   ARG  55           2HD      ARG  55   4.231  -7.474   2.315
  396   2HD   ARG  55           1HD      ARG  55   5.261  -8.001   0.985
  397    HE   ARG  55            HE      ARG  55   6.470  -6.317   3.119
  398   1HH1  ARG  55          1HH2      ARG  55   8.412  -7.480   1.377
  399   2HH1  ARG  55          2HH2      ARG  55   8.819  -8.994   2.111
  400   1HH2  ARG  55          2HH1      ARG  55   6.003  -9.068   4.133
  401   2HH2  ARG  55          1HH1      ARG  55   7.445  -9.903   3.662
  402    H    SER  56             H      SER  56   3.439  -7.790  -3.338
  403    HA   SER  56            HA      SER  56   5.440  -7.199  -5.348
  404   1HB   SER  56           2HB      SER  56   6.795  -8.595  -3.825
  405   2HB   SER  56           1HB      SER  56   5.672  -9.920  -4.099
  406    HG   SER  56            HG      SER  56   7.736  -9.102  -5.604
  407    H    SER  57             H      SER  57   3.046  -9.435  -4.263
  408    HA   SER  57            HA      SER  57   2.488 -10.857  -6.577
  409   1HB   SER  57           2HB      SER  57   0.150 -11.065  -5.627
  410   2HB   SER  57           1HB      SER  57   1.459 -11.552  -4.564
  411    HG   SER  57            HG      SER  57  -0.270 -10.043  -3.747
  412    H    PHE  58             H      PHE  58  -0.310  -8.983  -5.972
  413    HA   PHE  58            HA      PHE  58  -1.100  -8.481  -8.490
  414   1HB   PHE  58           2HB      PHE  58  -2.410  -6.579  -7.728
  415   2HB   PHE  58           1HB      PHE  58  -2.501  -7.984  -6.697
  416    HD1  PHE  58           HD2      PHE  58  -1.494  -8.026  -4.492
  417    HD2  PHE  58           HD1      PHE  58  -1.275  -4.564  -7.009
  418    HE1  PHE  58           HE2      PHE  58  -0.810  -6.658  -2.549
  419    HE2  PHE  58           HE1      PHE  58  -0.603  -3.192  -5.065
  420    HZ   PHE  58            HZ      PHE  58  -0.372  -4.243  -2.837
  421    OH   TYR  59            OH      TYR  59   2.499  -2.916  -2.899
  422    H    TYR  59             H      TYR  59   1.675  -6.691  -7.247
  423    HA   TYR  59            HA      TYR  59   1.350  -4.487  -8.979
  424   1HB   TYR  59           2HB      TYR  59   4.032  -5.572  -8.208
  425   2HB   TYR  59           1HB      TYR  59   3.663  -3.947  -8.768
  426    HD1  TYR  59           HD1      TYR  59   1.426  -3.061  -7.335
  427    HD2  TYR  59           HD2      TYR  59   4.653  -5.507  -5.964
  428    HE1  TYR  59           HE1      TYR  59   1.094  -2.203  -5.020
  429    HE2  TYR  59           HE2      TYR  59   4.319  -4.665  -3.655
  430    HH   TYR  59            HH      TYR  59   3.365  -2.767  -2.509
  431    H    VAL  60             H      VAL  60   1.695  -7.584  -9.967
  432    HA   VAL  60            HA      VAL  60   2.770  -6.736 -12.570
  433    HB   VAL  60            HB      VAL  60   3.209  -9.345 -12.670
  434   1HG1  VAL  60          1HG1      VAL  60   4.817  -7.150 -11.425
  435   2HG1  VAL  60          3HG1      VAL  60   5.488  -8.777 -11.539
  436   3HG1  VAL  60          2HG1      VAL  60   5.025  -7.914 -13.004
  437   1HG2  VAL  60          1HG2      VAL  60   2.240  -9.841 -10.457
  438   2HG2  VAL  60          3HG2      VAL  60   3.964 -10.220 -10.486
  439   3HG2  VAL  60          2HG2      VAL  60   3.399  -8.734  -9.719
  440    H    ASN  61             H      ASN  61   0.227  -8.678 -10.921
  441    HA   ASN  61            HA      ASN  61  -0.860  -9.488 -13.487
  442   1HB   ASN  61           2HB      ASN  61  -2.587 -10.605 -12.133
  443   2HB   ASN  61           1HB      ASN  61  -0.991 -11.117 -11.717
  444   1HD2  ASN  61          2HD2      ASN  61  -1.514 -10.389  -8.379
  445   2HD2  ASN  61          1HD2      ASN  61  -0.757 -11.339  -9.557
  446    H    GLY  62             H      GLY  62  -1.696  -7.248 -10.881
  447   1HA   GLY  62           2HA      GLY  62  -2.600  -5.089 -11.747
  448   2HA   GLY  62           1HA      GLY  62  -3.732  -6.076 -12.660
  449    H    LEU  63             H      LEU  63  -4.208  -3.984 -10.544
  450    HA   LEU  63            HA      LEU  63  -5.264  -5.424  -8.178
  451   1HB   LEU  63           2HB      LEU  63  -5.932  -2.571  -9.000
  452   2HB   LEU  63           1HB      LEU  63  -6.262  -3.281  -7.428
  453    HG   LEU  63            HG      LEU  63  -3.505  -2.829  -8.593
  454   1HD1  LEU  63          2HD1      LEU  63  -5.055  -0.840  -7.994
  455   2HD1  LEU  63          1HD1      LEU  63  -4.916  -1.396  -6.326
  456   3HD1  LEU  63          3HD1      LEU  63  -3.490  -0.900  -7.214
  457   1HD2  LEU  63          2HD2      LEU  63  -4.602  -3.793  -5.925
  458   2HD2  LEU  63          1HD2      LEU  63  -3.525  -4.671  -7.013
  459   3HD2  LEU  63          3HD2      LEU  63  -2.938  -3.255  -6.148
  460    H    THR  64             H      THR  64  -7.798  -4.175  -7.868
  461    HA   THR  64            HA      THR  64  -9.427  -4.705 -10.173
  462    HB   THR  64            HB      THR  64 -10.742  -6.469  -8.886
  463    HG1  THR  64           HG1      THR  64  -9.482  -7.587  -7.346
  464   1HG2  THR  64          3HG2      THR  64  -9.109  -6.806 -10.810
  465   2HG2  THR  64          2HG2      THR  64  -7.944  -7.321  -9.580
  466   3HG2  THR  64          1HG2      THR  64  -9.457  -8.215  -9.811
  467    H    LEU  65             H      LEU  65 -10.938  -3.233  -9.975
  468    HA   LEU  65            HA      LEU  65 -11.987  -2.558  -7.270
  469   1HB   LEU  65           2HB      LEU  65 -12.276  -0.181  -8.259
  470   2HB   LEU  65           1HB      LEU  65 -10.762  -0.644  -7.549
  471    HG   LEU  65            HG      LEU  65 -11.242  -0.973 -10.498
  472   1HD1  LEU  65          3HD1      LEU  65 -11.475   1.473  -9.257
  473   2HD1  LEU  65          2HD1      LEU  65  -9.733   1.408  -9.571
  474   3HD1  LEU  65          1HD1      LEU  65 -10.873   1.249 -10.908
  475   1HD2  LEU  65          1HD2      LEU  65  -8.992  -1.174  -8.573
  476   2HD2  LEU  65          3HD2      LEU  65  -9.212  -1.974 -10.129
  477   3HD2  LEU  65          2HD2      LEU  65  -8.612  -0.318 -10.064
  478    H    GLY  66             H      GLY  66 -13.939  -3.449  -7.388
  479   1HA   GLY  66           2HA      GLY  66 -16.208  -3.588  -7.964
  480   2HA   GLY  66           1HA      GLY  66 -15.917  -2.392  -9.229
  481    H    GLY  67             H      GLY  67 -13.819  -5.186  -9.002
  482   1HA   GLY  67           2HA      GLY  67 -13.800  -7.206 -10.232
  483   2HA   GLY  67           1HA      GLY  67 -15.301  -6.716 -11.020
  484    H    GLN  68             H      GLN  68 -13.019  -4.102 -11.012
  485    HA   GLN  68            HA      GLN  68 -12.392  -4.743 -13.884
  486   1HB   GLN  68           2HB      GLN  68 -13.471  -2.666 -13.790
  487   2HB   GLN  68           1HB      GLN  68 -12.521  -2.208 -12.427
  488   1HG   GLN  68           2HG      GLN  68 -11.924  -1.154 -14.757
  489   2HG   GLN  68           1HG      GLN  68 -10.615  -1.656 -13.699
  490   1HE2  GLN  68          2HE2      GLN  68  -9.281  -3.587 -16.393
  491   2HE2  GLN  68          1HE2      GLN  68  -9.003  -2.406 -15.202
  492    H    LYS  69             H      LYS  69 -10.561  -5.838 -13.994
  493    HA   LYS  69            HA      LYS  69  -8.408  -5.577 -12.170
  494   1HB   LYS  69           2HB      LYS  69  -9.227  -7.417 -14.021
  495   2HB   LYS  69           1HB      LYS  69  -7.801  -6.725 -14.796
  496   1HG   LYS  69           2HG      LYS  69  -6.370  -7.549 -13.212
  497   2HG   LYS  69           1HG      LYS  69  -7.549  -7.371 -11.911
  498   1HD   LYS  69           2HD      LYS  69  -8.649  -9.350 -12.453
  499   2HD   LYS  69           1HD      LYS  69  -7.999  -9.375 -14.088
  500   1HE   LYS  69           2HE      LYS  69  -6.515 -10.891 -13.235
  501   2HE   LYS  69           1HE      LYS  69  -5.688  -9.461 -12.616
  502   1HZ   LYS  69           1HZ      LYS  69  -7.185  -9.688 -10.616
  503   2HZ   LYS  69           3HZ      LYS  69  -7.587 -11.231 -11.196
  504   3HZ   LYS  69           2HZ      LYS  69  -5.977 -10.872 -10.785
  505    H    CYS  70             H      CYS  70  -7.269  -3.627 -12.063
  506    HA   CYS  70            HA      CYS  70  -6.364  -2.466 -14.728
  507   1HB   CYS  70           2HB      CYS  70  -5.673  -0.501 -13.337
  508   2HB   CYS  70           1HB      CYS  70  -7.405  -0.786 -13.330
  509    HG   CYS  70            HG      CYS  70  -5.706  -1.870 -10.973
  510    H    SER  71             H      SER  71  -3.979  -1.373 -13.935
  511    HA   SER  71            HA      SER  71  -2.371  -3.633 -12.853
  512   1HB   SER  71           2HB      SER  71  -0.868  -3.477 -14.738
  513   2HB   SER  71           1HB      SER  71  -2.529  -3.828 -15.232
  514    HG   SER  71            HG      SER  71  -1.012  -1.499 -15.525
  515    H    VAL  72             H      VAL  72  -1.206  -2.842 -11.259
  516    HA   VAL  72            HA      VAL  72  -0.527  -0.192 -10.741
  517    HB   VAL  72            HB      VAL  72   1.245  -2.418  -9.941
  518   1HG1  VAL  72          2HG1      VAL  72   0.679   0.381  -9.124
  519   2HG1  VAL  72          1HG1      VAL  72   0.980  -0.785  -7.822
  520   3HG1  VAL  72          3HG1      VAL  72   2.203  -0.533  -9.067
  521   1HG2  VAL  72          2HG2      VAL  72  -1.507  -1.732  -9.066
  522   2HG2  VAL  72          1HG2      VAL  72  -0.775  -3.319  -9.278
  523   3HG2  VAL  72          3HG2      VAL  72  -0.353  -2.336  -7.880
  524    H    ILE  73             H      ILE  73   0.642   1.085 -11.773
  525    HA   ILE  73            HA      ILE  73   3.051   0.391 -13.049
  526    HB   ILE  73            HB      ILE  73   0.918   2.294 -13.828
  527   1HG1  ILE  73          2HG1      ILE  73   2.268   0.672 -15.884
  528   2HG1  ILE  73          1HG1      ILE  73   1.460  -0.283 -14.647
  529   1HG2  ILE  73          3HG2      ILE  73   3.789   2.603 -14.224
  530   2HG2  ILE  73          2HG2      ILE  73   2.881   2.650 -15.737
  531   3HG2  ILE  73          1HG2      ILE  73   2.503   3.791 -14.447
  532   1HD1  ILE  73          3HD1      ILE  73   0.153   1.889 -16.333
  533   2HD1  ILE  73          2HD1      ILE  73  -0.068   0.140 -16.577
  534   3HD1  ILE  73          1HD1      ILE  73  -0.660   0.929 -15.094
  535    NH1  ARG  74           NH2      ARG  74   6.738   5.117 -12.604
  536    NH2  ARG  74           NH1      ARG  74   7.986   3.405 -13.378
  537    H    ARG  74             H      ARG  74   3.626   0.736 -10.796
  538    HA   ARG  74            HA      ARG  74   5.226   1.852  -9.416
  539   1HB   ARG  74           2HB      ARG  74   4.744   3.935 -11.159
  540   2HB   ARG  74           1HB      ARG  74   4.053   4.558  -9.652
  541   1HG   ARG  74           2HG      ARG  74   6.434   5.159  -9.805
  542   2HG   ARG  74           1HG      ARG  74   6.188   4.011  -8.488
  543   1HD   ARG  74           2HD      ARG  74   7.802   2.744  -9.441
  544   2HD   ARG  74           1HD      ARG  74   6.644   2.388 -10.723
  545    HE   ARG  74            HE      ARG  74   8.910   4.245 -10.912
  546   1HH1  ARG  74          1HH2      ARG  74   6.427   5.688 -11.844
  547   2HH1  ARG  74          2HH2      ARG  74   6.396   5.283 -13.527
  548   1HH2  ARG  74          2HH1      ARG  74   8.629   2.659 -13.211
  549   2HH2  ARG  74          1HH1      ARG  74   7.653   3.582 -14.303
  550    H    ASP  75             H      ASP  75   4.627   1.207  -7.452
  551    HA   ASP  75            HA      ASP  75   2.054   2.122  -6.442
  552   1HB   ASP  75           2HB      ASP  75   1.836  -0.127  -6.203
  553   2HB   ASP  75           1HB      ASP  75   3.543  -0.361  -6.054
  554    H    SER  76             H      SER  76   2.060   3.893  -5.395
  555    HA   SER  76            HA      SER  76   4.092   4.230  -3.206
  556   1HB   SER  76           2HB      SER  76   3.912   5.919  -5.379
  557   2HB   SER  76           1HB      SER  76   2.834   6.695  -4.235
  558    HG   SER  76            HG      SER  76   5.573   6.078  -3.995
  559    H    LEU  77             H      LEU  77   0.942   3.510  -3.886
  560    HA   LEU  77            HA      LEU  77  -0.961   4.953  -2.478
  561   1HB   LEU  77           2HB      LEU  77  -1.119   2.731  -3.729
  562   2HB   LEU  77           1HB      LEU  77  -0.558   1.945  -2.276
  563    HG   LEU  77            HG      LEU  77  -2.559   3.419  -1.283
  564   1HD1  LEU  77          1HD1      LEU  77  -3.091   2.958  -4.183
  565   2HD1  LEU  77          3HD1      LEU  77  -4.436   2.889  -3.036
  566   3HD1  LEU  77          2HD1      LEU  77  -3.482   4.361  -3.182
  567   1HD2  LEU  77          1HD2      LEU  77  -2.314   0.653  -2.360
  568   2HD2  LEU  77          3HD2      LEU  77  -2.672   1.183  -0.709
  569   3HD2  LEU  77          2HD2      LEU  77  -3.941   1.201  -1.933
  570    H    LEU  78             H      LEU  78   1.648   3.069  -1.078
  571    HA   LEU  78            HA      LEU  78   0.528   3.645   1.534
  572   1HB   LEU  78           2HB      LEU  78   2.739   1.910   0.773
  573   2HB   LEU  78           1HB      LEU  78   2.162   2.061   2.395
  574    HG   LEU  78            HG      LEU  78   0.042   1.488   0.395
  575   1HD1  LEU  78          3HD1      LEU  78   2.127  -0.637   0.980
  576   2HD1  LEU  78          2HD1      LEU  78   0.556  -0.929   0.201
  577   3HD1  LEU  78          1HD1      LEU  78   1.779   0.080  -0.595
  578   1HD2  LEU  78          3HD2      LEU  78   0.562   1.103   3.198
  579   2HD2  LEU  78          2HD2      LEU  78  -0.955   0.887   2.324
  580   3HD2  LEU  78          1HD2      LEU  78   0.171  -0.464   2.482
  581    H    GLN  79             H      GLN  79   1.242   5.268   2.636
  582    HA   GLN  79            HA      GLN  79   2.455   7.413   1.801
  583   1HB   GLN  79           2HB      GLN  79   2.567   8.171   4.156
  584   2HB   GLN  79           1HB      GLN  79   1.023   7.416   3.766
  585   1HG   GLN  79           2HG      GLN  79   2.659   5.286   4.608
  586   2HG   GLN  79           1HG      GLN  79   3.024   6.602   5.725
  587   1HE2  GLN  79          2HE2      GLN  79  -0.327   6.711   7.061
  588   2HE2  GLN  79          1HE2      GLN  79   1.021   7.692   6.736
  589    H    ASP  80             H      ASP  80   4.156   6.623   0.739
  590    HA   ASP  80            HA      ASP  80   6.716   6.463   2.274
  591   1HB   ASP  80           2HB      ASP  80   6.220   4.743   0.390
  592   2HB   ASP  80           1HB      ASP  80   6.305   6.097  -0.731
  593    H    GLY  81             H      GLY  81   4.791   8.790   1.927
  594   1HA   GLY  81           2HA      GLY  81   5.156  11.119   1.724
  595   2HA   GLY  81           1HA      GLY  81   6.616  10.783   0.781
  596    H    GLU  82             H      GLU  82   3.567   9.069   0.119
  597    HA   GLU  82            HA      GLU  82   2.985  10.710  -2.208
  598   1HB   GLU  82           2HB      GLU  82   4.214   8.060  -2.181
  599   2HB   GLU  82           1HB      GLU  82   3.019   8.391  -3.381
  600   1HG   GLU  82           2HG      GLU  82   4.820   9.096  -4.565
  601   2HG   GLU  82           1HG      GLU  82   4.464  10.602  -3.697
  602    H    PHE  83             H      PHE  83   2.165   7.514  -0.846
  603    HA   PHE  83            HA      PHE  83   0.210   6.284  -0.986
  604   1HB   PHE  83           2HB      PHE  83  -1.920   7.798  -0.428
  605   2HB   PHE  83           1HB      PHE  83  -0.910   7.003   0.714
  606    HD1  PHE  83           HD1      PHE  83   0.801   8.265   1.988
  607    HD2  PHE  83           HD2      PHE  83  -1.905  10.189  -0.725
  608    HE1  PHE  83           HE1      PHE  83   1.374  10.473   2.990
  609    HE2  PHE  83           HE2      PHE  83  -1.344  12.396   0.271
  610    HZ   PHE  83            HZ      PHE  83   0.295  12.539   2.130
  611    H    SER  84             H      SER  84   0.979   6.930  -3.456
  612    HA   SER  84            HA      SER  84  -1.601   7.091  -4.946
  613   1HB   SER  84           2HB      SER  84  -0.669   8.692  -6.542
  614   2HB   SER  84           1HB      SER  84  -0.685   9.397  -4.931
  615    HG   SER  84            HG      SER  84   1.497   9.010  -4.766
  616    H    MET  85             H      MET  85  -1.646   5.662  -6.449
  617    HA   MET  85            HA      MET  85   0.828   4.219  -7.302
  618   1HB   MET  85            LYS  90  -0.665  -6.722 -17.770
  675    H    SER  91             H      SER  91  -3.391  -2.519 -21.909
  676    HA   SER  91            HA      SER  91  -5.667  -4.059 -23.051
  677   1HB   SER  91           2HB      SER  91  -5.973  -2.046 -24.150
  678   2HB   SER  91           1HB      SER  91  -4.329  -1.572 -23.968
  679    HG   SER  91            HG      SER  91  -3.853  -2.447 -25.826
  680    H    THR  92             H      THR  92  -5.052  -5.396 -24.922
  681    HA   THR  92            HA      THR  92  -2.319  -6.514 -24.475
  682    HB   THR  92            HB      THR  92  -3.310  -8.615 -25.442
  683    HG1  THR  92           HG1      THR  92  -5.565  -8.660 -25.616
  684   1HG2  THR  92          3HG2      THR  92  -4.434  -7.236 -23.006
  685   2HG2  THR  92          2HG2      THR  92  -4.890  -8.900 -23.415
  686   3HG2  THR  92          1HG2      THR  92  -3.200  -8.505 -23.090
  687    H    GLY  93             H      GLY  93  -4.405  -6.915 -27.385
  688   1HA   GLY  93           2HA      GLY  93  -2.100  -5.963 -29.015
  689   2HA   GLY  93           1HA      GLY  93  -3.260  -7.174 -29.563
  690    H    GLY  94             H      GLY  94  -2.628  -3.780 -29.189
  691   1HA   GLY  94           2HA      GLY  94  -3.704  -1.893 -30.075
  692   2HA   GLY  94           1HA      GLY  94  -4.531  -2.994 -31.174
  693    H    ALA  95             H      ALA  95  -4.902  -3.566 -27.745
  694    HA   ALA  95            HA      ALA  95  -7.805  -2.988 -27.926
  695   1HB   ALA  95           1HB      ALA  95  -6.262  -4.753 -26.390
  696   2HB   ALA  95           3HB      ALA  95  -6.794  -3.530 -25.228
  697   3HB   ALA  95           2HB      ALA  95  -7.984  -4.424 -26.191
  698    HA   PRO  96            HA      PRO  96  -7.670   0.922 -25.970
  699   1HB   PRO  96           2HB      PRO  96 -10.122   0.965 -24.817
  700   2HB   PRO  96           1HB      PRO  96  -9.903   0.962 -26.579
  701   1HG   PRO  96           2HG      PRO  96 -10.840  -1.268 -24.817
  702   2HG   PRO  96           1HG      PRO  96 -11.126  -1.012 -26.542
  703   1HD   PRO  96           2HD      PRO  96  -9.206  -2.756 -25.361
  704   2HD   PRO  96           1HD      PRO  96  -9.443  -2.393 -27.087
  705    H    THR  97             H      THR  97  -6.752   1.728 -24.107
  706    HA   THR  97            HA      THR  97  -6.949   0.093 -21.581
  707    HB   THR  97            HB      THR  97  -5.054   1.522 -20.790
  708    HG1  THR  97           HG1      THR  97  -5.156   3.396 -21.810
  709   1HG2  THR  97          1HG2      THR  97  -4.788  -0.585 -22.293
  710   2HG2  THR  97          3HG2      THR  97  -4.289   0.566 -23.533
  711   3HG2  THR  97          2HG2      THR  97  -3.386   0.452 -22.018
  712    H    PHE  98             H      PHE  98  -7.112   1.423 -19.623
  713    HA   PHE  98            HA      PHE  98  -8.461   4.036 -19.740
  714   1HB   PHE  98           2HB      PHE  98  -9.678   1.652 -18.281
  715   2HB   PHE  98           1HB      PHE  98 -10.346   3.279 -18.376
  716    HD1  PHE  98           HD1      PHE  98 -10.471   4.191 -20.946
  717    HD2  PHE  98           HD2      PHE  98 -10.658   0.072 -19.750
  718    HE1  PHE  98           HE1      PHE  98 -11.591   3.625 -23.082
  719    HE2  PHE  98           HE2      PHE  98 -11.777  -0.498 -21.902
  720    HZ   PHE  98            HZ      PHE  98 -12.245   1.283 -23.559
  721    H    ASN  99             H      ASN  99  -7.052   5.173 -18.372
  722    HA   ASN  99            HA      ASN  99  -5.669   3.501 -16.360
  723   1HB   ASN  99           2HB      ASN  99  -4.732   6.294 -16.937
  724   2HB   ASN  99           1HB      ASN  99  -3.793   4.871 -16.459
  725   1HD2  ASN  99          2HD2      ASN  99  -3.188   5.513 -20.113
  726   2HD2  ASN  99          1HD2      ASN  99  -2.978   6.425 -18.698
  727    H    VAL 100             H      VAL 100  -5.657   3.737 -14.347
  728    HA   VAL 100            HA      VAL 100  -7.376   5.751 -13.023
  729    HB   VAL 100            HB      VAL 100  -6.550   3.107 -11.786
  730   1HG1  VAL 100          2HG1      VAL 100  -8.851   4.965 -11.397
  731   2HG1  VAL 100          1HG1      VAL 100  -8.826   3.362 -10.727
  732   3HG1  VAL 100          3HG1      VAL 100  -7.611   4.530 -10.250
  733   1HG2  VAL 100          2HG2      VAL 100  -7.743   2.855 -14.149
  734   2HG2  VAL 100          1HG2      VAL 100  -8.214   1.839 -12.793
  735   3HG2  VAL 100          3HG2      VAL 100  -9.168   3.247 -13.213
  736    H    THR 101             H      THR 101  -6.659   6.098 -10.776
  737    HA   THR 101            HA      THR 101  -3.854   5.682 -10.112
  738    HB   THR 101            HB      THR 101  -5.203   8.386  -9.901
  739    HG1  THR 101           HG1      THR 101  -2.956   7.608 -11.439
  740   1HG2  THR 101          1HG2      THR 101  -3.241   7.229  -8.295
  741   2HG2  THR 101          3HG2      THR 101  -2.314   8.177  -9.457
  742   3HG2  THR 101          2HG2      THR 101  -3.547   8.950  -8.468
  743    H    VAL 102             H      VAL 102  -3.871   4.991  -7.976
  744    HA   VAL 102            HA      VAL 102  -6.357   5.519  -6.463
  745    HB   VAL 102            HB      VAL 102  -4.925   2.950  -7.065
  746   1HG1  VAL 102          2HG1      VAL 102  -6.167   3.675  -4.478
  747   2HG1  VAL 102          1HG1      VAL 102  -6.771   2.180  -5.187
  748   3HG1  VAL 102          3HG1      VAL 102  -5.045   2.361  -4.859
  749   1HG2  VAL 102          3HG2      VAL 102  -7.749   3.956  -7.105
  750   2HG2  VAL 102          2HG2      VAL 102  -6.752   3.438  -8.455
  751   3HG2  VAL 102          1HG2      VAL 102  -7.340   2.251  -7.301
  752    H    THR 103             H      THR 103  -6.011   6.492  -4.670
  753    HA   THR 103            HA      THR 103  -3.284   6.430  -3.447
  754    HB   THR 103            HB      THR 103  -4.079   8.568  -2.324
  755    HG1  THR 103           HG1      THR 103  -6.011   9.277  -2.779
  756   1HG2  THR 103          3HG2      THR 103  -3.254   8.096  -5.054
  757   2HG2  THR 103          2HG2      THR 103  -4.249   9.528  -4.961
  758   3HG2  THR 103          1HG2      THR 103  -2.796   9.407  -3.967
  759    H    LYS 104             H      LYS 104  -3.201   6.403  -1.041
  760    HA   LYS 104            HA      LYS 104  -5.705   5.482   0.313
  761   1HB   LYS 104           2HB      LYS 104  -4.502   3.417  -0.391
  762   2HB   LYS 104           1HB      LYS 104  -3.083   3.968   0.495
  763   1HG   LYS 104           2HG      LYS 104  -3.919   2.917   2.319
  764   2HG   LYS 104           1HG      LYS 104  -5.167   4.145   2.363
  765   1HD   LYS 104           2HD      LYS 104  -6.319   2.073   2.346
  766   2HD   LYS 104           1HD      LYS 104  -6.466   2.715   0.717
  767   1HE   LYS 104           2HE      LYS 104  -5.835   0.274   0.851
  768   2HE   LYS 104           1HE      LYS 104  -4.752   1.261  -0.108
  769   1HZ   LYS 104           2HZ      LYS 104  -4.178   0.926   2.744
  770   2HZ   LYS 104           1HZ      LYS 104  -3.855  -0.378   1.705
  771   3HZ   LYS 104           3HZ      LYS 104  -3.108   1.118   1.439
  772    H    THR 105             H      THR 105  -5.825   6.002   2.432
  773    HA   THR 105            HA      THR 105  -3.622   7.694   3.539
  774    HB   THR 105            HB      THR 105  -5.332   8.620   5.021
  775    HG1  THR 105           HG1      THR 105  -7.415   7.831   4.977
  776   1HG2  THR 105          2HG2      THR 105  -5.281   8.941   2.255
  777   2HG2  THR 105          1HG2      THR 105  -6.985   8.688   2.614
  778   3HG2  THR 105          3HG2      THR 105  -6.107   9.992   3.403
  779    H    ASP 106             H      ASP 106  -4.874   7.180   6.314
  780    HA   ASP 106            HA      ASP 106  -3.484   4.616   6.797
  781   1HB   ASP 106           2HB      ASP 106  -3.058   6.741   8.154
  782   2HB   ASP 106           1HB      ASP 106  -4.634   6.455   8.888
  783    H    LYS 107             H      LYS 107  -6.702   5.914   6.506
  784    HA   LYS 107            HA      LYS 107  -7.817   3.290   7.340
  785   1HB   LYS 107           2HB      LYS 107  -9.048   5.883   8.321
  786   2HB   LYS 107           1HB      LYS 107  -9.449   4.249   8.817
  787   1HG   LYS 107           2HG      LYS 107  -6.938   4.138   9.550
  788   2HG   LYS 107           1HG      LYS 107  -7.057   5.892   9.537
  789   1HD   LYS 107           2HD      LYS 107  -9.144   5.628  10.995
  790   2HD   LYS 107           1HD      LYS 107  -8.670   3.939  11.192
  791   1HE   LYS 107           2HE      LYS 107  -6.449   4.698  12.047
  792   2HE   LYS 107           1HE      LYS 107  -7.005   6.366  11.934
  793   1HZ   LYS 107           3HZ      LYS 107  -8.802   5.822  13.466
  794   2HZ   LYS 107           2HZ      LYS 107  -8.232   4.228  13.594
  795   3HZ   LYS 107           1HZ      LYS 107  -7.289   5.521  14.165
  796    H    THR 108             H      THR 108  -7.556   5.145   4.748
  797    HA   THR 108            HA      THR 108 -10.330   4.594   3.824
  798    HB   THR 108            HB      THR 108 -10.647   6.778   2.919
  799    HG1  THR 108           HG1      THR 108  -8.574   7.186   2.188
  800   1HG2  THR 108          2HG2      THR 108 -10.719   6.362   5.536
  801   2HG2  THR 108          1HG2      THR 108  -9.331   7.462   5.543
  802   3HG2  THR 108          3HG2      THR 108 -10.885   8.008   4.901
  803    H    LEU 109             H      LEU 109 -10.367   4.698   1.383
  804    HA   LEU 109            HA      LEU 109  -7.773   4.115   0.053
  805   1HB   LEU 109           2HB      LEU 109  -9.425   2.162   0.871
  806   2HB   LEU 109           1HB      LEU 109 -10.180   2.488  -0.664
  807    HG   LEU 109            HG      LEU 109  -7.588   1.157  -0.077
  808   1HD1  LEU 109          2HD1      LEU 109  -9.772   0.241  -1.022
  809   2HD1  LEU 109          1HD1      LEU 109  -9.336   1.043  -2.520
  810   3HD1  LEU 109          3HD1      LEU 109  -8.293  -0.212  -1.858
  811   1HD2  LEU 109          3HD2      LEU 109  -7.981   3.044  -2.373
  812   2HD2  LEU 109          2HD2      LEU 109  -6.691   3.065  -1.184
  813   3HD2  LEU 109          1HD2      LEU 109  -6.785   1.762  -2.363
  814    H    VAL 110             H      VAL 110  -7.994   6.236  -1.154
  815    HA   VAL 110            HA      VAL 110 -10.499   6.739  -2.557
  816    HB   VAL 110            HB      VAL 110  -7.854   8.233  -2.346
  817   1HG1  VAL 110          1HG1      VAL 110 -10.221   8.748  -4.129
  818   2HG1  VAL 110          3HG1      VAL 110  -9.259  10.094  -3.521
  819   3HG1  VAL 110          2HG1      VAL 110  -8.504   8.847  -4.508
  820   1HG2  VAL 110          2HG2      VAL 110 -10.197   8.173  -0.741
  821   2HG2  VAL 110          1HG2      VAL 110  -8.853   9.323  -0.613
  822   3HG2  VAL 110          3HG2      VAL 110 -10.267   9.707  -1.618
  823    H    LEU 111             H      LEU 111 -10.732   6.734  -4.837
  824    HA   LEU 111            HA      LEU 111  -8.497   5.655  -6.418
  825   1HB   LEU 111           2HB      LEU 111 -11.328   4.821  -7.083
  826   2HB   LEU 111           1HB      LEU 111  -9.813   4.052  -7.549
  827    HG   LEU 111            HG      LEU 111 -10.831   4.140  -4.738
  828   1HD1  LEU 111          1HD1      LEU 111 -11.063   1.955  -6.802
  829   2HD1  LEU 111          3HD1      LEU 111 -11.414   1.739  -5.085
  830   3HD1  LEU 111          2HD1      LEU 111 -12.397   2.837  -6.051
  831   1HD2  LEU 111          3HD2      LEU 111  -8.363   3.776  -5.229
  832   2HD2  LEU 111          2HD2      LEU 111  -9.158   2.606  -4.191
  833   3HD2  LEU 111          1HD2      LEU 111  -8.859   2.212  -5.887
  834    H    LEU 112             H      LEU 112  -8.576   6.370  -8.532
  835    HA   LEU 112            HA      LEU 112 -10.445   8.609  -9.263
  836   1HB   LEU 112           2HB      LEU 112  -8.054   9.180  -8.320
  837   2HB   LEU 112           1HB      LEU 112  -7.481   8.606  -9.847
  838    HG   LEU 112            HG      LEU 112  -7.671  10.756 -10.504
  839   1HD1  LEU 112          1HD1      LEU 112 -10.657  10.122 -10.470
  840   2HD1  LEU 112          3HD1      LEU 112  -9.918  11.499 -11.314
  841   3HD1  LEU 112          2HD1      LEU 112  -9.528   9.856 -11.818
  842   1HD2  LEU 112          1HD2      LEU 112  -7.899  11.411  -8.156
  843   2HD2  LEU 112          3HD2      LEU 112  -8.842  12.457  -9.220
  844   3HD2  LEU 112          2HD2      LEU 112  -9.644  11.201  -8.273
  845    H    MET 113             H      MET 113 -11.432   7.401 -10.965
  846    HA   MET 113            HA      MET 113  -9.539   5.900 -12.797
  847   1HB   MET 113           2HB      MET 113 -11.613   4.812 -11.864
  848   2HB   MET 113           1HB      MET 113 -12.488   5.785 -13.005
  849   1HG   MET 113           2HG      MET 113 -10.299   4.555 -14.363
  850   2HG   MET 113           1HG      MET 113 -11.190   3.323 -13.493
  851   1HE   MET 113           3HE      MET 113 -12.073   2.059 -14.725
  852   2HE   MET 113           2HE      MET 113 -13.799   2.339 -14.925
  853   3HE   MET 113           1HE      MET 113 -12.755   2.292 -16.342
  854    H    GLY 114             H      GLY 114  -9.397   6.150 -14.914
  855   1HA   GLY 114           2HA      GLY 114 -10.883   8.319 -16.174
  856   2HA   GLY 114           1HA      GLY 114  -9.138   8.400 -16.187
  857    H    LYS 115             H      LYS 115 -11.216   8.016 -18.273
  858    HA   LYS 115            HA      LYS 115 -10.230   5.621 -19.626
  859   1HB   LYS 115           2HB      LYS 115 -12.906   7.006 -19.731
  860   2HB   LYS 115           1HB      LYS 115 -12.316   6.068 -21.110
  861   1HG   LYS 115           2HG      LYS 115 -11.814   4.275 -19.209
  862   2HG   LYS 115           1HG      LYS 115 -13.110   5.117 -18.400
  863   1HD   LYS 115           2HD      LYS 115 -14.570   4.767 -20.383
  864   2HD   LYS 115           1HD      LYS 115 -13.267   3.875 -21.153
  865   1HE   LYS 115           2HE      LYS 115 -13.275   2.225 -19.344
  866   2HE   LYS 115           1HE      LYS 115 -14.536   3.129 -18.508
  867   1HZ   LYS 115           2HZ      LYS 115 -14.930   2.188 -21.276
  868   2HZ   LYS 115           1HZ      LYS 115 -15.210   1.152 -19.959
  869   3HZ   LYS 115           3HZ      LYS 115 -16.097   2.589 -20.110
  870    H    GLU 116             H      GLU 116 -10.128   6.030 -22.006
  871    HA   GLU 116            HA      GLU 116  -8.223   7.372 -23.112
  872   1HB   GLU 116           2HB      GLU 116 -10.004   6.369 -24.045
  873   2HB   GLU 116           1HB      GLU 116 -10.903   7.816 -23.990
  874   1HG   GLU 116           2HG      GLU 116  -9.632   8.824 -25.678
  875   2HG   GLU 116           1HG      GLU 116  -8.230   7.815 -25.326
  876    H    GLY 117             H      GLY 117  -7.466   9.161 -23.977
  877   1HA   GLY 117           2HA      GLY 117  -6.976  11.475 -24.120
  878   2HA   GLY 117           1HA      GLY 117  -8.571  11.829 -23.392
  879    H    VAL 118             H      VAL 118  -7.073   9.099 -22.020
  880    HA   VAL 118            HA      VAL 118  -6.584  10.448 -19.525
  881    HB   VAL 118            HB      VAL 118  -8.289   8.591 -20.196
  882   1HG1  VAL 118          2HG1      VAL 118  -6.628   7.007 -21.044
  883   2HG1  VAL 118          1HG1      VAL 118  -6.058   6.789 -19.389
  884   3HG1  VAL 118          3HG1      VAL 118  -7.743   6.385 -19.791
  885   1HG2  VAL 118          1HG2      VAL 118  -6.787   9.172 -17.713
  886   2HG2  VAL 118          3HG2      VAL 118  -8.519   8.976 -17.956
  887   3HG2  VAL 118          2HG2      VAL 118  -7.511   7.547 -17.690
  888    H    HIS 119             H      HIS 119  -4.505  11.024 -19.332
  889    HA   HIS 119            HA      HIS 119  -2.314   9.355 -20.377
  890   1HB   HIS 119           2HB      HIS 119  -2.150  11.847 -20.417
  891   2HB   HIS 119           1HB      HIS 119  -2.217  11.860 -18.655
  892    HD1  HIS 119           HD1      HIS 119  -0.270   9.423 -20.812
  893    HD2  HIS 119           HD2      HIS 119   0.438  12.475 -18.062
  894    HE1  HIS 119           HE1      HIS 119   2.223   9.419 -20.367
  895    H    GLY 120             H      GLY 120  -3.791  10.284 -17.315
  896   1HA   GLY 120           2HA      GLY 120  -3.957   8.845 -15.405
  897   2HA   GLY 120           1HA      GLY 120  -2.588   7.913 -16.019
  898    H    GLY 121             H      GLY 121  -1.789  11.183 -16.335
  899   1HA   GLY 121           2HA      GLY 121  -0.141  11.099 -13.848
  900   2HA   GLY 121           1HA      GLY 121   0.187  12.119 -15.250
  901    H    LEU 122             H      LEU 122  -2.604  12.944 -15.525
  902    HA   LEU 122            HA      LEU 122  -2.665  15.196 -13.633
  903   1HB   LEU 122           2HB      LEU 122  -5.010  14.438 -15.374
  904   2HB   LEU 122           1HB      LEU 122  -4.470  16.042 -14.896
  905    HG   LEU 122            HG      LEU 122  -2.546  14.529 -16.567
  906   1HD1  LEU 122          2HD1      LEU 122  -5.035  14.107 -17.364
  907   2HD1  LEU 122          1HD1      LEU 122  -4.844  15.742 -18.014
  908   3HD1  LEU 122          3HD1      LEU 122  -3.747  14.458 -18.525
  909   1HD2  LEU 122          2HD2      LEU 122  -2.640  17.038 -15.714
  910   2HD2  LEU 122          1HD2      LEU 122  -1.990  16.650 -17.310
  911   3HD2  LEU 122          3HD2      LEU 122  -3.645  17.240 -17.153
  912    H    ILE 123             H      ILE 123  -4.359  12.200 -14.278
  913    HA   ILE 123            HA      ILE 123  -6.347  12.404 -12.202
  914    HB   ILE 123            HB      ILE 123  -4.975  10.096 -13.607
  915   1HG1  ILE 123          2HG1      ILE 123  -7.823  11.132 -14.053
  916   2HG1  ILE 123          1HG1      ILE 123  -6.436  11.659 -15.027
  917   1HG2  ILE 123          3HG2      ILE 123  -6.226   9.677 -11.277
  918   2HG2  ILE 123          2HG2      ILE 123  -7.630   9.689 -12.330
  919   3HG2  ILE 123          1HG2      ILE 123  -6.337   8.532 -12.607
  920   1HD1  ILE 123          3HD1      ILE 123  -7.156   8.749 -14.622
  921   2HD1  ILE 123          2HD1      ILE 123  -7.736   9.713 -15.966
  922   3HD1  ILE 123          1HD1      ILE 123  -6.013   9.423 -15.781
  923    H    ASN 124             H      ASN 124  -3.003  11.231 -12.449
  924    HA   ASN 124            HA      ASN 124  -2.786  10.173  -9.806
  925   1HB   ASN 124           2HB      ASN 124  -1.192   9.703 -11.700
  926   2HB   ASN 124           1HB      ASN 124  -0.559  11.329 -11.457
  927   1HD2  ASN 124          2HD2      ASN 124   1.021   8.477  -9.253
  928   2HD2  ASN 124          1HD2      ASN 124   0.322   8.290 -10.791
  929    H    LYS 125             H      LYS 125  -2.652  13.339 -11.168
  930    HA   LYS 125            HA      LYS 125  -1.457  14.585  -8.719
  931   1HB   LYS 125           2HB      LYS 125  -2.663  15.686 -11.308
  932   2HB   LYS 125           1HB      LYS 125  -2.087  16.727  -9.995
  933   1HG   LYS 125           2HG      LYS 125  -0.283  14.576 -11.045
  934   2HG   LYS 125           1HG      LYS 125  -0.478  16.062 -11.983
  935   1HD   LYS 125           2HD      LYS 125   0.048  17.352  -9.870
  936   2HD   LYS 125           1HD      LYS 125   0.464  15.815  -9.111
  937   1HE   LYS 125           2HE      LYS 125   2.387  15.573 -10.330
  938   2HE   LYS 125           1HE      LYS 125   1.712  16.359 -11.752
  939   1HZ   LYS 125           2HZ      LYS 125   1.836  18.301  -9.765
  940   2HZ   LYS 125           1HZ      LYS 125   3.316  17.468  -9.706
  941   3HZ   LYS 125           3HZ      LYS 125   2.804  18.177 -11.158
  942    H    LYS 126             H      LYS 126  -4.651  13.904 -10.086
  943    HA   LYS 126            HA      LYS 126  -6.032  15.673  -8.176
  944   1HB   LYS 126           2HB      LYS 126  -6.923  13.919 -10.464
  945   2HB   LYS 126           1HB      LYS 126  -8.074  14.726  -9.395
  946   1HG   LYS 126           2HG      LYS 126  -6.982  16.906  -9.901
  947   2HG   LYS 126           1HG      LYS 126  -5.898  16.078 -11.016
  948   1HD   LYS 126           2HD      LYS 126  -8.883  15.853 -11.303
  949   2HD   LYS 126           1HD      LYS 126  -8.000  17.208 -12.001
  950   1HE   LYS 126           2HE      LYS 126  -7.105  14.370 -12.516
  951   2HE   LYS 126           1HE      LYS 126  -8.375  15.106 -13.495
  952   1HZ   LYS 126           2HZ      LYS 126  -6.716  17.038 -13.704
  953   2HZ   LYS 126           1HZ      LYS 126  -5.555  15.890 -13.240
  954   3HZ   LYS 126           3HZ      LYS 126  -6.475  15.643 -14.639
  955    H    CYS 127             H      CYS 127  -4.942  12.451  -8.238
  956    HA   CYS 127            HA      CYS 127  -6.970  11.447  -6.341
  957   1HB   CYS 127           2HB      CYS 127  -5.815  10.051  -8.250
  958   2HB   CYS 127           1HB      CYS 127  -4.481   9.961  -7.120
  959    HG   CYS 127            HG      CYS 127  -5.795   8.022  -6.253
  960    OH   TYR 128            OH      TYR 128   2.469  14.716  -1.860
  961    H    TYR 128             H      TYR 128  -3.596  12.293  -6.691
  962    HA   TYR 128            HA      TYR 128  -2.707  11.655  -4.055
  963   1HB   TYR 128           2HB      TYR 128  -1.174  11.994  -5.933
  964   2HB   TYR 128           1HB      TYR 128  -1.746  13.643  -6.153
  965    HD1  TYR 128           HD1      TYR 128  -0.912  11.860  -2.960
  966    HD2  TYR 128           HD2      TYR 128   0.118  14.940  -5.785
  967    HE1  TYR 128           HE1      TYR 128   0.845  12.666  -1.418
  968    HE2  TYR 128           HE2      TYR 128   1.889  15.754  -4.226
  969    HH   TYR 128            HH      TYR 128   2.119  14.697  -0.968
  970    H    GLU 129             H      GLU 129  -4.187  14.527  -5.570
  971    HA   GLU 129            HA      GLU 129  -3.953  16.195  -3.147
  972   1HB   GLU 129           2HB      GLU 129  -5.291  16.447  -5.819
  973   2HB   GLU 129           1HB      GLU 129  -5.784  17.515  -4.506
  974   1HG   GLU 129           2HG      GLU 129  -2.875  17.139  -5.213
  975   2HG   GLU 129           1HG      GLU 129  -3.873  18.339  -6.034
  976    H    MET 130             H      MET 130  -6.408  14.075  -4.597
  977    HA   MET 130            HA      MET 130  -8.584  14.824  -2.892
  978   1HB   MET 130           2HB      MET 130  -8.412  13.187  -5.006
  979   2HB   MET 130           1HB      MET 130  -8.320  11.981  -3.736
  980   1HG   MET 130           2HG      MET 130 -10.658  12.303  -4.349
  981   2HG   MET 130           1HG      MET 130 -10.387  12.928  -2.722
  982   1HE   MET 130           3HE      MET 130  -9.424  14.244  -6.227
  983   2HE   MET 130           2HE      MET 130 -11.107  13.844  -6.502
  984   3HE   MET 130           1HE      MET 130 -10.591  15.525  -6.539
  985    H    ALA 131             H      ALA 131  -5.911  12.569  -2.499
  986    HA   ALA 131            HA      ALA 131  -6.846  11.533   0.081
  987   1HB   ALA 131           3HB      ALA 131  -4.317  11.250  -1.548
  988   2HB   ALA 131           2HB      ALA 131  -4.324  10.798   0.162
  989   3HB   ALA 131           1HB      ALA 131  -5.420   9.998  -0.963
  990    H    SER 132             H      SER 132  -5.020  14.304  -1.094
  991    HA   SER 132            HA      SER 132  -3.676  14.940   1.356
  992   1HB   SER 132           2HB      SER 132  -4.697  16.726  -0.871
  993   2HB   SER 132           1HB      SER 132  -3.844  17.355   0.526
  994    HG   SER 132            HG      SER 132  -2.516  16.829  -1.346
  995    H    HIS 133             H      HIS 133  -7.065  15.171   0.250
  996    HA   HIS 133            HA      HIS 133  -7.870  16.798   2.580
  997   1HB   HIS 133           2HB      HIS 133  -9.239  16.594   0.374
  998   2HB   HIS 133           1HB      HIS 133  -9.904  15.094   1.098
  999    HD1  HIS 133           HD1      HIS 133 -11.375  15.342   3.177
 1000    HD2  HIS 133           HD2      HIS 133  -9.863  18.999   1.853
 1001    HE1  HIS 133           HE1      HIS 133 -12.517  17.132   4.566
 1002    H    LEU 134             H      LEU 134  -7.921  13.363   1.634
 1003    HA   LEU 134            HA      LEU 134  -9.196  12.468   4.048
 1004   1HB   LEU 134           2HB      LEU 134  -7.522  11.139   1.935
 1005   2HB   LEU 134           1HB      LEU 134  -8.118  10.256   3.328
 1006    HG   LEU 134            HG      LEU 134 -10.358  11.504   2.619
 1007   1HD1  LEU 134          3HD1      LEU 134  -8.735  11.281   0.151
 1008   2HD1  LEU 134          2HD1      LEU 134 -10.486  11.184   0.086
 1009   3HD1  LEU 134          1HD1      LEU 134  -9.702  12.629   0.713
 1010   1HD2  LEU 134          3HD2      LEU 134  -9.259   8.927   1.558
 1011   2HD2  LEU 134          2HD2      LEU 134 -10.300   9.143   2.961
 1012   3HD2  LEU 134          1HD2      LEU 134 -10.940   9.399   1.337
 1013    NH1  ARG 135           NH2      ARG 135  -0.139  13.019   7.413
 1014    NH2  ARG 135           NH1      ARG 135   1.393  12.664   5.790
 1015    H    ARG 135             H      ARG 135  -6.107  13.668   3.524
 1016    HA   ARG 135            HA      ARG 135  -4.913  12.344   5.887
 1017   1HB   ARG 135           2HB      ARG 135  -3.897  14.173   3.724
 1018   2HB   ARG 135           1HB      ARG 135  -3.067  14.182   5.278
 1019   1HG   ARG 135           2HG      ARG 135  -3.666  11.504   4.134
 1020   2HG   ARG 135           1HG      ARG 135  -2.442  12.452   3.291
 1021   1HD   ARG 135           2HD      ARG 135  -2.399  12.021   6.285
 1022   2HD   ARG 135           1HD      ARG 135  -1.565  10.953   5.154
 1023    HE   ARG 135            HE      ARG 135  -0.750  13.585   4.533
 1024   1HH1  ARG 135          1HH2      ARG 135  -1.086  13.176   7.691
 1025   2HH1  ARG 135          2HH2      ARG 135   0.583  12.974   8.102
 1026   1HH2  ARG 135          2HH1      ARG 135   1.617  12.544   4.824
 1027   2HH2  ARG 135          1HH1      ARG 135   2.118  12.633   6.479
 1028    NH1  ARG 136           NH2      ARG 136  -6.626  19.160   2.266
 1029    NH2  ARG 136           NH1      ARG 136  -6.219  21.376   2.105
 1030    H    ARG 136             H      ARG 136  -6.175  15.419   4.718
 1031    HA   ARG 136            HA      ARG 136  -5.854  16.749   7.300
 1032   1HB   ARG 136           2HB      ARG 136  -7.280  17.502   4.743
 1033   2HB   ARG 136           1HB      ARG 136  -7.218  18.547   6.165
 1034   1HG   ARG 136           2HG      ARG 136  -4.597  18.064   5.954
 1035   2HG   ARG 136           1HG      ARG 136  -5.030  17.798   4.264
 1036   1HD   ARG 136           2HD      ARG 136  -6.371  20.172   5.162
 1037   2HD   ARG 136           1HD      ARG 136  -4.670  20.290   5.616
 1038    HE   ARG 136            HE      ARG 136  -4.077  20.233   3.287
 1039   1HH1  ARG 136          1HH2      ARG 136  -6.427  18.270   2.676
 1040   2HH1  ARG 136          2HH2      ARG 136  -7.337  19.241   1.570
 1041   1HH2  ARG 136          1HH1      ARG 136  -6.941  21.458   1.417
 1042   2HH2  ARG 136          2HH1      ARG 136  -5.705  22.184   2.389
 1043    H    SER 137             H      SER 137  -7.868  14.372   6.132
 1044    HA   SER 137            HA      SER 137 -10.372  15.231   7.349
 1045   1HB   SER 137           2HB      SER 137 -11.270  13.242   6.366
 1046   2HB   SER 137           1HB      SER 137 -10.093  13.788   5.199
 1047    HG   SER 137            HG      SER 137  -9.916  11.545   5.670
 1048    H    GLN 138             H      GLN 138  -7.426  13.648   8.332
 1049    HA   GLN 138            HA      GLN 138  -6.804  12.901  10.499
 1050   1HB   GLN 138           2HB      GLN 138  -9.226  14.215  11.077
 1051   2HB   GLN 138           1HB      GLN 138  -9.454  12.591  11.727
 1052   1HG   GLN 138           2HG      GLN 138  -7.883  12.883  13.356
 1053   2HG   GLN 138           1HG      GLN 138  -6.810  13.795  12.294
 1054   1HE2  GLN 138          2HE2      GLN 138  -9.883  15.966  13.985
 1055   2HE2  GLN 138          1HE2      GLN 138 -10.202  14.399  13.411
 1056    OH   TYR 139            OH      TYR 139 -14.131  10.385  10.591
 1057    H    TYR 139             H      TYR 139  -7.669  11.308   8.167
 1058    HA   TYR 139            HA      TYR 139  -8.305   8.746   9.581
 1059   1HB   TYR 139           2HB      TYR 139  -9.299   9.708   6.881
 1060   2HB   TYR 139           1HB      TYR 139  -9.436   8.036   7.432
 1061    HD1  TYR 139           HD2      TYR 139 -10.276   8.010  10.097
 1062    HD2  TYR 139           HD1      TYR 139 -11.273  10.904   7.079
 1063    HE1  TYR 139           HE2      TYR 139 -12.349   8.583  11.331
 1064    HE2  TYR 139           HE1      TYR 139 -13.347  11.476   8.315
 1065    HH   TYR 139            HH      TYR 139 -13.979  11.212  11.056
   
  Start of MODEL          19
 Raw file had 1065 H/Q atoms
  Start of MODEL   19
    1   1H    ALA   1            1H      ALA   1 -20.430  17.745  -1.058
    2   2H    ALA   1            3H      ALA   1 -21.837  18.689  -1.114
    3   3H    ALA   1            2H      ALA   1 -20.314  19.429  -1.251
    4    HA   ALA   1            HA      ALA   1 -20.881  19.876   0.927
    5   1HB   ALA   1           3HB      ALA   1 -21.930  17.029   0.995
    6   2HB   ALA   1           2HB      ALA   1 -21.857  18.092   2.400
    7   3HB   ALA   1           1HB      ALA   1 -22.891  18.507   1.033
    8    H    GLY   2             H      GLY   2 -19.753  16.499   0.348
    9   1HA   GLY   2           2HA      GLY   2 -17.083  17.192   1.431
   10   2HA   GLY   2           1HA      GLY   2 -17.982  15.974   2.335
   11    CH2  TRP   3           CH2      TRP   3 -13.346  11.238   3.503
   12    H    TRP   3             H      TRP   3 -18.067  13.879   1.529
   13    HA   TRP   3            HA      TRP   3 -16.177  12.781  -0.154
   14   1HB   TRP   3           2HB      TRP   3 -18.788  11.948   0.729
   15   2HB   TRP   3           1HB      TRP   3 -18.065  11.023  -0.550
   16    HD1  TRP   3           HD1      TRP   3 -18.298   9.240   1.551
   17    HE1  TRP   3           HE1      TRP   3 -16.506   8.466   3.219
   18    HE3  TRP   3           HE3      TRP   3 -14.990  13.156   1.246
   19    HZ2  TRP   3           HZ2      TRP   3 -14.024   9.347   4.254
   20    HZ3  TRP   3           HZ3      TRP   3 -12.928  13.128   2.578
   21    HH2  TRP   3           HH2      TRP   3 -12.437  11.234   4.088
   22    H    ASN   4             H      ASN   4 -19.463  13.766  -1.100
   23    HA   ASN   4            HA      ASN   4 -19.294  12.900  -3.817
   24   1HB   ASN   4           2HB      ASN   4 -21.015  15.188  -2.836
   25   2HB   ASN   4           1HB      ASN   4 -21.324  14.122  -4.206
   26   1HD2  ASN   4          2HD2      ASN   4 -22.521  13.006  -0.533
   27   2HD2  ASN   4          1HD2      ASN   4 -21.894  14.549  -0.857
   28    H    ALA   5             H      ALA   5 -17.982  15.702  -2.354
   29    HA   ALA   5            HA      ALA   5 -17.716  17.308  -4.821
   30   1HB   ALA   5           3HB      ALA   5 -16.977  17.650  -1.930
   31   2HB   ALA   5           2HB      ALA   5 -16.009  18.532  -3.115
   32   3HB   ALA   5           1HB      ALA   5 -17.752  18.786  -3.035
   33    OH   TYR   6            OH      TYR   6 -14.312  17.629   1.494
   34    H    TYR   6             H      TYR   6 -15.703  15.152  -2.771
   35    HA   TYR   6            HA      TYR   6 -13.318  15.569  -4.477
   36   1HB   TYR   6           2HB      TYR   6 -13.693  13.184  -2.654
   37   2HB   TYR   6           1HB      TYR   6 -12.212  14.071  -3.044
   38    HD1  TYR   6           HD1      TYR   6 -12.576  16.764  -2.612
   39    HD2  TYR   6           HD2      TYR   6 -14.442  13.565  -0.548
   40    HE1  TYR   6           HE1      TYR   6 -13.052  18.297  -0.728
   41    HE2  TYR   6           HE2      TYR   6 -14.924  15.079   1.381
   42    HH   TYR   6            HH      TYR   6 -14.798  18.377   1.142
   43    H    ILE   7             H      ILE   7 -16.258  13.983  -4.736
   44    HA   ILE   7            HA      ILE   7 -15.391  12.035  -6.768
   45    HB   ILE   7            HB      ILE   7 -18.022  12.730  -5.474
   46   1HG1  ILE   7          2HG1      ILE   7 -16.376  11.170  -4.403
   47   2HG1  ILE   7          1HG1      ILE   7 -17.956  10.475  -4.687
   48   1HG2  ILE   7          2HG2      ILE   7 -17.573  11.434  -8.084
   49   2HG2  ILE   7          1HG2      ILE   7 -18.719  10.630  -7.014
   50   3HG2  ILE   7          3HG2      ILE   7 -18.984  12.305  -7.504
   51   1HD1  ILE   7          1HD1      ILE   7 -16.237  10.085  -6.970
   52   2HD1  ILE   7          3HD1      ILE   7 -15.491   9.441  -5.513
   53   3HD1  ILE   7          2HD1      ILE   7 -17.087   8.888  -6.007
   54    H    ASP   8             H      ASP   8 -16.892  15.200  -6.289
   55    HA   ASP   8            HA      ASP   8 -17.799  15.833  -8.834
   56   1HB   ASP   8           2HB      ASP   8 -16.938  17.406  -6.537
   57   2HB   ASP   8           1HB      ASP   8 -17.044  18.248  -8.015
   58    H    ASN   9             H      ASN   9 -14.641  15.499  -7.563
   59    HA   ASN   9            HA      ASN   9 -12.926  16.774  -9.291
   60   1HB   ASN   9           2HB      ASN   9 -11.763  15.593  -7.702
   61   2HB   ASN   9           1HB      ASN   9 -12.989  14.442  -7.548
   62   1HD2  ASN   9          2HD2      ASN   9 -11.203  11.800  -9.339
   63   2HD2  ASN   9          1HD2      ASN   9 -12.453  12.212  -8.233
   64    H    LEU  10             H      LEU  10 -14.035  13.579  -9.558
   65    HA   LEU  10            HA      LEU  10 -13.292  12.693 -12.031
   66   1HB   LEU  10           2HB      LEU  10 -15.968  12.503 -10.857
   67   2HB   LEU  10           1HB      LEU  10 -15.339  11.448 -12.119
   68    HG   LEU  10            HG      LEU  10 -13.759  11.799  -9.666
   69   1HD1  LEU  10          1HD1      LEU  10 -16.524  10.962  -9.704
   70   2HD1  LEU  10          3HD1      LEU  10 -15.475   9.700  -9.152
   71   3HD1  LEU  10          2HD1      LEU  10 -15.443  11.215  -8.352
   72   1HD2  LEU  10          3HD2      LEU  10 -13.193  10.531 -11.829
   73   2HD2  LEU  10          2HD2      LEU  10 -12.924   9.704 -10.299
   74   3HD2  LEU  10          1HD2      LEU  10 -14.358   9.356 -11.263
   75    H    MET  11             H      MET  11 -15.874  14.691 -11.197
   76    HA   MET  11            HA      MET  11 -16.937  14.651 -13.904
   77   1HB   MET  11           2HB      MET  11 -17.866  16.303 -11.533
   78   2HB   MET  11           1HB      MET  11 -18.836  15.636 -12.850
   79   1HG   MET  11           2HG      MET  11 -17.517  13.289 -11.609
   80   2HG   MET  11           1HG      MET  11 -18.130  14.281 -10.265
   81   1HE   MET  11           2HE      MET  11 -18.410  12.159 -13.009
   82   2HE   MET  11           1HE      MET  11 -20.019  11.435 -12.949
   83   3HE   MET  11           3HE      MET  11 -19.716  12.846 -13.977
   84    H    ALA  12             H      ALA  12 -14.969  16.835 -12.021
   85    HA   ALA  12            HA      ALA  12 -15.119  19.111 -13.774
   86   1HB   ALA  12           3HB      ALA  12 -13.653  18.471 -11.251
   87   2HB   ALA  12           2HB      ALA  12 -13.160  19.868 -12.221
   88   3HB   ALA  12           1HB      ALA  12 -14.799  19.783 -11.573
   89    H    ASP  13             H      ASP  13 -12.813  16.516 -13.364
   90    HA   ASP  13            HA      ASP  13 -10.898  17.809 -15.097
   91   1HB   ASP  13           2HB      ASP  13  -9.556  15.618 -14.266
   92   2HB   ASP  13           1HB      ASP  13  -9.469  17.223 -13.573
   93    H    GLY  14             H      GLY  14 -13.202  16.259 -16.392
   94   1HA   GLY  14           2HA      GLY  14 -13.350  14.521 -18.191
   95   2HA   GLY  14           1HA      GLY  14 -12.571  15.893 -18.940
   96    H    THR  15             H      THR  15 -11.161  13.614 -16.735
   97    HA   THR  15            HA      THR  15  -9.459  12.148 -18.680
   98    HB   THR  15            HB      THR  15  -8.481  13.834 -16.376
   99    HG1  THR  15           HG1      THR  15  -8.517  14.756 -18.486
  100   1HG2  THR  15          3HG2      THR  15  -7.322  11.425 -17.698
  101   2HG2  THR  15          2HG2      THR  15  -6.259  12.675 -17.004
  102   3HG2  THR  15          1HG2      THR  15  -7.439  11.837 -15.989
  103    H    CYS  16             H      CYS  16 -10.230  12.846 -15.456
  104    HA   CYS  16            HA      CYS  16 -10.176  10.246 -14.230
  105   1HB   CYS  16           2HB      CYS  16 -11.520  11.620 -12.504
  106   2HB   CYS  16           1HB      CYS  16 -10.073  12.452 -13.016
  107    HG   CYS  16            HG      CYS  16 -11.453  14.147 -14.302
  108    H    GLN  17             H      GLN  17 -12.273   9.059 -13.766
  109    HA   GLN  17            HA      GLN  17 -14.677   9.798 -15.184
  110   1HB   GLN  17           2HB      GLN  17 -13.111   8.387 -16.646
  111   2HB   GLN  17           1HB      GLN  17 -13.649   7.044 -15.643
  112   1HG   GLN  17           2HG      GLN  17 -15.637   8.936 -16.888
  113   2HG   GLN  17           1HG      GLN  17 -14.995   7.576 -17.808
  114   1HE2  GLN  17          2HE2      GLN  17 -18.001   6.858 -15.325
  115   2HE2  GLN  17          1HE2      GLN  17 -17.614   8.381 -15.971
  116    H    ASP  18             H      ASP  18 -13.064   7.736 -12.794
  117    HA   ASP  18            HA      ASP  18 -15.647   7.381 -11.353
  118   1HB   ASP  18           2HB      ASP  18 -15.553   5.407 -12.895
  119   2HB   ASP  18           1HB      ASP  18 -14.045   4.925 -12.133
  120    H    ALA  19             H      ALA  19 -14.807   8.429  -9.664
  121    HA   ALA  19            HA      ALA  19 -12.275   7.790  -8.409
  122   1HB   ALA  19           2HB      ALA  19 -13.031  10.267  -8.619
  123   2HB   ALA  19           1HB      ALA  19 -14.333   9.865  -7.496
  124   3HB   ALA  19           3HB      ALA  19 -12.661   9.740  -6.988
  125    H    ALA  20             H      ALA  20 -12.299   6.127  -7.064
  126    HA   ALA  20            HA      ALA  20 -14.896   5.756  -5.542
  127   1HB   ALA  20           2HB      ALA  20 -12.950   3.746  -6.520
  128   2HB   ALA  20           1HB      ALA  20 -14.003   3.396  -5.134
  129   3HB   ALA  20           3HB      ALA  20 -14.691   3.811  -6.707
  130    H    ILE  21             H      ILE  21 -14.660   6.740  -3.718
  131    HA   ILE  21            HA      ILE  21 -12.227   6.465  -2.085
  132    HB   ILE  21            HB      ILE  21 -14.951   7.611  -1.302
  133   1HG1  ILE  21          2HG1      ILE  21 -12.584   8.801  -2.781
  134   2HG1  ILE  21          1HG1      ILE  21 -14.291   8.923  -3.182
  135   1HG2  ILE  21          2HG2      ILE  21 -12.151   7.795  -0.122
  136   2HG2  ILE  21          1HG2      ILE  21 -13.461   8.861   0.377
  137   3HG2  ILE  21          3HG2      ILE  21 -13.589   7.123   0.639
  138   1HD1  ILE  21          2HD1      ILE  21 -14.176  10.141  -0.713
  139   2HD1  ILE  21          1HD1      ILE  21 -12.644  10.601  -1.436
  140   3HD1  ILE  21          3HD1      ILE  21 -14.156  11.002  -2.256
  141    H    VAL  22             H      VAL  22 -12.089   4.626  -0.691
  142    HA   VAL  22            HA      VAL  22 -14.616   3.065  -0.354
  143    HB   VAL  22            HB      VAL  22 -11.822   1.960  -0.882
  144   1HG1  VAL  22          3HG1      VAL  22 -13.348   0.488   0.453
  145   2HG1  VAL  22          2HG1      VAL  22 -14.498   0.539  -0.881
  146   3HG1  VAL  22          1HG1      VAL  22 -12.911  -0.199  -1.114
  147   1HG2  VAL  22          2HG2      VAL  22 -14.185   2.460  -2.695
  148   2HG2  VAL  22          1HG2      VAL  22 -12.506   2.944  -2.933
  149   3HG2  VAL  22          3HG2      VAL  22 -12.965   1.243  -3.088
  150    H    GLY  23             H      GLY  23 -15.023   3.078   1.937
  151   1HA   GLY  23           2HA      GLY  23 -12.937   3.341   3.958
  152   2HA   GLY  23           1HA      GLY  23 -14.602   2.812   4.269
  153    OH   TYR  24            OH      TYR  24  -5.484   1.154   5.442
  154    H    TYR  24             H      TYR  24 -11.438   1.733   3.315
  155    HA   TYR  24            HA      TYR  24 -12.080  -1.071   3.061
  156   1HB   TYR  24           2HB      TYR  24  -9.946  -1.271   2.086
  157   2HB   TYR  24           1HB      TYR  24 -10.346   0.386   1.742
  158    HD1  TYR  24           HD1      TYR  24  -9.820   1.804   4.267
  159    HD2  TYR  24           HD2      TYR  24  -7.720  -1.449   2.488
  160    HE1  TYR  24           HE1      TYR  24  -7.809   2.413   5.549
  161    HE2  TYR  24           HE2      TYR  24  -5.698  -0.844   3.725
  162    HH   TYR  24            HH      TYR  24  -5.413   2.110   5.458
  163    H    LYS  25             H      LYS  25 -12.413   0.090   5.840
  164    HA   LYS  25            HA      LYS  25 -10.274  -0.703   7.526
  165   1HB   LYS  25           2HB      LYS  25 -13.153  -0.200   7.981
  166   2HB   LYS  25           1HB      LYS  25 -12.122  -0.713   9.281
  167   1HG   LYS  25           2HG      LYS  25 -12.064   1.648   9.406
  168   2HG   LYS  25           1HG      LYS  25 -10.567   1.210   8.586
  169   1HD   LYS  25           2HD      LYS  25 -11.323   1.909   6.531
  170   2HD   LYS  25           1HD      LYS  25 -13.019   1.704   6.970
  171   1HE   LYS  25           2HE      LYS  25 -11.160   3.840   8.039
  172   2HE   LYS  25           1HE      LYS  25 -12.453   4.082   6.878
  173   1HZ   LYS  25           1HZ      LYS  25 -13.850   2.938   8.772
  174   2HZ   LYS  25           3HZ      LYS  25 -12.618   3.569   9.751
  175   3HZ   LYS  25           2HZ      LYS  25 -13.549   4.607   8.784
  176    H    ASP  26             H      ASP  26 -11.692  -2.439   9.349
  177    HA   ASP  26            HA      ASP  26 -10.947  -5.032   8.703
  178   1HB   ASP  26           2HB      ASP  26 -13.147  -5.727   9.975
  179   2HB   ASP  26           1HB      ASP  26 -11.810  -5.014  10.844
  180    H    SER  27             H      SER  27 -14.200  -3.777   8.159
  181    HA   SER  27            HA      SER  27 -14.579  -5.664   5.930
  182   1HB   SER  27           2HB      SER  27 -16.989  -4.917   6.279
  183   2HB   SER  27           1HB      SER  27 -16.333  -5.955   7.510
  184    HG   SER  27            HG      SER  27 -16.600  -3.128   7.553
  185    HA   PRO  28            HA      PRO  28 -13.921  -1.868   3.729
  186   1HB   PRO  28           2HB      PRO  28 -13.958  -2.920   1.203
  187   2HB   PRO  28           1HB      PRO  28 -12.554  -2.958   2.285
  188   1HG   PRO  28           2HG      PRO  28 -14.346  -5.177   1.527
  189   2HG   PRO  28           1HG      PRO  28 -12.735  -5.220   2.203
  190   1HD   PRO  28           2HD      PRO  28 -15.174  -5.673   3.565
  191   2HD   PRO  28           1HD      PRO  28 -13.536  -5.615   4.252
  192    H    SER  29             H      SER  29 -15.037  -0.515   2.130
  193    HA   SER  29            HA      SER  29 -17.597  -1.218   1.111
  194   1HB   SER  29           2HB      SER  29 -18.836   0.496   2.485
  195   2HB   SER  29           1HB      SER  29 -18.372  -0.950   3.370
  196    HG   SER  29            HG      SER  29 -17.433   1.661   3.553
  197    H    VAL  30             H      VAL  30 -18.568   0.622   0.006
  198    HA   VAL  30            HA      VAL  30 -16.497   2.352  -1.090
  199    HB   VAL  30            HB      VAL  30 -19.288   1.596  -1.901
  200   1HG1  VAL  30          2HG1      VAL  30 -18.750   3.986  -2.527
  201   2HG1  VAL  30          1HG1      VAL  30 -17.336   3.374  -3.392
  202   3HG1  VAL  30          3HG1      VAL  30 -18.953   2.909  -3.914
  203   1HG2  VAL  30          1HG2      VAL  30 -16.503   1.065  -2.945
  204   2HG2  VAL  30          3HG2      VAL  30 -17.576  -0.097  -2.178
  205   3HG2  VAL  30          2HG2      VAL  30 -17.970   0.563  -3.745
  206    CH2  TRP  31           CH2      TRP  31 -13.869   6.067   6.658
  207    H    TRP  31             H      TRP  31 -16.210   4.047   0.232
  208    HA   TRP  31            HA      TRP  31 -18.259   5.333   1.750
  209   1HB   TRP  31           2HB      TRP  31 -15.374   5.810   1.137
  210   2HB   TRP  31           1HB      TRP  31 -16.308   7.147   1.800
  211    HD1  TRP  31           HD1      TRP  31 -17.638   3.891   2.996
  212    HE1  TRP  31           HE1      TRP  31 -16.924   3.448   5.382
  213    HE3  TRP  31           HE3      TRP  31 -13.990   7.457   3.556
  214    HZ2  TRP  31           HZ2      TRP  31 -15.092   4.428   7.326
  215    HZ3  TRP  31           HZ3      TRP  31 -12.806   7.672   5.719
  216    HH2  TRP  31           HH2      TRP  31 -13.339   6.161   7.592
  217    H    ALA  32             H      ALA  32 -16.991   5.769  -1.469
  218    HA   ALA  32            HA      ALA  32 -19.205   7.317  -2.360
  219   1HB   ALA  32           1HB      ALA  32 -16.735   8.985  -1.735
  220   2HB   ALA  32           3HB      ALA  32 -18.134   9.578  -2.664
  221   3HB   ALA  32           2HB      ALA  32 -18.315   9.125  -0.956
  222    H    ALA  33             H      ALA  33 -18.844   5.688  -3.988
  223    HA   ALA  33            HA      ALA  33 -16.709   6.396  -5.922
  224   1HB   ALA  33           3HB      ALA  33 -18.073   3.733  -5.489
  225   2HB   ALA  33           2HB      ALA  33 -16.948   4.077  -6.798
  226   3HB   ALA  33           1HB      ALA  33 -16.390   4.114  -5.125
  227    H    VAL  34             H      VAL  34 -17.381   7.061  -7.879
  228    HA   VAL  34            HA      VAL  34 -20.046   7.848  -8.423
  229    HB   VAL  34            HB      VAL  34 -18.001   6.976 -10.492
  230   1HG1  VAL  34          3HG1      VAL  34 -20.664   8.314 -10.622
  231   2HG1  VAL  34          2HG1      VAL  34 -19.389   9.018 -11.633
  232   3HG1  VAL  34          1HG1      VAL  34 -19.851   7.311 -11.831
  233   1HG2  VAL  34          3HG2      VAL  34 -18.564   9.657  -9.205
  234   2HG2  VAL  34          2HG2      VAL  34 -17.136   8.662  -8.945
  235   3HG2  VAL  34          1HG2      VAL  34 -17.430   9.379 -10.525
  236    HA   PRO  35            HA      PRO  35 -21.800   3.695  -8.689
  237   1HB   PRO  35           2HB      PRO  35 -24.437   4.456  -8.896
  238   2HB   PRO  35           1HB      PRO  35 -23.548   4.375  -7.365
  239   1HG   PRO  35           2HG      PRO  35 -24.303   6.786  -8.977
  240   2HG   PRO  35           1HG      PRO  35 -24.079   6.633  -7.225
  241   1HD   PRO  35           2HD      PRO  35 -22.206   7.758  -8.991
  242   2HD   PRO  35           1HD      PRO  35 -21.844   7.173  -7.353
  243    H    GLY  36             H      GLY  36 -22.486   2.328 -10.324
  244   1HA   GLY  36           2HA      GLY  36 -23.645   1.868 -12.431
  245   2HA   GLY  36           1HA      GLY  36 -23.327   3.531 -12.924
  246    H    LYS  37             H      LYS  37 -20.449   3.072 -11.731
  247    HA   LYS  37            HA      LYS  37 -19.320   2.174 -14.294
  248   1HB   LYS  37           2HB      LYS  37 -18.213   3.493 -11.836
  249   2HB   LYS  37           1HB      LYS  37 -17.123   2.766 -13.019
  250   1HG   LYS  37           2HG      LYS  37 -17.338   4.987 -13.780
  251   2HG   LYS  37           1HG      LYS  37 -18.494   4.105 -14.777
  252   1HD   LYS  37           2HD      LYS  37 -19.516   5.152 -12.183
  253   2HD   LYS  37           1HD      LYS  37 -19.155   6.348 -13.427
  254   1HE   LYS  37           2HE      LYS  37 -20.561   4.133 -14.631
  255   2HE   LYS  37           1HE      LYS  37 -21.464   4.704 -13.228
  256   1HZ   LYS  37           2HZ      LYS  37 -21.189   6.989 -14.131
  257   2HZ   LYS  37           1HZ      LYS  37 -20.549   6.305 -15.546
  258   3HZ   LYS  37           3HZ      LYS  37 -22.146   5.968 -15.097
  259    H    THR  38             H      THR  38 -17.691   1.408 -11.195
  260    HA   THR  38            HA      THR  38 -18.282  -1.430 -11.299
  261    HB   THR  38            HB      THR  38 -15.975  -0.344 -12.777
  262    HG1  THR  38           HG1      THR  38 -17.353  -2.776 -13.043
  263   1HG2  THR  38          1HG2      THR  38 -14.798  -1.598 -10.975
  264   2HG2  THR  38          3HG2      THR  38 -15.758  -3.024 -11.384
  265   3HG2  THR  38          2HG2      THR  38 -14.608  -2.372 -12.550
  266    H    PHE  39             H      PHE  39 -15.992   1.061 -10.208
  267    HA   PHE  39            HA      PHE  39 -14.737  -0.356  -8.079
  268   1HB   PHE  39           2HB      PHE  39 -15.421   2.570  -8.268
  269   2HB   PHE  39           1HB      PHE  39 -14.304   1.851  -7.114
  270    HD1  PHE  39           HD2      PHE  39 -13.871  -0.093 -10.002
  271    HD2  PHE  39           HD1      PHE  39 -12.980   3.880  -8.503
  272    HE1  PHE  39           HE2      PHE  39 -12.038   0.116 -11.637
  273    HE2  PHE  39           HE1      PHE  39 -11.134   4.033 -10.141
  274    HZ   PHE  39            HZ      PHE  39 -10.678   2.167 -11.703
  275    H    VAL  40             H      VAL  40 -17.678   1.553  -8.022
  276    HA   VAL  40            HA      VAL  40 -18.194   1.622  -5.279
  277    HB   VAL  40            HB      VAL  40 -19.505   3.029  -6.689
  278   1HG1  VAL  40          1HG1      VAL  40 -20.105   0.467  -8.139
  279   2HG1  VAL  40          3HG1      VAL  40 -21.155   1.872  -8.316
  280   3HG1  VAL  40          2HG1      VAL  40 -19.449   1.980  -8.776
  281   1HG2  VAL  40          2HG2      VAL  40 -20.675   1.351  -4.803
  282   2HG2  VAL  40          1HG2      VAL  40 -21.430   2.787  -5.505
  283   3HG2  VAL  40          3HG2      VAL  40 -21.750   1.194  -6.195
  284    H    ASN  41             H      ASN  41 -18.406  -1.023  -7.519
  285    HA   ASN  41            HA      ASN  41 -20.033  -2.674  -5.733
  286   1HB   ASN  41           2HB      ASN  41 -18.917  -2.956  -8.504
  287   2HB   ASN  41           1HB      ASN  41 -19.452  -4.357  -7.607
  288   1HD2  ASN  41          2HD2      ASN  41 -22.210  -1.814  -9.142
  289   2HD2  ASN  41          1HD2      ASN  41 -20.547  -1.528  -9.325
  290    H    ILE  42             H      ILE  42 -17.285  -1.613  -4.953
  291    HA   ILE  42            HA      ILE  42 -15.443  -3.794  -5.157
  292    HB   ILE  42            HB      ILE  42 -15.499  -1.089  -3.848
  293   1HG1  ILE  42          2HG1      ILE  42 -13.135  -2.369  -5.172
  294   2HG1  ILE  42          1HG1      ILE  42 -14.536  -1.982  -6.166
  295   1HG2  ILE  42          3HG2      ILE  42 -13.536  -3.257  -2.989
  296   2HG2  ILE  42          2HG2      ILE  42 -13.357  -1.541  -2.632
  297   3HG2  ILE  42          1HG2      ILE  42 -14.708  -2.443  -1.957
  298   1HD1  ILE  42          2HD1      ILE  42 -14.193   0.317  -4.639
  299   2HD1  ILE  42          1HD1      ILE  42 -12.541  -0.188  -4.992
  300   3HD1  ILE  42          3HD1      ILE  42 -13.674   0.106  -6.315
  301    H    THR  43             H      THR  43 -14.623  -4.886  -3.324
  302    HA   THR  43            HA      THR  43 -16.240  -5.488  -0.933
  303    HB   THR  43            HB      THR  43 -15.902  -7.970  -1.644
  304    HG1  THR  43           HG1      THR  43 -15.654  -8.258  -3.881
  305   1HG2  THR  43          1HG2      THR  43 -17.715  -6.085  -3.071
  306   2HG2  THR  43          3HG2      THR  43 -17.785  -7.817  -3.376
  307   3HG2  THR  43          2HG2      THR  43 -18.115  -7.194  -1.760
  308    HA   PRO  44            HA      PRO  44 -12.091  -6.215   0.705
  309   1HB   PRO  44           2HB      PRO  44 -12.141  -8.566   2.002
  310   2HB   PRO  44           1HB      PRO  44 -12.799  -7.090   2.659
  311   1HG   PRO  44           2HG      PRO  44 -14.243  -9.449   1.553
  312   2HG   PRO  44           1HG      PRO  44 -14.802  -8.241   2.725
  313   1HD   PRO  44           2HD      PRO  44 -15.500  -8.318   0.016
  314   2HD   PRO  44           1HD      PRO  44 -15.743  -6.932   1.077
  315    H    ALA  45             H      ALA  45 -13.150  -8.106  -1.703
  316    HA   ALA  45            HA      ALA  45 -10.872  -9.878  -2.002
  317   1HB   ALA  45           2HB      ALA  45 -13.454 -10.050  -2.823
  318   2HB   ALA  45           1HB      ALA  45 -12.691  -9.398  -4.272
  319   3HB   ALA  45           3HB      ALA  45 -12.136 -10.929  -3.597
  320    H    GLU  46             H      GLU  46 -12.378  -7.464  -4.017
  321    HA   GLU  46            HA      GLU  46 -10.067  -6.882  -5.628
  322   1HB   GLU  46           2HB      GLU  46 -11.352  -4.559  -5.879
  323   2HB   GLU  46           1HB      GLU  46 -11.893  -5.983  -6.729
  324   1HG   GLU  46           2HG      GLU  46 -12.957  -5.626  -4.008
  325   2HG   GLU  46           1HG      GLU  46 -13.444  -4.390  -5.163
  326    H    VAL  47             H      VAL  47 -11.212  -5.622  -2.571
  327    HA   VAL  47            HA      VAL  47  -9.076  -3.654  -2.370
  328    HB   VAL  47            HB      VAL  47 -11.559  -4.160  -0.951
  329   1HG1  VAL  47          1HG1      VAL  47  -9.877  -4.553   0.858
  330   2HG1  VAL  47          3HG1      VAL  47  -9.321  -2.914   0.533
  331   3HG1  VAL  47          2HG1      VAL  47 -10.962  -3.182   1.104
  332   1HG2  VAL  47          1HG2      VAL  47 -10.755  -2.189  -2.428
  333   2HG2  VAL  47          3HG2      VAL  47 -11.663  -1.812  -0.956
  334   3HG2  VAL  47          2HG2      VAL  47  -9.878  -1.671  -0.949
  335    H    GLY  48             H      GLY  48  -9.611  -6.946  -1.550
  336   1HA   GLY  48           2HA      GLY  48  -7.729  -7.332   0.546
  337   2HA   GLY  48           1HA      GLY  48  -8.208  -8.551  -0.628
  338    H    VAL  49             H      VAL  49  -7.378  -6.857  -2.883
  339    HA   VAL  49            HA      VAL  49  -4.480  -7.453  -2.814
  340    HB   VAL  49            HB      VAL  49  -5.743  -8.391  -4.720
  341   1HG1  VAL  49          3HG1      VAL  49  -6.261  -5.474  -5.345
  342   2HG1  VAL  49          2HG1      VAL  49  -6.546  -6.795  -6.474
  343   3HG1  VAL  49          1HG1      VAL  49  -7.461  -6.708  -4.973
  344   1HG2  VAL  49          2HG2      VAL  49  -3.649  -6.273  -5.268
  345   2HG2  VAL  49          1HG2      VAL  49  -3.448  -8.023  -5.195
  346   3HG2  VAL  49          3HG2      VAL  49  -4.299  -7.293  -6.554
  347    H    LEU  50             H      LEU  50  -6.649  -4.777  -3.337
  348    HA   LEU  50            HA      LEU  50  -4.705  -2.779  -3.978
  349   1HB   LEU  50           2HB      LEU  50  -7.497  -2.908  -3.181
  350   2HB   LEU  50           1HB      LEU  50  -6.731  -1.422  -2.872
  351    HG   LEU  50            HG      LEU  50  -6.499  -2.612  -5.583
  352   1HD1  LEU  50          2HD1      LEU  50  -8.966  -1.322  -4.328
  353   2HD1  LEU  50          1HD1      LEU  50  -8.683  -1.296  -6.078
  354   3HD1  LEU  50          3HD1      LEU  50  -8.878  -2.838  -5.243
  355   1HD2  LEU  50          2HD2      LEU  50  -5.345  -0.482  -4.902
  356   2HD2  LEU  50          1HD2      LEU  50  -6.511  -0.229  -6.200
  357   3HD2  LEU  50          3HD2      LEU  50  -6.926   0.222  -4.540
  358    H    VAL  51             H      VAL  51  -5.442  -4.398  -1.073
  359    HA   VAL  51            HA      VAL  51  -3.897  -2.432   0.514
  360    HB   VAL  51            HB      VAL  51  -5.707  -1.933   2.005
  361   1HG1  VAL  51          2HG1      VAL  51  -7.028  -2.413  -0.666
  362   2HG1  VAL  51          1HG1      VAL  51  -7.740  -1.488   0.630
  363   3HG1  VAL  51          3HG1      VAL  51  -6.261  -0.922  -0.131
  364   1HG2  VAL  51          2HG2      VAL  51  -6.584  -4.670   1.336
  365   2HG2  VAL  51          1HG2      VAL  51  -6.746  -3.784   2.850
  366   3HG2  VAL  51          3HG2      VAL  51  -7.901  -3.522   1.549
  367    H    GLY  52             H      GLY  52  -5.036  -5.701   0.186
  368   1HA   GLY  52           2HA      GLY  52  -4.244  -6.750   2.728
  369   2HA   GLY  52           1HA      GLY  52  -4.467  -7.714   1.279
  370    H    LYS  53             H      LYS  53  -2.243  -6.684   3.477
  371    HA   LYS  53            HA      LYS  53   0.106  -6.203   2.063
  372   1HB   LYS  53           2HB      LYS  53   1.330  -6.822   4.076
  373   2HB   LYS  53           1HB      LYS  53  -0.119  -5.930   4.532
  374   1HG   LYS  53           2HG      LYS  53  -0.367  -7.712   5.971
  375   2HG   LYS  53           1HG      LYS  53  -1.140  -8.426   4.557
  376   1HD   LYS  53           2HD      LYS  53   0.651  -9.809   4.100
  377   2HD   LYS  53           1HD      LYS  53   1.824  -8.685   4.784
  378   1HE   LYS  53           2HE      LYS  53  -0.169 -10.273   6.425
  379   2HE   LYS  53           1HE      LYS  53   1.514 -10.741   6.178
  380   1HZ   LYS  53           1HZ      LYS  53   2.000  -8.372   7.018
  381   2HZ   LYS  53           3HZ      LYS  53   0.431  -8.436   7.657
  382   3HZ   LYS  53           2HZ      LYS  53   1.594  -9.574   8.147
  383    H    ASP  54             H      ASP  54  -1.478  -9.191   2.733
  384    HA   ASP  54            HA      ASP  54   0.667 -10.835   1.744
  385   1HB   ASP  54           2HB      ASP  54  -0.954 -11.508   3.588
  386   2HB   ASP  54           1HB      ASP  54  -2.142 -11.743   2.309
  387    NH1  ARG  55           NH2      ARG  55  -6.237 -11.560  -4.104
  388    NH2  ARG  55           NH1      ARG  55  -5.111 -13.343  -3.294
  389    H    ARG  55             H      ARG  55   0.670  -9.631  -0.328
  390    HA   ARG  55            HA      ARG  55  -0.600 -11.024  -2.422
  391   1HB   ARG  55           2HB      ARG  55  -2.353  -9.323  -1.335
  392   2HB   ARG  55           1HB      ARG  55  -1.516  -8.192  -2.390
  393   1HG   ARG  55           2HG      ARG  55  -3.431  -9.148  -3.579
  394   2HG   ARG  55           1HG      ARG  55  -1.942  -9.725  -4.321
  395   1HD   ARG  55           2HD      ARG  55  -2.140 -11.862  -3.227
  396   2HD   ARG  55           1HD      ARG  55  -3.453 -11.283  -2.204
  397    HE   ARG  55            HE      ARG  55  -3.778 -11.474  -5.170
  398   1HH1  ARG  55          1HH2      ARG  55  -6.236 -10.663  -4.545
  399   2HH1  ARG  55          2HH2      ARG  55  -7.102 -11.989  -3.844
  400   1HH2  ARG  55          2HH1      ARG  55  -4.247 -13.815  -3.117
  401   2HH2  ARG  55          1HH1      ARG  55  -5.977 -13.768  -3.029
  402    H    SER  56             H      SER  56   1.969 -10.678  -2.037
  403    HA   SER  56            HA      SER  56   3.194  -8.308  -3.037
  404   1HB   SER  56           2HB      SER  56   4.258 -10.098  -1.556
  405   2HB   SER  56           1HB      SER  56   4.487 -11.027  -3.032
  406    HG   SER  56            HG      SER  56   6.054  -9.733  -3.561
  407    H    SER  57             H      SER  57   1.591 -10.787  -4.673
  408    HA   SER  57            HA      SER  57   3.154 -10.795  -7.075
  409   1HB   SER  57           2HB      SER  57   1.106 -11.870  -8.060
  410   2HB   SER  57           1HB      SER  57   1.795 -12.712  -6.680
  411    HG   SER  57            HG      SER  57  -0.604 -12.178  -6.785
  412    H    PHE  58             H      PHE  58   0.023  -9.421  -6.285
  413    HA   PHE  58            HA      PHE  58  -0.648  -8.058  -8.620
  414   1HB   PHE  58           2HB      PHE  58  -2.041  -6.561  -7.483
  415   2HB   PHE  58           1HB      PHE  58  -1.954  -7.955  -6.455
  416    HD1  PHE  58           HD2      PHE  58  -0.126  -4.653  -6.894
  417    HD2  PHE  58           HD1      PHE  58  -1.690  -7.594  -4.214
  418    HE1  PHE  58           HE2      PHE  58   0.528  -3.247  -4.974
  419    HE2  PHE  58           HE1      PHE  58  -1.055  -6.183  -2.286
  420    HZ   PHE  58            HZ      PHE  58   0.053  -4.014  -2.675
  421    OH   TYR  59            OH      TYR  59   2.338  -4.135  -1.404
  422    H    TYR  59             H      TYR  59   2.034  -7.067  -6.619
  423    HA   TYR  59            HA      TYR  59   2.312  -4.443  -7.514
  424   1HB   TYR  59           2HB      TYR  59   4.415  -6.389  -6.718
  425   2HB   TYR  59           1HB      TYR  59   4.733  -4.679  -7.005
  426    HD1  TYR  59           HD1      TYR  59   3.849  -2.969  -5.550
  427    HD2  TYR  59           HD2      TYR  59   3.103  -7.102  -4.774
  428    HE1  TYR  59           HE1      TYR  59   3.153  -2.410  -3.227
  429    HE2  TYR  59           HE2      TYR  59   2.391  -6.561  -2.464
  430    HH   TYR  59            HH      TYR  59   1.423  -4.396  -1.296
  431    H    VAL  60             H      VAL  60   2.594  -7.072  -9.456
  432    HA   VAL  60            HA      VAL  60   3.938  -5.524 -11.531
  433    HB   VAL  60            HB      VAL  60   4.679  -7.905 -12.254
  434   1HG1  VAL  60          2HG1      VAL  60   6.158  -6.037 -11.566
  435   2HG1  VAL  60          1HG1      VAL  60   5.942  -6.536  -9.888
  436   3HG1  VAL  60          3HG1      VAL  60   6.769  -7.602 -11.024
  437   1HG2  VAL  60          3HG2      VAL  60   3.302  -8.947 -10.351
  438   2HG2  VAL  60          2HG2      VAL  60   4.954  -9.536 -10.553
  439   3HG2  VAL  60          1HG2      VAL  60   4.584  -8.365  -9.286
  440    H    ASN  61             H      ASN  61   1.453  -7.918 -10.724
  441    HA   ASN  61            HA      ASN  61   0.711  -8.227 -13.499
  442   1HB   ASN  61           2HB      ASN  61  -0.902  -9.827 -12.702
  443   2HB   ASN  61           1HB      ASN  61   0.647 -10.166 -11.995
  444   1HD2  ASN  61          2HD2      ASN  61  -0.638 -10.046  -8.769
  445   2HD2  ASN  61          1HD2      ASN  61   0.552 -10.616  -9.834
  446    H    GLY  62             H      GLY  62  -0.686  -6.707 -10.579
  447   1HA   GLY  62           2HA      GLY  62  -1.777  -4.516 -11.247
  448   2HA   GLY  62           1HA      GLY  62  -2.736  -5.537 -12.305
  449    H    LEU  63             H      LEU  63  -3.813  -3.901 -10.285
  450    HA   LEU  63            HA      LEU  63  -4.583  -5.670  -8.012
  451   1HB   LEU  63           2HB      LEU  63  -5.765  -2.911  -8.414
  452   2HB   LEU  63           1HB      LEU  63  -5.508  -3.772  -6.895
  453    HG   LEU  63            HG      LEU  63  -3.407  -2.468  -8.658
  454   1HD1  LEU  63          2HD1      LEU  63  -4.875  -1.074  -7.159
  455   2HD1  LEU  63          1HD1      LEU  63  -4.271  -2.001  -5.780
  456   3HD1  LEU  63          3HD1      LEU  63  -3.163  -1.006  -6.738
  457   1HD2  LEU  63          1HD2      LEU  63  -3.246  -4.381  -6.344
  458   2HD2  LEU  63          3HD2      LEU  63  -2.299  -4.359  -7.830
  459   3HD2  LEU  63          2HD2      LEU  63  -1.992  -3.162  -6.570
  460    H    THR  64             H      THR  64  -7.242  -4.522  -7.650
  461    HA   THR  64            HA      THR  64  -8.828  -5.148  -9.973
  462    HB   THR  64            HB      THR  64 -10.096  -6.956  -8.736
  463    HG1  THR  64           HG1      THR  64  -8.811  -8.010  -7.118
  464   1HG2  THR  64          1HG2      THR  64  -8.377  -7.291 -10.573
  465   2HG2  THR  64          3HG2      THR  64  -7.205  -7.667  -9.304
  466   3HG2  THR  64          2HG2      THR  64  -8.645  -8.678  -9.518
  467    H    LEU  65             H      LEU  65 -10.500  -3.901  -9.770
  468    HA   LEU  65            HA      LEU  65 -11.659  -3.321  -7.173
  469   1HB   LEU  65           2HB      LEU  65 -11.836  -0.866  -8.041
  470   2HB   LEU  65           1HB      LEU  65 -10.499  -1.417  -7.089
  471    HG   LEU  65            HG      LEU  65 -10.402  -1.464 -10.094
  472   1HD1  LEU  65          3HD1      LEU  65 -10.820   0.859  -8.896
  473   2HD1  LEU  65          2HD1      LEU  65  -9.122   0.695  -8.446
  474   3HD1  LEU  65          1HD1      LEU  65  -9.583   0.721 -10.148
  475   1HD2  LEU  65          2HD2      LEU  65  -8.646  -2.190  -7.870
  476   2HD2  LEU  65          1HD2      LEU  65  -8.462  -2.530  -9.587
  477   3HD2  LEU  65          3HD2      LEU  65  -7.882  -1.004  -8.926
  478    H    GLY  66             H      GLY  66 -13.563  -4.085  -7.391
  479   1HA   GLY  66           2HA      GLY  66 -15.794  -4.171  -8.114
  480   2HA   GLY  66           1HA      GLY  66 -15.370  -3.068  -9.429
  481    H    GLY  67             H      GLY  67 -13.382  -5.916  -8.791
  482   1HA   GLY  67           2HA      GLY  67 -13.152  -7.928  -9.980
  483   2HA   GLY  67           1HA      GLY  67 -14.705  -7.615 -10.760
  484    H    GLN  68             H      GLN  68 -12.487  -4.916 -10.873
  485    HA   GLN  68            HA      GLN  68 -11.901  -5.619 -13.730
  486   1HB   GLN  68           2HB      GLN  68 -13.265  -3.612 -13.341
  487   2HB   GLN  68           1HB      GLN  68 -11.894  -2.952 -12.507
  488   1HG   GLN  68           2HG      GLN  68 -11.474  -4.040 -15.233
  489   2HG   GLN  68           1HG      GLN  68 -12.221  -2.448 -15.066
  490   1HE2  GLN  68          2HE2      GLN  68  -8.309  -2.529 -14.909
  491   2HE2  GLN  68          1HE2      GLN  68  -9.317  -3.580 -15.782
  492    H    LYS  69             H      LYS  69  -9.892  -6.555 -13.790
  493    HA   LYS  69            HA      LYS  69  -7.896  -5.883 -11.870
  494   1HB   LYS  69           2HB      LYS  69  -7.717  -8.062 -12.602
  495   2HB   LYS  69           1HB      LYS  69  -8.220  -7.663 -14.234
  496   1HG   LYS  69           2HG      LYS  69  -5.908  -6.526 -14.461
  497   2HG   LYS  69           1HG      LYS  69  -5.479  -7.419 -13.004
  498   1HD   LYS  69           2HD      LYS  69  -6.870  -9.186 -14.778
  499   2HD   LYS  69           1HD      LYS  69  -5.598  -8.365 -15.688
  500   1HE   LYS  69           2HE      LYS  69  -3.948  -8.994 -13.885
  501   2HE   LYS  69           1HE      LYS  69  -5.231  -9.928 -13.112
  502   1HZ   LYS  69           3HZ      LYS  69  -4.622 -10.390 -15.948
  503   2HZ   LYS  69           2HZ      LYS  69  -3.612 -11.068 -14.760
  504   3HZ   LYS  69           1HZ      LYS  69  -5.266 -11.458 -14.800
  505    H    CYS  70             H      CYS  70  -6.835  -4.031 -11.854
  506    HA   CYS  70            HA      CYS  70  -6.186  -2.590 -14.467
  507   1HB   CYS  70           2HB      CYS  70  -5.499  -0.777 -12.836
  508   2HB   CYS  70           1HB      CYS  70  -7.212  -1.113 -12.857
  509    HG   CYS  70            HG      CYS  70  -5.866  -2.726 -10.691
  510    H    SER  71             H      SER  71  -3.846  -1.545 -13.995
  511    HA   SER  71            HA      SER  71  -2.051  -3.606 -12.904
  512   1HB   SER  71           2HB      SER  71  -0.613  -3.465 -14.825
  513   2HB   SER  71           1HB      SER  71  -2.237  -3.918 -15.261
  514    HG   SER  71            HG      SER  71  -0.868  -1.911 -16.203
  515    H    VAL  72             H      VAL  72  -1.092  -2.659 -11.304
  516    HA   VAL  72            HA      VAL  72  -0.555   0.008 -10.802
  517    HB   VAL  72            HB      VAL  72   1.424  -2.115 -10.172
  518   1HG1  VAL  72          2HG1      VAL  72   1.018   0.621  -9.406
  519   2HG1  VAL  72          1HG1      VAL  72   0.912  -0.425  -8.002
  520   3HG1  VAL  72          3HG1      VAL  72   2.356  -0.455  -8.998
  521   1HG2  VAL  72          2HG2      VAL  72  -1.327  -1.723  -9.106
  522   2HG2  VAL  72          1HG2      VAL  72  -0.477  -3.228  -9.436
  523   3HG2  VAL  72          3HG2      VAL  72  -0.068  -2.279  -8.015
  524    H    ILE  73             H      ILE  73   0.566   1.437 -11.716
  525    HA   ILE  73            HA      ILE  73   2.977   0.768 -13.156
  526    HB   ILE  73            HB      ILE  73   0.861   2.614 -14.100
  527   1HG1  ILE  73          2HG1      ILE  73   2.003   0.458 -15.790
  528   2HG1  ILE  73          1HG1      ILE  73   0.963  -0.050 -14.467
  529   1HG2  ILE  73          3HG2      ILE  73   3.693   2.289 -14.939
  530   2HG2  ILE  73          2HG2      ILE  73   2.478   2.757 -16.130
  531   3HG2  ILE  73          1HG2      ILE  73   2.775   3.781 -14.725
  532   1HD1  ILE  73          3HD1      ILE  73  -0.790   1.588 -15.372
  533   2HD1  ILE  73          2HD1      ILE  73   0.227   1.762 -16.799
  534   3HD1  ILE  73          1HD1      ILE  73  -0.477   0.181 -16.408
  535    NH1  ARG  74           NH1      ARG  74   8.112   7.797 -10.412
  536    NH2  ARG  74           NH2      ARG  74   7.249   8.725 -12.284
  537    H    ARG  74             H      ARG  74   3.637   1.304 -11.037
  538    HA   ARG  74            HA      ARG  74   5.308   2.778 -10.028
  539   1HB   ARG  74           2HB      ARG  74   4.454   4.714 -11.543
  540   2HB   ARG  74           1HB      ARG  74   3.296   5.024 -10.250
  541   1HG   ARG  74           2HG      ARG  74   5.116   5.269  -8.637
  542   2HG   ARG  74           1HG      ARG  74   6.300   4.888  -9.888
  543   1HD   ARG  74           2HD      ARG  74   4.374   7.148 -10.326
  544   2HD   ARG  74           1HD      ARG  74   5.794   7.401  -9.307
  545    HE   ARG  74            HE      ARG  74   6.058   6.392 -12.110
  546   1HH1  ARG  74          2HH1      ARG  74   8.068   7.109  -9.688
  547   2HH1  ARG  74          1HH1      ARG  74   8.862   8.460 -10.428
  548   1HH2  ARG  74          1HH2      ARG  74   6.550   8.743 -12.998
  549   2HH2  ARG  74          2HH2      ARG  74   7.985   9.401 -12.288
  550    H    ASP  75             H      ASP  75   4.479   1.100  -8.514
  551    HA   ASP  75            HA      ASP  75   2.227   1.730  -6.909
  552   1HB   ASP  75           2HB      ASP  75   2.419  -0.543  -6.825
  553   2HB   ASP  75           1HB      ASP  75   4.125  -0.490  -6.927
  554    H    SER  76             H      SER  76   2.149   3.459  -5.759
  555    HA   SER  76            HA      SER  76   4.318   3.848  -3.730
  556   1HB   SER  76           2HB      SER  76   3.924   5.625  -5.825
  557   2HB   SER  76           1HB      SER  76   2.998   6.336  -4.528
  558    HG   SER  76            HG      SER  76   5.673   5.435  -4.349
  559    H    LEU  77             H      LEU  77   1.108   3.160  -4.249
  560    HA   LEU  77            HA      LEU  77  -0.682   4.548  -2.679
  561   1HB   LEU  77           2HB      LEU  77  -0.871   2.327  -3.943
  562   2HB   LEU  77           1HB      LEU  77  -0.325   1.542  -2.482
  563    HG   LEU  77            HG      LEU  77  -2.622   3.438  -2.319
  564   1HD1  LEU  77          3HD1      LEU  77  -2.970   1.940  -4.337
  565   2HD1  LEU  77          2HD1      LEU  77  -2.824   0.550  -3.252
  566   3HD1  LEU  77          1HD1      LEU  77  -4.154   1.691  -3.045
  567   1HD2  LEU  77          3HD2      LEU  77  -1.602   0.961  -0.934
  568   2HD2  LEU  77          2HD2      LEU  77  -2.010   2.526  -0.232
  569   3HD2  LEU  77          1HD2      LEU  77  -3.291   1.436  -0.762
  570    H    LEU  78             H      LEU  78   2.049   2.682  -1.442
  571    HA   LEU  78            HA      LEU  78   1.034   3.223   1.220
  572   1HB   LEU  78           2HB      LEU  78   3.075   1.416   0.257
  573   2HB   LEU  78           1HB      LEU  78   2.908   1.731   1.953
  574    HG   LEU  78            HG      LEU  78   0.544   0.925   0.244
  575   1HD1  LEU  78          2HD1      LEU  78   2.413  -0.943   1.727
  576   2HD1  LEU  78          1HD1      LEU  78   0.844  -1.404   1.035
  577   3HD1  LEU  78          3HD1      LEU  78   2.169  -0.880  -0.017
  578   1HD2  LEU  78          1HD2      LEU  78   1.162   0.723   3.205
  579   2HD2  LEU  78          3HD2      LEU  78   0.076   1.885   2.442
  580   3HD2  LEU  78          2HD2      LEU  78  -0.332   0.166   2.440
  581    H    GLN  79             H      GLN  79   1.778   4.781   2.354
  582    HA   GLN  79            HA      GLN  79   2.972   6.982   1.612
  583   1HB   GLN  79           2HB      GLN  79   3.153   7.562   4.023
  584   2HB   GLN  79           1HB      GLN  79   1.589   6.868   3.614
  585   1HG   GLN  79           2HG      GLN  79   2.540   4.628   4.339
  586   2HG   GLN  79           1HG      GLN  79   3.921   5.515   4.962
  587   1HE2  GLN  79          2HE2      GLN  79   0.309   5.909   6.872
  588   2HE2  GLN  79          1HE2      GLN  79   0.343   5.376   5.262
  589    H    ASP  80             H      ASP  80   4.694   6.140   0.477
  590    HA   ASP  80            HA      ASP  80   7.240   5.961   2.026
  591   1HB   ASP  80           2HB      ASP  80   6.646   4.309   0.051
  592   2HB   ASP  80           1HB      ASP  80   7.019   5.693  -0.978
  593    H    GLY  81             H      GLY  81   5.281   8.293   1.532
  594   1HA   GLY  81           2HA      GLY  81   5.753  10.626   1.418
  595   2HA   GLY  81           1HA      GLY  81   7.175  10.252   0.429
  596    H    GLU  82             H      GLU  82   4.078   8.610  -0.170
  597    HA   GLU  82            HA      GLU  82   3.469  10.295  -2.454
  598   1HB   GLU  82           2HB      GLU  82   4.631   7.614  -2.509
  599   2HB   GLU  82           1HB      GLU  82   3.411   7.999  -3.666
  600   1HG   GLU  82           2HG      GLU  82   5.238   8.645  -4.874
  601   2HG   GLU  82           1HG      GLU  82   4.871  10.170  -4.038
  602    H    PHE  83             H      PHE  83   2.602   7.063  -1.176
  603    HA   PHE  83            HA      PHE  83   0.597   5.884  -1.340
  604   1HB   PHE  83           2HB      PHE  83  -1.437   7.392  -0.583
  605   2HB   PHE  83           1HB      PHE  83  -0.385   6.580   0.484
  606    HD1  PHE  83           HD2      PHE  83  -1.366   9.791  -0.956
  607    HD2  PHE  83           HD1      PHE  83   1.288   7.798   1.758
  608    HE1  PHE  83           HE2      PHE  83  -0.728  11.983   0.033
  609    HE2  PHE  83           HE1      PHE  83   1.923   9.984   2.758
  610    HZ   PHE  83            HZ      PHE  83   0.913  12.078   1.891
  611    H    SER  84             H      SER  84   1.174   6.412  -3.772
  612    HA   SER  84            HA      SER  84  -1.363   7.003  -5.163
  613   1HB   SER  84           2HB      SER  84  -0.118   8.402  -6.836
  614   2HB   SER  84           1HB      SER  84  -0.242   9.151  -5.250
  615    HG   SER  84            HG      SER  84   1.874   9.319  -5.848
  616    H    MET  85             H      MET  85  -1.650   5.540  -6.742
  617    HA   MET  85            HA      MET  85   0.709   3.922  -7.697
  618   1HB   MET  85           2HB      MET  85  -0.816   3.064  -5.773
  619   2HB   MET  85           1HB      MET  85  -1.944   2.812  -7.048
  620   1HG   MET  85           2HG      MET  85  -0.963   0.928  -7.656
  621   2HG   MET  85           1HG      MET  85   0.577   1.732  -7.803
  622   1HE   MET  85           2HE      MET  85  -1.147  -0.793  -6.763
  623   2HE   MET  85           1HE      MET  85   0.425  -1.517  -6.277
  624   3HE   MET  85           3HE      MET  85  -0.862  -1.232  -5.068
  625    H    ASP  86             H      ASP  86   0.711   4.014 -10.010
  626    HA   ASP  86            HA      ASP  86  -1.819   4.871 -11.310
  627   1HB   ASP  86           2HB      ASP  86   0.989   4.547 -12.038
  628   2HB   ASP  86           1HB      ASP  86  -0.182   4.438 -13.320
  629    H    LEU  87             H      LEU  87  -2.954   2.753 -10.640
  630    HA   LEU  87            HA      LEU  87  -2.106   0.560 -12.356
  631   1HB   LEU  87           2HB      LEU  87  -3.957  -0.745 -11.163
  632   2HB   LEU  87           1HB      LEU  87  -2.429  -0.546 -10.404
  633    HG   LEU  87            HG      LEU  87  -4.307  -0.275  -8.845
  634   1HD1  LEU  87          3HD1      LEU  87  -2.120   1.464  -9.179
  635   2HD1  LEU  87          2HD1      LEU  87  -3.491   2.437  -8.646
  636   3HD1  LEU  87          1HD1      LEU  87  -2.980   1.043  -7.700
  637   1HD2  LEU  87          1HD2      LEU  87  -5.715   0.806 -10.750
  638   2HD2  LEU  87          3HD2      LEU  87  -5.959   1.333  -9.089
  639   3HD2  LEU  87          2HD2      LEU  87  -4.987   2.308 -10.190
  640    NH1  ARG  88           NH1      ARG  88  -0.380   3.100 -19.051
  641    NH2  ARG  88           NH2      ARG  88  -0.284   1.549 -20.691
  642    H    ARG  88             H      ARG  88  -2.856   0.339 -14.207
  643    HA   ARG  88            HA      ARG  88  -5.421   1.745 -14.845
  644   1HB   ARG  88           2HB      ARG  88  -4.488   2.341 -16.917
  645   2HB   ARG  88           1HB      ARG  88  -3.032   2.246 -15.950
  646   1HG   ARG  88           2HG      ARG  88  -2.486   0.066 -16.884
  647   2HG   ARG  88           1HG      ARG  88  -4.082  -0.080 -17.608
  648   1HD   ARG  88           2HD      ARG  88  -3.316   0.744 -19.427
  649   2HD   ARG  88           1HD      ARG  88  -3.074   2.304 -18.589
  650    HE   ARG  88            HE      ARG  88  -0.890   0.340 -18.309
  651   1HH1  ARG  88          2HH1      ARG  88  -0.670   3.373 -18.135
  652   2HH1  ARG  88          1HH1      ARG  88   0.132   3.739 -19.625
  653   1HH2  ARG  88          1HH2      ARG  88  -0.504   0.635 -21.033
  654   2HH2  ARG  88          2HH2      ARG  88   0.236   2.185 -21.261
  655    H    THR  89             H      THR  89  -6.890   0.869 -16.299
  656    HA   THR  89            HA      THR  89  -7.078  -2.054 -16.423
  657    HB   THR  89            HB      THR  89  -9.286  -1.732 -17.187
  658    HG1  THR  89           HG1      THR  89  -9.605  -0.500 -18.793
  659   1HG2  THR  89          2HG2      THR  89  -8.764  -0.510 -14.932
  660   2HG2  THR  89          1HG2      THR  89  -9.217   0.902 -15.863
  661   3HG2  THR  89          3HG2      THR  89 -10.370  -0.403 -15.658
  662    H    LYS  90             H      LYS  90  -5.473  -2.609 -17.831
  663    HA   LYS  90            HA      LYS  90  -4.555  -0.951 -19.934
  664   1HB   LYS  90           2HB      LYS  90  -3.581  -3.768 -19.777
  665   2HB   LYS  90           1HB      LYS  90  -2.692  -2.268 -19.978
  666   1HG   LYS  90           2HG      LYS  90  -2.037  -2.685 -17.832
  667   2HG   LYS  90           1HG      LYS  90  -3.565  -1.886 -17.444
  668   1HD   LYS  90           2HD      LYS  90  -3.865  -3.771 -16.292
  669   2HD   LYS  90           1HD      LYS  90  -4.506  -4.288 -17.830
  670   1HE   LYS  90           2HE      LYS  90  -1.622  -4.726 -17.046
  671   2HE   LYS  90           1HE      LYS  90  -2.883  -5.921 -16.749
  672   1HZ   LYS  90           1HZ      LYS  90  -3.398  -5.761 -19.185
  673   2HZ   LYS  90           3HZ      LYS  90  -1.968  -4.866 -19.364
  674   3HZ   LYS  90           2HZ      LYS  90  -1.899  -6.470 -18.806
  675    H    SER  91             H      SER  91  -4.043  -2.000 -22.048
  676    HA   SER  91            HA      SER  91  -6.148  -3.820 -23.110
  677   1HB   SER  91           2HB      SER  91  -7.230  -1.843 -23.747
  678   2HB   SER  91           1HB      SER  91  -5.780  -0.959 -23.834
  679    HG   SER  91            HG      SER  91  -5.886  -1.221 -25.884
  680    H    THR  92             H      THR  92  -5.580  -4.147 -25.620
  681    HA   THR  92            HA      THR  92  -2.677  -4.910 -25.682
  682    HB   THR  92            HB      THR  92  -3.284  -6.458 -27.437
  683    HG1  THR  92           HG1      THR  92  -5.734  -5.037 -27.426
  684   1HG2  THR  92          1HG2      THR  92  -5.355  -6.320 -25.225
  685   2HG2  THR  92          3HG2      THR  92  -5.201  -7.692 -26.330
  686   3HG2  THR  92          2HG2      THR  92  -3.868  -7.278 -25.251
  687    H    GLY  93             H      GLY  93  -5.032  -2.910 -27.337
  688   1HA   GLY  93           2HA      GLY  93  -3.265  -1.001 -28.379
  689   2HA   GLY  93           1HA      GLY  93  -3.443  -2.220 -29.647
  690    H    GLY  94             H      GLY  94  -5.760  -2.849 -30.149
  691   1HA   GLY  94           2HA      GLY  94  -7.332  -0.465 -30.693
  692   2HA   GLY  94           1HA      GLY  94  -7.816  -2.126 -31.050
  693    H    ALA  95             H      ALA  95  -7.216  -2.907 -28.163
  694    HA   ALA  95            HA      ALA  95  -9.864  -2.552 -27.113
  695   1HB   ALA  95           3HB      ALA  95  -7.494  -3.996 -26.343
  696   2HB   ALA  95           2HB      ALA  95  -8.104  -3.110 -24.945
  697   3HB   ALA  95           1HB      ALA  95  -9.155  -4.236 -25.803
  698    HA   PRO  96            HA      PRO  96  -9.444   1.242 -24.946
  699   1HB   PRO  96           2HB      PRO  96 -11.420   0.902 -23.128
  700   2HB   PRO  96           1HB      PRO  96 -11.752   0.977 -24.862
  701   1HG   PRO  96           2HG      PRO  96 -11.867  -1.395 -23.060
  702   2HG   PRO  96           1HG      PRO  96 -12.626  -1.162 -24.640
  703   1HD   PRO  96           2HD      PRO  96 -10.171  -2.577 -24.044
  704   2HD   PRO  96           1HD      PRO  96 -10.992  -2.377 -25.605
  705    H    THR  97             H      THR  97  -8.230   2.152 -23.245
  706    HA   THR  97            HA      THR  97  -7.774   0.435 -20.829
  707    HB   THR  97            HB      THR  97  -5.707   1.732 -20.345
  708    HG1  THR  97           HG1      THR  97  -5.120   3.374 -21.611
  709   1HG2  THR  97          1HG2      THR  97  -5.884  -0.287 -22.016
  710   2HG2  THR  97          3HG2      THR  97  -5.405   0.925 -23.205
  711   3HG2  THR  97          2HG2      THR  97  -4.368   0.596 -21.816
  712    H    PHE  98             H      PHE  98  -7.858   1.560 -18.847
  713    HA   PHE  98            HA      PHE  98  -9.030   4.237 -18.780
  714   1HB   PHE  98           2HB      PHE  98 -10.146   1.801 -17.308
  715   2HB   PHE  98           1HB      PHE  98 -10.764   3.466 -17.252
  716    HD1  PHE  98           HD1      PHE  98 -10.799   4.379 -19.938
  717    HD2  PHE  98           HD2      PHE  98 -11.672   0.459 -18.494
  718    HE1  PHE  98           HE1      PHE  98 -12.216   3.985 -21.927
  719    HE2  PHE  98           HE2      PHE  98 -13.077   0.033 -20.506
  720    HZ   PHE  98            HZ      PHE  98 -13.351   1.807 -22.215
  721    H    ASN  99             H      ASN  99  -6.985   4.837 -18.029
  722    HA   ASN  99            HA      ASN  99  -5.617   3.387 -15.965
  723   1HB   ASN  99           2HB      ASN  99  -4.756   6.190 -16.528
  724   2HB   ASN  99           1HB      ASN  99  -3.783   4.737 -16.275
  725   1HD2  ASN  99          2HD2      ASN  99  -3.703   5.685 -19.939
  726   2HD2  ASN  99          1HD2      ASN  99  -3.377   6.550 -18.514
  727    H    VAL 100             H      VAL 100  -5.527   3.533 -13.915
  728    HA   VAL 100            HA      VAL 100  -7.150   5.554 -12.512
  729    HB   VAL 100            HB      VAL 100  -6.488   2.806 -11.376
  730   1HG1  VAL 100          2HG1      VAL 100  -7.516   4.814 -10.089
  731   2HG1  VAL 100          1HG1      VAL 100  -9.000   4.391 -10.933
  732   3HG1  VAL 100          3HG1      VAL 100  -8.217   3.213  -9.887
  733   1HG2  VAL 100          2HG2      VAL 100  -7.597   2.474 -13.608
  734   2HG2  VAL 100          1HG2      VAL 100  -8.615   1.947 -12.270
  735   3HG2  VAL 100          3HG2      VAL 100  -8.940   3.484 -13.074
  736    H    THR 101             H      THR 101  -6.266   6.480 -10.704
  737    HA   THR 101            HA      THR 101  -3.562   5.681  -9.907
  738    HB   THR 101            HB      THR 101  -4.814   8.438  -9.679
  739    HG1  THR 101           HG1      THR 101  -4.224   8.077 -11.790
  740   1HG2  THR 101          3HG2      THR 101  -2.803   7.235  -8.149
  741   2HG2  THR 101          2HG2      THR 101  -1.924   8.198  -9.342
  742   3HG2  THR 101          1HG2      THR 101  -3.114   8.966  -8.290
  743    H    VAL 102             H      VAL 102  -3.675   4.850  -7.899
  744    HA   VAL 102            HA      VAL 102  -6.108   5.320  -6.308
  745    HB   VAL 102            HB      VAL 102  -4.368   2.927  -6.852
  746   1HG1  VAL 102          2HG1      VAL 102  -4.623   3.239  -4.291
  747   2HG1  VAL 102          1HG1      VAL 102  -6.335   2.975  -4.535
  748   3HG1  VAL 102          3HG1      VAL 102  -5.179   1.710  -4.950
  749   1HG2  VAL 102          3HG2      VAL 102  -7.254   3.647  -6.873
  750   2HG2  VAL 102          2HG2      VAL 102  -6.248   3.062  -8.183
  751   3HG2  VAL 102          1HG2      VAL 102  -6.734   1.967  -6.894
  752    H    THR 103             H      THR 103  -5.813   6.512  -4.569
  753    HA   THR 103            HA      THR 103  -3.086   6.739  -3.454
  754    HB   THR 103            HB      THR 103  -4.084   8.764  -2.233
  755    HG1  THR 103           HG1      THR 103  -6.181   8.614  -2.623
  756   1HG2  THR 103          1HG2      THR 103  -3.318   8.459  -5.084
  757   2HG2  THR 103          3HG2      THR 103  -4.007  10.015  -4.607
  758   3HG2  THR 103          2HG2      THR 103  -2.550   9.398  -3.800
  759    H    LYS 104             H      LYS 104  -3.154   7.321  -1.043
  760    HA   LYS 104            HA      LYS 104  -5.106   5.629   0.442
  761   1HB   LYS 104           2HB      LYS 104  -3.081   4.276  -0.133
  762   2HB   LYS 104           1HB      LYS 104  -2.090   5.447   0.727
  763   1HG   LYS 104           2HG      LYS 104  -2.440   3.838   2.366
  764   2HG   LYS 104           1HG      LYS 104  -3.740   4.968   2.708
  765   1HD   LYS 104           2HD      LYS 104  -5.322   3.642   1.501
  766   2HD   LYS 104           1HD      LYS 104  -4.051   2.578   0.900
  767   1HE   LYS 104           2HE      LYS 104  -4.625   2.931   3.842
  768   2HE   LYS 104           1HE      LYS 104  -5.398   1.703   2.851
  769   1HZ   LYS 104           1HZ      LYS 104  -2.469   1.963   2.907
  770   2HZ   LYS 104           3HZ      LYS 104  -3.284   1.071   4.092
  771   3HZ   LYS 104           2HZ      LYS 104  -3.407   0.625   2.458
  772    H    THR 105             H      THR 105  -5.465   6.265   2.549
  773    HA   THR 105            HA      THR 105  -4.019   8.687   3.564
  774    HB   THR 105            HB      THR 105  -6.083   9.368   4.674
  775    HG1  THR 105           HG1      THR 105  -7.821   8.101   4.762
  776   1HG2  THR 105          2HG2      THR 105  -5.968   8.941   1.782
  777   2HG2  THR 105          1HG2      THR 105  -7.621   9.031   2.375
  778   3HG2  THR 105          3HG2      THR 105  -6.506  10.358   2.684
  779    H    ASP 106             H      ASP 106  -5.678   7.980   6.181
  780    HA   ASP 106            HA      ASP 106  -3.707   5.968   7.138
  781   1HB   ASP 106           2HB      ASP 106  -3.995   8.161   8.363
  782   2HB   ASP 106           1HB      ASP 106  -5.591   7.600   8.828
  783    H    LYS 107             H      LYS 107  -7.140   6.403   6.504
  784    HA   LYS 107            HA      LYS 107  -7.591   3.542   7.177
  785   1HB   LYS 107           2HB      LYS 107  -9.619   5.503   8.223
  786   2HB   LYS 107           1HB      LYS 107  -9.317   3.843   8.724
  787   1HG   LYS 107           2HG      LYS 107  -7.224   4.507   9.801
  788   2HG   LYS 107           1HG      LYS 107  -7.431   6.161   9.228
  789   1HD   LYS 107           2HD      LYS 107  -9.435   6.443  10.554
  790   2HD   LYS 107           1HD      LYS 107  -9.428   4.741  11.005
  791   1HE   LYS 107           2HE      LYS 107  -7.294   5.056  12.198
  792   2HE   LYS 107           1HE      LYS 107  -7.292   6.763  11.740
  793   1HZ   LYS 107           2HZ      LYS 107  -9.626   5.634  13.132
  794   2HZ   LYS 107           1HZ      LYS 107  -8.241   6.045  14.026
  795   3HZ   LYS 107           3HZ      LYS 107  -9.047   7.231  13.120
  796    H    THR 108             H      THR 108  -7.765   5.591   4.779
  797    HA   THR 108            HA      THR 108 -10.366   4.559   3.755
  798    HB   THR 108            HB      THR 108 -10.918   6.648   2.769
  799    HG1  THR 108           HG1      THR 108  -8.992   7.319   1.971
  800   1HG2  THR 108          2HG2      THR 108 -11.030   6.419   5.355
  801   2HG2  THR 108          1HG2      THR 108  -9.673   7.555   5.354
  802   3HG2  THR 108          3HG2      THR 108 -11.216   8.030   4.647
  803    H    LEU 109             H      LEU 109 -10.282   4.121   1.516
  804    HA   LEU 109            HA      LEU 109  -7.574   3.862   0.305
  805   1HB   LEU 109           2HB      LEU 109  -9.259   1.892   1.112
  806   2HB   LEU 109           1HB      LEU 109  -9.872   2.104  -0.499
  807    HG   LEU 109            HG      LEU 109  -7.802   0.432   0.268
  808   1HD1  LEU 109          1HD1      LEU 109  -9.327   0.890  -1.950
  809   2HD1  LEU 109          3HD1      LEU 109  -7.682   1.102  -2.546
  810   3HD1  LEU 109          2HD1      LEU 109  -8.142  -0.398  -1.738
  811   1HD2  LEU 109          3HD2      LEU 109  -6.275   2.333   0.415
  812   2HD2  LEU 109          2HD2      LEU 109  -5.793   1.178  -0.812
  813   3HD2  LEU 109          1HD2      LEU 109  -6.566   2.693  -1.277
  814    H    VAL 110             H      VAL 110  -7.723   5.880  -1.067
  815    HA   VAL 110            HA      VAL 110 -10.288   6.291  -2.504
  816    HB   VAL 110            HB      VAL 110  -7.833   7.938  -1.946
  817   1HG1  VAL 110          3HG1      VAL 110  -9.483   8.205  -4.461
  818   2HG1  VAL 110          2HG1      VAL 110  -8.823   9.628  -3.675
  819   3HG1  VAL 110          1HG1      VAL 110  -7.742   8.378  -4.261
  820   1HG2  VAL 110          1HG2      VAL 110 -10.372   7.897  -0.988
  821   2HG2  VAL 110          3HG2      VAL 110  -9.355   9.342  -0.981
  822   3HG2  VAL 110          2HG2      VAL 110 -10.554   9.104  -2.272
  823    H    LEU 111             H      LEU 111 -10.513   6.233  -4.695
  824    HA   LEU 111            HA      LEU 111  -8.276   5.184  -6.314
  825   1HB   LEU 111           2HB      LEU 111 -11.158   4.460  -6.905
  826   2HB   LEU 111           1HB      LEU 111  -9.700   3.683  -7.506
  827    HG   LEU 111            HG      LEU 111 -10.469   3.670  -4.606
  828   1HD1  LEU 111          2HD1      LEU 111 -11.521   2.078  -6.835
  829   2HD1  LEU 111          1HD1      LEU 111 -10.889   1.091  -5.511
  830   3HD1  LEU 111          3HD1      LEU 111 -12.159   2.278  -5.206
  831   1HD2  LEU 111          2HD2      LEU 111  -8.143   3.235  -5.159
  832   2HD2  LEU 111          1HD2      LEU 111  -8.910   1.823  -4.465
  833   3HD2  LEU 111          3HD2      LEU 111  -8.640   1.909  -6.206
  834    H    LEU 112             H      LEU 112  -8.216   6.082  -8.360
  835    HA   LEU 112            HA      LEU 112 -10.109   8.290  -8.975
  836   1HB   LEU 112           2HB      LEU 112  -7.627   8.793  -8.189
  837   2HB   LEU 112           1HB      LEU 112  -7.223   8.394  -9.825
  838    HG   LEU 112            HG      LEU 112  -7.492  10.725  -9.873
  839   1HD1  LEU 112          2HD1      LEU 112  -9.097   9.375 -11.484
  840   2HD1  LEU 112          1HD1      LEU 112 -10.366  10.056 -10.472
  841   3HD1  LEU 112          3HD1      LEU 112  -9.266  11.127 -11.349
  842   1HD2  LEU 112          2HD2      LEU 112  -8.518  10.565  -7.510
  843   2HD2  LEU 112          1HD2      LEU 112  -8.951  11.939  -8.524
  844   3HD2  LEU 112          3HD2      LEU 112 -10.064  10.585  -8.343
  845    H    MET 113             H      MET 113 -11.158   7.217 -10.649
  846    HA   MET 113            HA      MET 113  -9.569   5.465 -12.457
  847   1HB   MET 113           2HB      MET 113 -11.985   4.933 -11.680
  848   2HB   MET 113           1HB      MET 113 -12.462   6.017 -12.930
  849   1HG   MET 113           2HG      MET 113 -10.578   4.411 -14.165
  850   2HG   MET 113           1HG      MET 113 -11.483   3.307 -13.148
  851   1HE   MET 113           1HE      MET 113 -12.994   2.177 -13.709
  852   2HE   MET 113           3HE      MET 113 -14.564   2.991 -13.723
  853   3HE   MET 113           2HE      MET 113 -13.966   2.194 -15.176
  854    H    GLY 114             H      GLY 114  -9.304   5.821 -14.579
  855   1HA   GLY 114           2HA      GLY 114  -9.946   8.512 -15.583
  856   2HA   GLY 114           1HA      GLY 114  -8.357   7.811 -15.737
  857    H    LYS 115             H      LYS 115 -11.114   8.307 -17.337
  858    HA   LYS 115            HA      LYS 115 -10.828   6.015 -19.094
  859   1HB   LYS 115           2HB      LYS 115 -13.128   7.880 -18.603
  860   2HB   LYS 115           1HB      LYS 115 -13.008   6.947 -20.104
  861   1HG   LYS 115           2HG      LYS 115 -12.446   5.061 -18.119
  862   2HG   LYS 115           1HG      LYS 115 -13.736   6.023 -17.422
  863   1HD   LYS 115           2HD      LYS 115 -15.245   5.503 -19.149
  864   2HD   LYS 115           1HD      LYS 115 -13.951   5.014 -20.248
  865   1HE   LYS 115           2HE      LYS 115 -13.578   2.969 -19.091
  866   2HE   LYS 115           1HE      LYS 115 -14.447   3.521 -17.659
  867   1HZ   LYS 115           1HZ      LYS 115 -16.136   3.591 -19.957
  868   2HZ   LYS 115           3HZ      LYS 115 -15.469   2.044 -19.758
  869   3HZ   LYS 115           2HZ      LYS 115 -16.348   2.759 -18.491
  870    H    GLU 116             H      GLU 116 -10.869   6.501 -21.342
  871    HA   GLU 116            HA      GLU 116  -8.933   7.585 -22.611
  872   1HB   GLU 116           2HB      GLU 116 -10.921   6.855 -23.371
  873   2HB   GLU 116           1HB      GLU 116 -11.576   8.421 -23.253
  874   1HG   GLU 116           2HG      GLU 116 -10.083   9.261 -24.942
  875   2HG   GLU 116           1HG      GLU 116  -9.122   7.783 -24.886
  876    H    GLY 117             H      GLY 117  -8.116   9.297 -23.671
  877   1HA   GLY 117           2HA      GLY 117  -7.316  11.509 -23.836
  878   2HA   GLY 117           1HA      GLY 117  -8.737  12.058 -22.899
  879    H    VAL 118             H      VAL 118  -7.388   9.106 -21.794
  880    HA   VAL 118            HA      VAL 118  -6.473  10.321 -19.344
  881    HB   VAL 118            HB      VAL 118  -8.424   8.674 -19.772
  882   1HG1  VAL 118          1HG1      VAL 118  -7.140   6.998 -20.980
  883   2HG1  VAL 118          3HG1      VAL 118  -6.279   6.623 -19.478
  884   3HG1  VAL 118          2HG1      VAL 118  -8.052   6.413 -19.557
  885   1HG2  VAL 118          1HG2      VAL 118  -6.402   8.848 -17.573
  886   2HG2  VAL 118          3HG2      VAL 118  -8.164   8.978 -17.489
  887   3HG2  VAL 118          2HG2      VAL 118  -7.396   7.370 -17.499
  888    H    HIS 119             H      HIS 119  -4.343  10.788 -19.548
  889    HA   HIS 119            HA      HIS 119  -2.420   9.008 -20.843
  890   1HB   HIS 119           2HB      HIS 119  -2.197  11.511 -20.737
  891   2HB   HIS 119           1HB      HIS 119  -1.891  11.357 -19.009
  892    HD1  HIS 119           HD1      HIS 119   0.157   9.568 -18.460
  893    HD2  HIS 119           HD2      HIS 119   0.102  11.323 -22.236
  894    HE1  HIS 119           HE1      HIS 119   2.491   9.300 -19.405
  895    H    GLY 120             H      GLY 120  -3.327   9.883 -17.529
  896   1HA   GLY 120           2HA      GLY 120  -3.304   8.282 -15.707
  897   2HA   GLY 120           1HA      GLY 120  -2.033   7.387 -16.552
  898    H    GLY 121             H      GLY 121  -2.199  10.886 -15.908
  899   1HA   GLY 121           2HA      GLY 121   0.051  10.714 -13.949
  900   2HA   GLY 121           1HA      GLY 121   0.294  11.695 -15.399
  901    H    LEU 122             H      LEU 122  -2.195  12.840 -15.672
  902    HA   LEU 122            HA      LEU 122  -2.254  14.977 -13.768
  903   1HB   LEU 122           2HB      LEU 122  -4.587  14.285 -15.584
  904   2HB   LEU 122           1HB      LEU 122  -4.129  15.861 -14.974
  905    HG   LEU 122            HG      LEU 122  -3.449  16.054 -17.180
  906   1HD1  LEU 122          3HD1      LEU 122  -0.996  14.766 -15.944
  907   2HD1  LEU 122          2HD1      LEU 122  -1.005  15.762 -17.391
  908   3HD1  LEU 122          1HD1      LEU 122  -1.439  16.465 -15.831
  909   1HD2  LEU 122          2HD2      LEU 122  -3.931  13.380 -17.319
  910   2HD2  LEU 122          1HD2      LEU 122  -3.219  14.325 -18.635
  911   3HD2  LEU 122          3HD2      LEU 122  -2.174  13.410 -17.551
  912    H    ILE 123             H      ILE 123  -3.904  11.925 -14.266
  913    HA   ILE 123            HA      ILE 123  -5.968  12.233 -12.287
  914    HB   ILE 123            HB      ILE 123  -4.506   9.813 -13.308
  915   1HG1  ILE 123          2HG1      ILE 123  -7.166  11.037 -14.172
  916   2HG1  ILE 123          1HG1      ILE 123  -5.646  11.184 -15.064
  917   1HG2  ILE 123          2HG2      ILE 123  -5.894   9.629 -11.082
  918   2HG2  ILE 123          1HG2      ILE 123  -7.291   9.790 -12.138
  919   3HG2  ILE 123          3HG2      ILE 123  -6.187   8.438 -12.344
  920   1HD1  ILE 123          3HD1      ILE 123  -6.647   8.479 -14.304
  921   2HD1  ILE 123          2HD1      ILE 123  -7.335   9.347 -15.658
  922   3HD1  ILE 123          1HD1      ILE 123  -5.627   8.964 -15.658
  923    H    ASN 124             H      ASN 124  -2.593  11.175 -12.310
  924    HA   ASN 124            HA      ASN 124  -2.398  10.263  -9.630
  925   1HB   ASN 124           2HB      ASN 124  -0.688  10.101 -11.551
  926   2HB   ASN 124           1HB      ASN 124  -0.177  11.705 -11.037
  927   1HD2  ASN 124          2HD2      ASN 124   0.880   8.442  -8.864
  928   2HD2  ASN 124          1HD2      ASN 124  -0.057   8.297 -10.272
  929    H    LYS 125             H      LYS 125  -2.417  13.401 -11.171
  930    HA   LYS 125            HA      LYS 125  -1.723  14.884  -8.625
  931   1HB   LYS 125           2HB      LYS 125  -2.412  15.588 -11.489
  932   2HB   LYS 125           1HB      LYS 125  -2.594  16.827 -10.238
  933   1HG   LYS 125           2HG      LYS 125  -0.057  15.363  -9.999
  934   2HG   LYS 125           1HG      LYS 125  -0.222  16.176 -11.556
  935   1HD   LYS 125           2HD      LYS 125  -0.772  17.578  -8.930
  936   2HD   LYS 125           1HD      LYS 125   0.822  17.567  -9.682
  937   1HE   LYS 125           2HE      LYS 125  -1.039  18.260 -11.724
  938   2HE   LYS 125           1HE      LYS 125  -1.442  19.235 -10.309
  939   1HZ   LYS 125           1HZ      LYS 125   1.041  19.679 -10.176
  940   2HZ   LYS 125           3HZ      LYS 125   1.129  19.078 -11.759
  941   3HZ   LYS 125           2HZ      LYS 125   0.182  20.449 -11.425
  942    H    LYS 126             H      LYS 126  -4.591  13.806 -10.364
  943    HA   LYS 126            HA      LYS 126  -6.454  15.447  -8.784
  944   1HB   LYS 126           2HB      LYS 126  -6.890  13.423 -10.986
  945   2HB   LYS 126           1HB      LYS 126  -8.167  14.395 -10.233
  946   1HG   LYS 126           2HG      LYS 126  -7.084  16.457 -10.889
  947   2HG   LYS 126           1HG      LYS 126  -5.679  15.589 -11.475
  948   1HD   LYS 126           2HD      LYS 126  -8.158  14.682 -12.715
  949   2HD   LYS 126           1HD      LYS 126  -7.826  16.379 -12.986
  950   1HE   LYS 126           2HE      LYS 126  -5.412  15.535 -13.524
  951   2HE   LYS 126           1HE      LYS 126  -6.227  14.003 -13.825
  952   1HZ   LYS 126           1HZ      LYS 126  -7.822  15.577 -15.178
  953   2HZ   LYS 126           3HZ      LYS 126  -6.435  16.543 -15.266
  954   3HZ   LYS 126           2HZ      LYS 126  -6.405  14.959 -15.871
  955    H    CYS 127             H      CYS 127  -4.919  12.487  -8.446
  956    HA   CYS 127            HA      CYS 127  -6.919  11.213  -6.724
  957   1HB   CYS 127           2HB      CYS 127  -5.291   9.944  -8.338
  958   2HB   CYS 127           1HB      CYS 127  -4.099  10.245  -7.102
  959    HG   CYS 127            HG      CYS 127  -6.479   9.105  -5.753
  960    OH   TYR 128            OH      TYR 128   2.158  15.444  -2.227
  961    H    TYR 128             H      TYR 128  -3.948  12.987  -6.832
  962    HA   TYR 128            HA      TYR 128  -3.171  12.827  -4.084
  963   1HB   TYR 128           2HB      TYR 128  -2.018  13.705  -6.337
  964   2HB   TYR 128           1HB      TYR 128  -2.746  15.226  -5.871
  965    HD1  TYR 128           HD1      TYR 128  -1.500  12.902  -3.235
  966    HD2  TYR 128           HD2      TYR 128  -0.612  16.262  -5.770
  967    HE1  TYR 128           HE1      TYR 128   0.475  13.423  -1.837
  968    HE2  TYR 128           HE2      TYR 128   1.360  16.798  -4.354
  969    HH   TYR 128            HH      TYR 128   2.028  15.064  -1.353
  970    H    GLU 129             H      GLU 129  -5.394  14.836  -6.033
  971    HA   GLU 129            HA      GLU 129  -6.085  16.665  -3.819
  972   1HB   GLU 129           2HB      GLU 129  -7.495  16.270  -6.475
  973   2HB   GLU 129           1HB      GLU 129  -7.662  17.649  -5.390
  974   1HG   GLU 129           2HG      GLU 129  -4.858  17.162  -6.036
  975   2HG   GLU 129           1HG      GLU 129  -5.816  17.395  -7.495
  976    H    MET 130             H      MET 130  -7.535  13.814  -5.361
  977    HA   MET 130            HA      MET 130 -10.118  13.764  -4.097
  978   1HB   MET 130           2HB      MET 130  -8.829  12.262  -5.998
  979   2HB   MET 130           1HB      MET 130  -8.530  11.224  -4.634
  980   1HG   MET 130           2HG      MET 130 -11.093  11.646  -6.205
  981   2HG   MET 130           1HG      MET 130 -10.502  10.204  -5.350
  982   1HE   MET 130           3HE      MET 130 -13.238  11.198  -5.778
  983   2HE   MET 130           2HE      MET 130 -13.252   9.863  -4.632
  984   3HE   MET 130           1HE      MET 130 -14.135  11.336  -4.252
  985    H    ALA 131             H      ALA 131  -6.959  12.459  -3.178
  986    HA   ALA 131            HA      ALA 131  -7.730  11.653  -0.464
  987   1HB   ALA 131           1HB      ALA 131  -5.072  11.632  -1.958
  988   2HB   ALA 131           3HB      ALA 131  -5.299  11.046  -0.300
  989   3HB   ALA 131           2HB      ALA 131  -6.133  10.257  -1.626
  990    H    SER 132             H      SER 132  -6.525  14.530  -2.012
  991    HA   SER 132            HA      SER 132  -4.940  15.577   0.133
  992   1HB   SER 132           2HB      SER 132  -5.261  17.781  -0.834
  993   2HB   SER 132           1HB      SER 132  -5.022  16.657  -2.151
  994    HG   SER 132            HG      SER 132  -6.847  18.205  -2.287
  995    H    HIS 133             H      HIS 133  -8.440  15.414  -0.556
  996    HA   HIS 133            HA      HIS 133  -8.998  17.032   1.832
  997   1HB   HIS 133           2HB      HIS 133 -10.548  16.777  -0.263
  998   2HB   HIS 133           1HB      HIS 133 -11.180  15.368   0.626
  999    HD1  HIS 133           HD1      HIS 133 -11.202  19.082   0.593
 1000    HD2  HIS 133           HD2      HIS 133 -12.119  16.059   3.309
 1001    HE1  HIS 133           HE1      HIS 133 -12.470  20.182   2.492
 1002    H    LEU 134             H      LEU 134  -8.953  13.541   0.878
 1003    HA   LEU 134            HA      LEU 134  -9.985  12.698   3.491
 1004   1HB   LEU 134           2HB      LEU 134  -8.421  11.293   1.356
 1005   2HB   LEU 134           1HB      LEU 134  -8.821  10.510   2.883
 1006    HG   LEU 134            HG      LEU 134 -11.214  11.673   2.131
 1007   1HD1  LEU 134          2HD1      LEU 134  -9.596  11.221  -0.239
 1008   2HD1  LEU 134          1HD1      LEU 134 -11.100  10.322  -0.283
 1009   3HD1  LEU 134          3HD1      LEU 134 -11.125  12.065  -0.077
 1010   1HD2  LEU 134          2HD2      LEU 134 -10.230   8.863   1.591
 1011   2HD2  LEU 134          1HD2      LEU 134 -10.899   9.434   3.118
 1012   3HD2  LEU 134          3HD2      LEU 134 -11.922   9.343   1.684
 1013    NH1  ARG 135           NH2      ARG 135  -1.350  13.957   6.599
 1014    NH2  ARG 135           NH1      ARG 135   0.219  13.020   5.276
 1015    H    ARG 135             H      ARG 135  -7.061  14.099   2.667
 1016    HA   ARG 135            HA      ARG 135  -5.530  12.939   4.910
 1017   1HB   ARG 135           2HB      ARG 135  -4.925  14.815   2.640
 1018   2HB   ARG 135           1HB      ARG 135  -3.947  14.929   4.100
 1019   1HG   ARG 135           2HG      ARG 135  -4.447  12.254   2.823
 1020   2HG   ARG 135           1HG      ARG 135  -3.176  13.311   2.208
 1021   1HD   ARG 135           2HD      ARG 135  -3.418  12.516   5.123
 1022   2HD   ARG 135           1HD      ARG 135  -2.399  11.666   3.959
 1023    HE   ARG 135            HE      ARG 135  -1.674  14.371   3.768
 1024   1HH1  ARG 135          1HH2      ARG 135  -2.261  14.352   6.716
 1025   2HH1  ARG 135          2HH2      ARG 135  -0.734  13.881   7.383
 1026   1HH2  ARG 135          2HH1      ARG 135   0.511  12.693   4.378
 1027   2HH2  ARG 135          1HH1      ARG 135   0.838  12.953   6.058
 1028    NH1  ARG 136           NH2      ARG 136  -4.145  21.455   5.615
 1029    NH2  ARG 136           NH1      ARG 136  -5.596  23.112   6.107
 1030    H    ARG 136             H      ARG 136  -7.050  15.907   3.786
 1031    HA   ARG 136            HA      ARG 136  -6.641  17.334   6.277
 1032   1HB   ARG 136           2HB      ARG 136  -8.204  17.842   3.764
 1033   2HB   ARG 136           1HB      ARG 136  -8.454  18.855   5.188
 1034   1HG   ARG 136           2HG      ARG 136  -5.699  18.772   5.020
 1035   2HG   ARG 136           1HG      ARG 136  -6.174  18.775   3.321
 1036   1HD   ARG 136           2HD      ARG 136  -6.253  21.038   3.631
 1037   2HD   ARG 136           1HD      ARG 136  -7.851  20.679   4.289
 1038    HE   ARG 136            HE      ARG 136  -6.820  20.731   6.549
 1039   1HH1  ARG 136          1HH2      ARG 136  -3.969  20.497   5.389
 1040   2HH1  ARG 136          2HH2      ARG 136  -3.384  22.098   5.689
 1041   1HH2  ARG 136          2HH1      ARG 136  -6.533  23.426   6.257
 1042   2HH2  ARG 136          1HH1      ARG 136  -4.835  23.756   6.180
 1043    H    SER 137             H      SER 137  -8.606  14.782   5.372
 1044    HA   SER 137            HA      SER 137 -11.010  15.482   6.819
 1045   1HB   SER 137           2HB      SER 137 -11.791  13.360   6.076
 1046   2HB   SER 137           1HB      SER 137 -10.738  13.865   4.783
 1047    HG   SER 137            HG      SER 137 -10.288  11.729   5.396
 1048    H    GLN 138             H      GLN 138  -7.863  14.092   7.517
 1049    HA   GLN 138            HA      GLN 138  -6.897  13.513   9.591
 1050   1HB   GLN 138           2HB      GLN 138  -8.812  15.266  10.391
 1051   2HB   GLN 138           1HB      GLN 138  -9.422  13.798  11.152
 1052   1HG   GLN 138           2HG      GLN 138  -7.963  14.744  12.762
 1053   2HG   GLN 138           1HG      GLN 138  -7.024  13.454  12.012
 1054   1HE2  GLN 138          2HE2      GLN 138  -6.068  17.358  11.140
 1055   2HE2  GLN 138          1HE2      GLN 138  -7.631  16.990  11.686
 1056    OH   TYR 139            OH      TYR 139 -15.269   9.277   8.917
 1057    H    TYR 139             H      TYR 139  -8.401  11.695   7.771
 1058    HA   TYR 139            HA      TYR 139  -9.507   9.647   9.593
 1059   1HB   TYR 139           2HB      TYR 139  -9.627  10.228   6.700
 1060   2HB   TYR 139           1HB      TYR 139  -9.463   8.514   7.079
 1061    HD1  TYR 139           HD1      TYR 139 -10.929   7.978   9.419
 1062    HD2  TYR 139           HD2      TYR 139 -11.848  10.839   6.350
 1063    HE1  TYR 139           HE1      TYR 139 -13.323   7.894  10.056
 1064    HE2  TYR 139           HE2      TYR 139 -14.238  10.755   6.989
 1065    HH   TYR 139            HH      TYR 139 -15.488   8.369   9.135
   
  Start of MODEL          20
 Raw file had 1065 H/Q atoms
  Start of MODEL   20
    1   1H    ALA   1            2H      ALA   1 -19.509  17.040   5.218
    2   2H    ALA   1            1H      ALA   1 -19.676  15.357   5.051
    3   3H    ALA   1            3H      ALA   1 -19.148  16.015   6.522
    4    HA   ALA   1            HA      ALA   1 -17.067  16.602   5.681
    5   1HB   ALA   1           1HB      ALA   1 -17.679  14.066   5.901
    6   2HB   ALA   1           3HB      ALA   1 -17.591  14.070   4.139
    7   3HB   ALA   1           2HB      ALA   1 -16.176  14.516   5.093
    8    H    GLY   2             H      GLY   2 -18.757  15.115   2.873
    9   1HA   GLY   2           2HA      GLY   2 -19.209  16.611   0.883
   10   2HA   GLY   2           1HA      GLY   2 -17.600  17.283   1.151
   11    CH2  TRP   3           CH2      TRP   3 -13.129  11.407   3.377
   12    H    TRP   3             H      TRP   3 -18.334  13.828   1.439
   13    HA   TRP   3            HA      TRP   3 -16.231  12.880  -0.108
   14   1HB   TRP   3           2HB      TRP   3 -18.753  11.791   0.711
   15   2HB   TRP   3           1HB      TRP   3 -17.887  10.928  -0.523
   16    HD1  TRP   3           HD1      TRP   3 -18.205   9.385   1.849
   17    HE1  TRP   3           HE1      TRP   3 -16.383   8.741   3.519
   18    HE3  TRP   3           HE3      TRP   3 -14.739  13.147   0.941
   19    HZ2  TRP   3           HZ2      TRP   3 -13.850   9.653   4.368
   20    HZ3  TRP   3           HZ3      TRP   3 -12.656  13.152   2.227
   21    HH2  TRP   3           HH2      TRP   3 -12.204  11.428   3.931
   22    H    ASN   4             H      ASN   4 -19.562  13.500  -1.163
   23    HA   ASN   4            HA      ASN   4 -19.301  12.631  -3.858
   24   1HB   ASN   4           2HB      ASN   4 -21.115  14.792  -2.759
   25   2HB   ASN   4           1HB      ASN   4 -21.330  13.959  -4.300
   26   1HD2  ASN   4          2HD2      ASN   4 -22.909  11.185  -2.826
   27   2HD2  ASN   4          1HD2      ASN   4 -22.534  12.046  -4.239
   28    H    ALA   5             H      ALA   5 -18.153  15.497  -2.379
   29    HA   ALA   5            HA      ALA   5 -17.827  17.102  -4.811
   30   1HB   ALA   5           2HB      ALA   5 -17.947  18.020  -2.406
   31   2HB   ALA   5           1HB      ALA   5 -16.292  17.440  -2.209
   32   3HB   ALA   5           3HB      ALA   5 -16.660  18.666  -3.421
   33    OH   TYR   6            OH      TYR   6 -13.528  17.881   1.002
   34    H    TYR   6             H      TYR   6 -15.874  14.894  -2.799
   35    HA   TYR   6            HA      TYR   6 -13.488  15.216  -4.473
   36   1HB   TYR   6           2HB      TYR   6 -14.078  12.956  -2.549
   37   2HB   TYR   6           1HB      TYR   6 -12.491  13.463  -3.149
   38    HD1  TYR   6           HD1      TYR   6 -11.710  15.858  -2.652
   39    HD2  TYR   6           HD2      TYR   6 -15.082  14.053  -0.829
   40    HE1  TYR   6           HE1      TYR   6 -11.763  17.678  -0.960
   41    HE2  TYR   6           HE2      TYR   6 -15.153  15.807   0.888
   42    HH   TYR   6            HH      TYR   6 -13.580  18.714   0.527
   43    H    ILE   7             H      ILE   7 -16.481  13.723  -4.853
   44    HA   ILE   7            HA      ILE   7 -15.559  11.815  -6.914
   45    HB   ILE   7            HB      ILE   7 -18.242  12.401  -5.706
   46   1HG1  ILE   7          2HG1      ILE   7 -16.570  10.904  -4.596
   47   2HG1  ILE   7          1HG1      ILE   7 -18.076  10.100  -4.989
   48   1HG2  ILE   7          1HG2      ILE   7 -17.594  10.888  -8.219
   49   2HG2  ILE   7          3HG2      ILE   7 -19.033  10.511  -7.266
   50   3HG2  ILE   7          2HG2      ILE   7 -18.837  12.117  -7.985
   51   1HD1  ILE   7          1HD1      ILE   7 -16.276   9.912  -7.214
   52   2HD1  ILE   7          3HD1      ILE   7 -15.462   9.362  -5.756
   53   3HD1  ILE   7          2HD1      ILE   7 -16.975   8.615  -6.255
   54    H    ASP   8             H      ASP   8 -16.930  14.997  -6.390
   55    HA   ASP   8            HA      ASP   8 -17.712  15.680  -8.987
   56   1HB   ASP   8           2HB      ASP   8 -17.144  17.140  -6.534
   57   2HB   ASP   8           1HB      ASP   8 -17.111  18.068  -7.974
   58    H    ASN   9             H      ASN   9 -14.686  15.199  -7.518
   59    HA   ASN   9            HA      ASN   9 -12.872  16.694  -8.925
   60   1HB   ASN   9           2HB      ASN   9 -11.697  15.441  -7.437
   61   2HB   ASN   9           1HB      ASN   9 -12.983  14.432  -7.195
   62   1HD2  ASN   9          2HD2      ASN   9 -11.275  11.435  -8.577
   63   2HD2  ASN   9          1HD2      ASN   9 -12.441  12.088  -7.479
   64    H    LEU  10             H      LEU  10 -14.104  13.678  -9.592
   65    HA   LEU  10            HA      LEU  10 -13.030  12.969 -12.023
   66   1HB   LEU  10           2HB      LEU  10 -15.672  12.398 -10.840
   67   2HB   LEU  10           1HB      LEU  10 -15.052  11.572 -12.244
   68    HG   LEU  10            HG      LEU  10 -14.383  10.139 -10.741
   69   1HD1  LEU  10          2HD1      LEU  10 -12.161  12.154 -10.445
   70   2HD1  LEU  10          1HD1      LEU  10 -12.067  10.529  -9.841
   71   3HD1  LEU  10          3HD1      LEU  10 -12.226  10.802 -11.562
   72   1HD2  LEU  10          2HD2      LEU  10 -14.523  12.335  -8.696
   73   2HD2  LEU  10          1HD2      LEU  10 -15.449  10.875  -8.741
   74   3HD2  LEU  10          3HD2      LEU  10 -13.756  10.860  -8.284
   75    H    MET  11             H      MET  11 -15.820  14.647 -11.168
   76    HA   MET  11            HA      MET  11 -16.634  14.725 -13.966
   77   1HB   MET  11           2HB      MET  11 -17.709  16.117 -11.487
   78   2HB   MET  11           1HB      MET  11 -18.572  15.864 -13.011
   79   1HG   MET  11           2HG      MET  11 -17.377  13.342 -11.572
   80   2HG   MET  11           1HG      MET  11 -18.926  14.064 -11.006
   81   1HE   MET  11           3HE      MET  11 -16.830  12.622 -13.502
   82   2HE   MET  11           2HE      MET  11 -17.836  11.177 -13.472
   83   3HE   MET  11           1HE      MET  11 -17.780  12.169 -14.925
   84    H    ALA  12             H      ALA  12 -14.910  16.794 -11.755
   85    HA   ALA  12            HA      ALA  12 -14.720  19.071 -13.511
   86   1HB   ALA  12           3HB      ALA  12 -13.652  18.466 -10.768
   87   2HB   ALA  12           2HB      ALA  12 -13.171  19.913 -11.657
   88   3HB   ALA  12           1HB      ALA  12 -14.865  19.665 -11.229
   89    H    ASP  13             H      ASP  13 -12.969  16.116 -13.393
   90    HA   ASP  13            HA      ASP  13 -10.349  17.370 -14.069
   91   1HB   ASP  13           2HB      ASP  13  -9.665  14.762 -14.166
   92   2HB   ASP  13           1HB      ASP  13  -9.717  15.674 -12.672
   93    H    GLY  14             H      GLY  14 -12.914  16.397 -16.024
   94   1HA   GLY  14           2HA      GLY  14 -12.949  15.429 -18.292
   95   2HA   GLY  14           1HA      GLY  14 -11.988  16.881 -18.543
   96    H    THR  15             H      THR  15 -11.071  13.981 -16.800
   97    HA   THR  15            HA      THR  15  -9.073  13.074 -18.755
   98    HB   THR  15            HB      THR  15  -8.542  14.261 -16.054
   99    HG1  THR  15           HG1      THR  15  -8.205  15.653 -17.722
  100   1HG2  THR  15          3HG2      THR  15  -7.027  12.199 -17.556
  101   2HG2  THR  15          2HG2      THR  15  -6.182  13.343 -16.498
  102   3HG2  THR  15          1HG2      THR  15  -7.433  12.276 -15.851
  103    H    CYS  16             H      CYS  16 -10.678  12.642 -15.683
  104    HA   CYS  16            HA      CYS  16 -10.008   9.832 -15.299
  105   1HB   CYS  16           2HB      CYS  16 -11.122  10.273 -13.230
  106   2HB   CYS  16           1HB      CYS  16 -10.855  11.895 -13.700
  107    HG   CYS  16            HG      CYS  16 -13.584  10.609 -13.495
  108    H    GLN  17             H      GLN  17 -12.217   8.588 -14.725
  109    HA   GLN  17            HA      GLN  17 -14.217   8.745 -16.812
  110   1HB   GLN  17           2HB      GLN  17 -12.058   7.371 -17.328
  111   2HB   GLN  17           1HB      GLN  17 -12.881   6.136 -16.425
  112   1HG   GLN  17           2HG      GLN  17 -14.629   7.397 -18.354
  113   2HG   GLN  17           1HG      GLN  17 -13.144   6.808 -19.123
  114   1HE2  GLN  17          2HE2      GLN  17 -15.614   3.971 -19.077
  115   2HE2  GLN  17          1HE2      GLN  17 -15.572   5.521 -19.770
  116    H    ASP  18             H      ASP  18 -12.766   6.835 -14.162
  117    HA   ASP  18            HA      ASP  18 -15.351   6.621 -12.761
  118   1HB   ASP  18           2HB      ASP  18 -14.236   4.487 -13.787
  119   2HB   ASP  18           1HB      ASP  18 -13.313   4.568 -12.316
  120    H    ALA  19             H      ALA  19 -14.811   5.954 -10.323
  121    HA   ALA  19            HA      ALA  19 -12.412   7.280  -9.142
  122   1HB   ALA  19           1HB      ALA  19 -14.923   8.663  -9.752
  123   2HB   ALA  19           3HB      ALA  19 -14.367   8.815  -8.071
  124   3HB   ALA  19           2HB      ALA  19 -13.298   9.204  -9.385
  125    H    ALA  20             H      ALA  20 -12.174   6.117  -7.039
  126    HA   ALA  20            HA      ALA  20 -14.787   5.666  -5.684
  127   1HB   ALA  20           1HB      ALA  20 -12.991   3.505  -6.537
  128   2HB   ALA  20           3HB      ALA  20 -13.984   3.315  -5.091
  129   3HB   ALA  20           2HB      ALA  20 -14.726   3.669  -6.644
  130    H    ILE  21             H      ILE  21 -14.627   6.635  -3.909
  131    HA   ILE  21            HA      ILE  21 -12.237   6.495  -2.186
  132    HB   ILE  21            HB      ILE  21 -14.990   7.738  -1.800
  133   1HG1  ILE  21          2HG1      ILE  21 -12.244   8.867  -2.447
  134   2HG1  ILE  21          1HG1      ILE  21 -13.685   8.927  -3.460
  135   1HG2  ILE  21          3HG2      ILE  21 -12.956   7.029   0.143
  136   2HG2  ILE  21          2HG2      ILE  21 -13.073   8.785   0.050
  137   3HG2  ILE  21          1HG2      ILE  21 -14.504   7.828   0.421
  138   1HD1  ILE  21          3HD1      ILE  21 -14.738  10.192  -1.444
  139   2HD1  ILE  21          2HD1      ILE  21 -13.063  10.452  -0.965
  140   3HD1  ILE  21          1HD1      ILE  21 -13.635  11.051  -2.515
  141    H    VAL  22             H      VAL  22 -12.131   4.630  -0.890
  142    HA   VAL  22            HA      VAL  22 -14.679   3.153  -0.456
  143    HB   VAL  22            HB      VAL  22 -11.942   1.970  -1.101
  144   1HG1  VAL  22          2HG1      VAL  22 -13.668   0.636   0.346
  145   2HG1  VAL  22          1HG1      VAL  22 -14.552   0.464  -1.166
  146   3HG1  VAL  22          3HG1      VAL  22 -12.911  -0.173  -1.026
  147   1HG2  VAL  22          2HG2      VAL  22 -13.794   3.142  -2.861
  148   2HG2  VAL  22          1HG2      VAL  22 -12.461   2.072  -3.299
  149   3HG2  VAL  22          3HG2      VAL  22 -14.072   1.412  -3.013
  150    H    GLY  23             H      GLY  23 -15.068   2.825   1.693
  151   1HA   GLY  23           2HA      GLY  23 -12.994   3.092   3.752
  152   2HA   GLY  23           1HA      GLY  23 -14.675   2.584   4.030
  153    OH   TYR  24            OH      TYR  24  -5.867   0.781   5.554
  154    H    TYR  24             H      TYR  24 -11.590   1.505   2.865
  155    HA   TYR  24            HA      TYR  24 -12.186  -1.253   2.401
  156   1HB   TYR  24           2HB      TYR  24  -9.989  -1.278   1.484
  157   2HB   TYR  24           1HB      TYR  24 -10.414   0.401   1.403
  158    HD1  TYR  24           HD1      TYR  24  -9.902   1.784   3.702
  159    HD2  TYR  24           HD2      TYR  24  -7.983  -1.810   2.498
  160    HE1  TYR  24           HE1      TYR  24  -8.006   2.282   5.221
  161    HE2  TYR  24           HE2      TYR  24  -6.081  -1.333   3.996
  162    HH   TYR  24            HH      TYR  24  -6.207   0.791   6.451
  163    H    LYS  25             H      LYS  25 -12.529  -0.243   5.305
  164    HA   LYS  25            HA      LYS  25 -10.517  -1.224   6.969
  165   1HB   LYS  25           2HB      LYS  25 -13.394  -0.673   7.389
  166   2HB   LYS  25           1HB      LYS  25 -12.396  -1.258   8.684
  167   1HG   LYS  25           2HG      LYS  25 -12.291   1.082   8.933
  168   2HG   LYS  25           1HG      LYS  25 -10.806   0.689   8.074
  169   1HD   LYS  25           2HD      LYS  25 -11.565   1.508   6.085
  170   2HD   LYS  25           1HD      LYS  25 -13.261   1.262   6.502
  171   1HE   LYS  25           2HE      LYS  25 -11.452   3.324   7.767
  172   2HE   LYS  25           1HE      LYS  25 -12.648   3.665   6.530
  173   1HZ   LYS  25           1HZ      LYS  25 -14.250   2.516   8.173
  174   2HZ   LYS  25           3HZ      LYS  25 -13.056   2.853   9.329
  175   3HZ   LYS  25           2HZ      LYS  25 -13.779   4.120   8.467
  176    H    ASP  26             H      ASP  26 -11.964  -2.997   8.677
  177    HA   ASP  26            HA      ASP  26 -11.381  -5.580   7.756
  178   1HB   ASP  26           2HB      ASP  26 -13.425  -6.272   9.243
  179   2HB   ASP  26           1HB      ASP  26 -11.968  -5.666   9.997
  180    H    SER  27             H      SER  27 -14.544  -4.042   7.707
  181    HA   SER  27            HA      SER  27 -15.421  -5.794   5.513
  182   1HB   SER  27           2HB      SER  27 -17.642  -4.676   6.131
  183   2HB   SER  27           1HB      SER  27 -17.027  -5.847   7.264
  184    HG   SER  27            HG      SER  27 -17.103  -4.276   8.653
  185    HA   PRO  28            HA      PRO  28 -14.331  -2.068   3.339
  186   1HB   PRO  28           2HB      PRO  28 -14.445  -3.125   0.816
  187   2HB   PRO  28           1HB      PRO  28 -13.039  -3.253   1.892
  188   1HG   PRO  28           2HG      PRO  28 -15.020  -5.333   1.183
  189   2HG   PRO  28           1HG      PRO  28 -13.387  -5.504   1.776
  190   1HD   PRO  28           2HD      PRO  28 -15.749  -5.830   3.254
  191   2HD   PRO  28           1HD      PRO  28 -14.092  -5.776   3.890
  192    H    SER  29             H      SER  29 -15.363  -0.605   1.901
  193    HA   SER  29            HA      SER  29 -17.957  -1.164   0.833
  194   1HB   SER  29           2HB      SER  29 -19.089   0.604   2.226
  195   2HB   SER  29           1HB      SER  29 -18.705  -0.877   3.094
  196    HG   SER  29            HG      SER  29 -17.970   0.808   4.327
  197    H    VAL  30             H      VAL  30 -18.840   0.832  -0.160
  198    HA   VAL  30            HA      VAL  30 -16.615   2.402  -1.224
  199    HB   VAL  30            HB      VAL  30 -19.414   1.779  -2.148
  200   1HG1  VAL  30          3HG1      VAL  30 -18.885   4.132  -2.696
  201   2HG1  VAL  30          2HG1      VAL  30 -17.388   3.604  -3.454
  202   3HG1  VAL  30          1HG1      VAL  30 -18.936   3.120  -4.134
  203   1HG2  VAL  30          3HG2      VAL  30 -16.895   0.521  -2.414
  204   2HG2  VAL  30          2HG2      VAL  30 -18.356   0.148  -3.315
  205   3HG2  VAL  30          1HG2      VAL  30 -17.192   1.294  -3.968
  206    CH2  TRP  31           CH2      TRP  31 -13.924   5.774   6.558
  207    H    TRP  31             H      TRP  31 -16.269   4.097   0.116
  208    HA   TRP  31            HA      TRP  31 -18.294   5.477   1.594
  209   1HB   TRP  31           2HB      TRP  31 -15.377   5.902   1.022
  210   2HB   TRP  31           1HB      TRP  31 -16.304   7.204   1.767
  211    HD1  TRP  31           HD1      TRP  31 -17.696   3.915   2.737
  212    HE1  TRP  31           HE1      TRP  31 -17.016   3.306   5.099
  213    HE3  TRP  31           HE3      TRP  31 -13.974   7.347   3.543
  214    HZ2  TRP  31           HZ2      TRP  31 -15.196   4.130   7.111
  215    HZ3  TRP  31           HZ3      TRP  31 -12.812   7.410   5.727
  216    HH2  TRP  31           HH2      TRP  31 -13.405   5.800   7.503
  217    H    ALA  32             H      ALA  32 -17.104   5.741  -1.655
  218    HA   ALA  32            HA      ALA  32 -19.192   7.403  -2.558
  219   1HB   ALA  32           2HB      ALA  32 -16.790   8.906  -1.570
  220   2HB   ALA  32           1HB      ALA  32 -17.660   9.517  -2.991
  221   3HB   ALA  32           3HB      ALA  32 -18.500   9.322  -1.448
  222    H    ALA  33             H      ALA  33 -18.938   5.825  -4.256
  223    HA   ALA  33            HA      ALA  33 -16.689   6.387  -6.124
  224   1HB   ALA  33           1HB      ALA  33 -16.645   4.051  -5.251
  225   2HB   ALA  33           3HB      ALA  33 -18.287   3.816  -5.851
  226   3HB   ALA  33           2HB      ALA  33 -16.968   4.094  -6.981
  227    H    VAL  34             H      VAL  34 -17.298   6.964  -8.174
  228    HA   VAL  34            HA      VAL  34 -19.851   7.976  -8.805
  229    HB   VAL  34            HB      VAL  34 -17.870   6.762 -10.804
  230   1HG1  VAL  34          1HG1      VAL  34 -20.358   7.480 -11.409
  231   2HG1  VAL  34          3HG1      VAL  34 -19.673   9.110 -11.337
  232   3HG1  VAL  34          2HG1      VAL  34 -19.014   7.917 -12.465
  233   1HG2  VAL  34          1HG2      VAL  34 -18.117   9.592  -9.683
  234   2HG2  VAL  34          3HG2      VAL  34 -16.818   8.458  -9.335
  235   3HG2  VAL  34          2HG2      VAL  34 -17.010   9.088 -10.964
  236    HA   PRO  35            HA      PRO  35 -21.782   3.857  -8.660
  237   1HB   PRO  35           2HB      PRO  35 -24.390   4.745  -8.565
  238   2HB   PRO  35           1HB      PRO  35 -23.328   4.611  -7.150
  239   1HG   PRO  35           2HG      PRO  35 -24.139   7.061  -8.673
  240   2HG   PRO  35           1HG      PRO  35 -23.726   6.892  -6.958
  241   1HD   PRO  35           2HD      PRO  35 -22.011   7.931  -8.913
  242   2HD   PRO  35           1HD      PRO  35 -21.491   7.298  -7.341
  243    H    GLY  36             H      GLY  36 -22.902   2.519 -10.082
  244   1HA   GLY  36           2HA      GLY  36 -24.195   2.020 -12.051
  245   2HA   GLY  36           1HA      GLY  36 -23.926   3.670 -12.615
  246    H    LYS  37             H      LYS  37 -20.941   3.212 -11.729
  247    HA   LYS  37            HA      LYS  37 -20.089   2.276 -14.371
  248   1HB   LYS  37           2HB      LYS  37 -18.445   3.349 -12.070
  249   2HB   LYS  37           1HB      LYS  37 -17.887   3.112 -13.724
  250   1HG   LYS  37           2HG      LYS  37 -20.099   5.005 -12.833
  251   2HG   LYS  37           1HG      LYS  37 -18.494   5.474 -13.395
  252   1HD   LYS  37           2HD      LYS  37 -19.000   4.389 -15.599
  253   2HD   LYS  37           1HD      LYS  37 -20.636   4.067 -15.026
  254   1HE   LYS  37           2HE      LYS  37 -20.678   6.107 -16.330
  255   2HE   LYS  37           1HE      LYS  37 -20.915   6.530 -14.634
  256   1HZ   LYS  37           1HZ      LYS  37 -18.260   6.551 -15.948
  257   2HZ   LYS  37           3HZ      LYS  37 -19.261   7.917 -15.872
  258   3HZ   LYS  37           2HZ      LYS  37 -18.680   7.212 -14.441
  259    H    THR  38             H      THR  38 -18.303   1.545 -11.313
  260    HA   THR  38            HA      THR  38 -18.741  -1.317 -11.523
  261    HB   THR  38            HB      THR  38 -16.445  -0.050 -12.901
  262    HG1  THR  38           HG1      THR  38 -17.484  -0.944 -14.442
  263   1HG2  THR  38          2HG2      THR  38 -16.243  -2.572 -11.328
  264   2HG2  THR  38          1HG2      THR  38 -15.445  -2.523 -12.892
  265   3HG2  THR  38          3HG2      THR  38 -14.994  -1.363 -11.635
  266    H    PHE  39             H      PHE  39 -16.517   1.192 -10.376
  267    HA   PHE  39            HA      PHE  39 -15.169  -0.248  -8.341
  268   1HB   PHE  39           2HB      PHE  39 -15.890   2.646  -8.614
  269   2HB   PHE  39           1HB      PHE  39 -14.930   2.006  -7.296
  270    HD1  PHE  39           HD2      PHE  39 -14.312   0.033 -10.185
  271    HD2  PHE  39           HD1      PHE  39 -13.290   3.801  -8.398
  272    HE1  PHE  39           HE2      PHE  39 -12.286   0.132 -11.529
  273    HE2  PHE  39           HE1      PHE  39 -11.227   3.891  -9.737
  274    HZ   PHE  39            HZ      PHE  39 -10.743   2.019 -11.302
  275    H    VAL  40             H      VAL  40 -18.130   1.607  -8.102
  276    HA   VAL  40            HA      VAL  40 -18.515   1.585  -5.342
  277    HB   VAL  40            HB      VAL  40 -19.917   3.003  -6.641
  278   1HG1  VAL  40          3HG1      VAL  40 -20.613   0.481  -8.128
  279   2HG1  VAL  40          2HG1      VAL  40 -21.610   1.928  -8.239
  280   3HG1  VAL  40          1HG1      VAL  40 -19.921   1.979  -8.757
  281   1HG2  VAL  40          3HG2      VAL  40 -20.949   1.294  -4.735
  282   2HG2  VAL  40          2HG2      VAL  40 -21.795   2.692  -5.405
  283   3HG2  VAL  40          1HG2      VAL  40 -22.079   1.087  -6.076
  284    H    ASN  41             H      ASN  41 -18.767  -1.023  -7.615
  285    HA   ASN  41            HA      ASN  41 -20.257  -2.725  -5.770
  286   1HB   ASN  41           2HB      ASN  41 -19.111  -3.110  -8.545
  287   2HB   ASN  41           1HB      ASN  41 -19.935  -4.360  -7.648
  288   1HD2  ASN  41          2HD2      ASN  41 -23.074  -2.378  -7.686
  289   2HD2  ASN  41          1HD2      ASN  41 -22.084  -3.072  -6.494
  290    H    ILE  42             H      ILE  42 -17.515  -1.589  -5.115
  291    HA   ILE  42            HA      ILE  42 -15.586  -3.695  -5.421
  292    HB   ILE  42            HB      ILE  42 -15.690  -0.992  -4.104
  293   1HG1  ILE  42          2HG1      ILE  42 -13.374  -2.269  -5.547
  294   2HG1  ILE  42          1HG1      ILE  42 -14.803  -1.784  -6.457
  295   1HG2  ILE  42          2HG2      ILE  42 -13.737  -3.161  -3.251
  296   2HG2  ILE  42          1HG2      ILE  42 -13.422  -1.443  -3.037
  297   3HG2  ILE  42          3HG2      ILE  42 -14.785  -2.195  -2.216
  298   1HD1  ILE  42          1HD1      ILE  42 -13.686   0.219  -4.556
  299   2HD1  ILE  42          3HD1      ILE  42 -12.739  -0.105  -6.014
  300   3HD1  ILE  42          2HD1      ILE  42 -14.407   0.462  -6.145
  301    H    THR  43             H      THR  43 -14.856  -4.986  -3.816
  302    HA   THR  43            HA      THR  43 -16.398  -5.560  -1.356
  303    HB   THR  43            HB      THR  43 -16.095  -8.004  -2.162
  304    HG1  THR  43           HG1      THR  43 -14.577  -7.638  -3.736
  305   1HG2  THR  43          2HG2      THR  43 -18.082  -6.107  -2.680
  306   2HG2  THR  43          1HG2      THR  43 -17.793  -6.930  -4.217
  307   3HG2  THR  43          3HG2      THR  43 -18.250  -7.865  -2.795
  308    HA   PRO  44            HA      PRO  44 -12.337  -6.385   0.376
  309   1HB   PRO  44           2HB      PRO  44 -12.451  -8.808   1.529
  310   2HB   PRO  44           1HB      PRO  44 -13.105  -7.360   2.252
  311   1HG   PRO  44           2HG      PRO  44 -14.549  -9.617   0.930
  312   2HG   PRO  44           1HG      PRO  44 -15.115  -8.519   2.204
  313   1HD   PRO  44           2HD      PRO  44 -15.821  -8.323  -0.473
  314   2HD   PRO  44           1HD      PRO  44 -15.955  -7.001   0.681
  315    H    ALA  45             H      ALA  45 -13.291  -8.123  -2.189
  316    HA   ALA  45            HA      ALA  45 -10.992  -9.872  -2.484
  317   1HB   ALA  45           2HB      ALA  45 -13.520  -9.349  -3.952
  318   2HB   ALA  45           1HB      ALA  45 -12.155  -9.978  -4.880
  319   3HB   ALA  45           3HB      ALA  45 -12.789 -10.897  -3.514
  320    H    GLU  46             H      GLU  46 -12.483  -7.452  -4.500
  321    HA   GLU  46            HA      GLU  46 -10.157  -6.754  -6.018
  322   1HB   GLU  46           2HB      GLU  46 -11.459  -4.412  -6.217
  323   2HB   GLU  46           1HB      GLU  46 -11.984  -5.825  -7.113
  324   1HG   GLU  46           2HG      GLU  46 -13.058  -5.591  -4.380
  325   2HG   GLU  46           1HG      GLU  46 -13.561  -4.314  -5.483
  326    H    VAL  47             H      VAL  47 -11.380  -5.588  -2.988
  327    HA   VAL  47            HA      VAL  47  -9.287  -3.642  -2.629
  328    HB   VAL  47            HB      VAL  47 -11.769  -4.329  -1.305
  329   1HG1  VAL  47          3HG1      VAL  47 -10.007  -4.680   0.508
  330   2HG1  VAL  47          2HG1      VAL  47  -9.752  -2.944   0.349
  331   3HG1  VAL  47          1HG1      VAL  47 -11.323  -3.565   0.826
  332   1HG2  VAL  47          1HG2      VAL  47 -11.007  -2.262  -2.682
  333   2HG2  VAL  47          3HG2      VAL  47 -12.039  -2.017  -1.269
  334   3HG2  VAL  47          2HG2      VAL  47 -10.280  -1.752  -1.130
  335    H    GLY  48             H      GLY  48  -9.874  -6.963  -1.802
  336   1HA   GLY  48           2HA      GLY  48  -8.041  -7.423   0.284
  337   2HA   GLY  48           1HA      GLY  48  -8.405  -8.600  -0.970
  338    H    VAL  49             H      VAL  49  -7.405  -6.893  -3.104
  339    HA   VAL  49            HA      VAL  49  -4.502  -7.364  -2.708
  340    HB   VAL  49            HB      VAL  49  -5.544  -8.441  -4.694
  341   1HG1  VAL  49          2HG1      VAL  49  -7.076  -6.354  -5.034
  342   2HG1  VAL  49          1HG1      VAL  49  -5.705  -5.706  -5.933
  343   3HG1  VAL  49          3HG1      VAL  49  -6.468  -7.206  -6.451
  344   1HG2  VAL  49          3HG2      VAL  49  -3.452  -6.296  -5.202
  345   2HG2  VAL  49          2HG2      VAL  49  -3.161  -7.980  -4.760
  346   3HG2  VAL  49          1HG2      VAL  49  -3.834  -7.589  -6.341
  347    H    LEU  50             H      LEU  50  -6.745  -4.831  -3.489
  348    HA   LEU  50            HA      LEU  50  -4.880  -2.767  -4.130
  349   1HB   LEU  50           2HB      LEU  50  -7.665  -2.983  -3.305
  350   2HB   LEU  50           1HB      LEU  50  -6.937  -1.466  -3.069
  351    HG   LEU  50            HG      LEU  50  -6.864  -2.837  -5.716
  352   1HD1  LEU  50          3HD1      LEU  50  -9.030  -1.055  -4.475
  353   2HD1  LEU  50          2HD1      LEU  50  -8.898  -1.377  -6.216
  354   3HD1  LEU  50          1HD1      LEU  50  -9.230  -2.703  -5.106
  355   1HD2  LEU  50          3HD2      LEU  50  -5.444  -0.769  -5.056
  356   2HD2  LEU  50          2HD2      LEU  50  -6.406  -0.642  -6.527
  357   3HD2  LEU  50          1HD2      LEU  50  -6.973   0.112  -5.031
  358    H    VAL  51             H      VAL  51  -5.658  -4.330  -1.194
  359    HA   VAL  51            HA      VAL  51  -4.183  -2.323   0.373
  360    HB   VAL  51            HB      VAL  51  -6.007  -2.099   1.950
  361   1HG1  VAL  51          1HG1      VAL  51  -6.186  -0.929  -0.304
  362   2HG1  VAL  51          3HG1      VAL  51  -7.397  -2.150  -0.686
  363   3HG1  VAL  51          2HG1      VAL  51  -7.645  -1.053   0.665
  364   1HG2  VAL  51          1HG2      VAL  51  -6.708  -4.723   1.013
  365   2HG2  VAL  51          3HG2      VAL  51  -7.373  -3.849   2.394
  366   3HG2  VAL  51          2HG2      VAL  51  -8.076  -3.659   0.802
  367    H    GLY  52             H      GLY  52  -4.894  -5.641  -0.150
  368   1HA   GLY  52           2HA      GLY  52  -4.514  -6.808   2.413
  369   2HA   GLY  52           1HA      GLY  52  -4.133  -7.621   0.905
  370    H    LYS  53             H      LYS  53  -2.218  -8.510   1.200
  371    HA   LYS  53            HA      LYS  53  -0.125  -7.598   2.873
  372   1HB   LYS  53           2HB      LYS  53   1.203  -9.415   1.740
  373   2HB   LYS  53           1HB      LYS  53  -0.306  -9.943   2.472
  374   1HG   LYS  53           2HG      LYS  53  -1.115 -10.638   0.482
  375   2HG   LYS  53           1HG      LYS  53  -0.773  -9.073  -0.256
  376   1HD   LYS  53           2HD      LYS  53   0.671 -10.352  -1.504
  377   2HD   LYS  53           1HD      LYS  53   1.738 -10.021  -0.140
  378   1HE   LYS  53           2HE      LYS  53   1.883 -12.364  -0.410
  379   2HE   LYS  53           1HE      LYS  53   0.734 -12.164   0.910
  380   1HZ   LYS  53           1HZ      LYS  53  -0.955 -12.111  -1.089
  381   2HZ   LYS  53           3HZ      LYS  53   0.267 -13.008  -1.851
  382   3HZ   LYS  53           2HZ      LYS  53  -0.430 -13.580  -0.410
  383    H    ASP  54             H      ASP  54  -1.006  -6.355  -0.016
  384    HA   ASP  54            HA      ASP  54   0.616  -5.853  -1.932
  385   1HB   ASP  54           2HB      ASP  54  -1.143  -4.249  -1.353
  386   2HB   ASP  54           1HB      ASP  54  -0.199  -3.665   0.011
  387    NH1  ARG  55           NH1      ARG  55   7.077  -1.733   2.627
  388    NH2  ARG  55           NH2      ARG  55   5.558  -2.077   4.266
  389    H    ARG  55             H      ARG  55   2.775  -6.242  -2.011
  390    HA   ARG  55            HA      ARG  55   4.633  -4.373  -0.975
  391   1HB   ARG  55           2HB      ARG  55   4.057  -6.149   0.895
  392   2HB   ARG  55           1HB      ARG  55   5.281  -7.077   0.030
  393   1HG   ARG  55           2HG      ARG  55   6.491  -5.872   1.668
  394   2HG   ARG  55           1HG      ARG  55   6.734  -4.964   0.176
  395   1HD   ARG  55           2HD      ARG  55   5.502  -3.185   0.903
  396   2HD   ARG  55           1HD      ARG  55   4.340  -4.204   1.753
  397    HE   ARG  55            HE      ARG  55   6.425  -4.492   3.392
  398   1HH1  ARG  55          2HH1      ARG  55   7.599  -2.075   1.845
  399   2HH1  ARG  55          1HH1      ARG  55   7.192  -0.788   2.931
  400   1HH2  ARG  55          1HH2      ARG  55   4.914  -2.679   4.738
  401   2HH2  ARG  55          2HH2      ARG  55   5.684  -1.136   4.580
  402    H    SER  56             H      SER  56   3.958  -6.942  -3.133
  403    HA   SER  56            HA      SER  56   6.227  -6.379  -4.763
  404   1HB   SER  56           2HB      SER  56   7.494  -7.615  -3.158
  405   2HB   SER  56           1HB      SER  56   6.329  -8.928  -3.186
  406    HG   SER  56            HG      SER  56   8.409  -8.374  -4.868
  407    H    SER  57             H      SER  57   4.098  -8.971  -3.919
  408    HA   SER  57            HA      SER  57   3.834 -10.399  -6.220
  409   1HB   SER  57           2HB      SER  57   1.438 -10.818  -5.472
  410   2HB   SER  57           1HB      SER  57   2.720 -11.204  -4.333
  411    HG   SER  57            HG      SER  57   2.151  -9.548  -3.117
  412    H    PHE  58             H      PHE  58   0.775  -8.877  -5.924
  413    HA   PHE  58            HA      PHE  58   0.097  -8.655  -8.519
  414   1HB   PHE  58           2HB      PHE  58  -1.591  -7.034  -8.006
  415   2HB   PHE  58           1HB      PHE  58  -1.416  -8.097  -6.631
  416    HD1  PHE  58           HD2      PHE  58  -0.039  -4.832  -7.901
  417    HD2  PHE  58           HD1      PHE  58  -1.316  -7.143  -4.520
  418    HE1  PHE  58           HE2      PHE  58   0.301  -2.916  -6.449
  419    HE2  PHE  58           HE1      PHE  58  -1.010  -5.153  -3.086
  420    HZ   PHE  58            HZ      PHE  58  -0.215  -3.038  -4.095
  421    OH   TYR  59            OH      TYR  59   3.849  -3.250  -2.928
  422    H    TYR  59             H      TYR  59   2.635  -6.477  -7.331
  423    HA   TYR  59            HA      TYR  59   2.197  -4.379  -9.116
  424   1HB   TYR  59           2HB      TYR  59   4.962  -5.326  -8.572
  425   2HB   TYR  59           1HB      TYR  59   4.414  -3.696  -8.930
  426    HD1  TYR  59           HD1      TYR  59   2.120  -3.463  -7.154
  427    HD2  TYR  59           HD2      TYR  59   6.017  -5.081  -6.459
  428    HE1  TYR  59           HE1      TYR  59   1.954  -2.833  -4.748
  429    HE2  TYR  59           HE2      TYR  59   5.870  -4.447  -4.091
  430    HH   TYR  59            HH      TYR  59   4.445  -2.510  -2.791
  431    H    VAL  60             H      VAL  60   3.007  -7.486  -9.849
  432    HA   VAL  60            HA      VAL  60   4.040  -6.925 -12.483
  433    HB   VAL  60            HB      VAL  60   4.370  -9.327 -12.551
  434   1HG1  VAL  60          2HG1      VAL  60   5.268  -7.857 -10.093
  435   2HG1  VAL  60          1HG1      VAL  60   5.867  -9.480 -10.475
  436   3HG1  VAL  60          3HG1      VAL  60   6.177  -8.144 -11.585
  437   1HG2  VAL  60          3HG2      VAL  60   2.751  -9.291 -10.035
  438   2HG2  VAL  60          2HG2      VAL  60   2.616 -10.363 -11.416
  439   3HG2  VAL  60          1HG2      VAL  60   3.950 -10.550 -10.285
  440    H    ASN  61             H      ASN  61   1.193  -8.539 -10.993
  441    HA   ASN  61            HA      ASN  61   0.023  -8.950 -13.600
  442   1HB   ASN  61           2HB      ASN  61  -1.886  -9.907 -12.220
  443   2HB   ASN  61           1HB      ASN  61  -0.403 -10.776 -12.232
  444   1HD2  ASN  61          2HD2      ASN  61   0.080 -10.581  -8.802
  445   2HD2  ASN  61          1HD2      ASN  61   0.657 -11.148 -10.292
  446    H    GLY  62             H      GLY  62  -1.137  -7.238 -10.639
  447   1HA   GLY  62           2HA      GLY  62  -1.787  -4.817 -11.204
  448   2HA   GLY  62           1HA      GLY  62  -2.844  -5.582 -12.408
  449    H    LEU  63             H      LEU  63  -3.660  -3.968 -10.088
  450    HA   LEU  63            HA      LEU  63  -4.773  -5.794  -8.085
  451   1HB   LEU  63           2HB      LEU  63  -5.615  -2.905  -8.457
  452   2HB   LEU  63           1HB      LEU  63  -5.690  -3.860  -6.975
  453    HG   LEU  63            HG      LEU  63  -3.026  -3.304  -8.284
  454   1HD1  LEU  63          1HD1      LEU  63  -4.768  -1.261  -7.630
  455   2HD1  LEU  63          3HD1      LEU  63  -3.870  -1.473  -6.125
  456   3HD1  LEU  63          2HD1      LEU  63  -3.014  -1.127  -7.628
  457   1HD2  LEU  63          3HD2      LEU  63  -4.131  -4.005  -5.555
  458   2HD2  LEU  63          2HD2      LEU  63  -2.881  -4.839  -6.492
  459   3HD2  LEU  63          1HD2      LEU  63  -2.523  -3.293  -5.724
  460    H    THR  64             H      THR  64  -7.370  -4.472  -7.839
  461    HA   THR  64            HA      THR  64  -8.807  -4.841 -10.307
  462    HB   THR  64            HB      THR  64 -10.280  -6.634  -9.290
  463    HG1  THR  64           HG1      THR  64  -8.022  -6.870  -7.601
  464   1HG2  THR  64          2HG2      THR  64  -8.498  -7.032 -11.012
  465   2HG2  THR  64          1HG2      THR  64  -7.412  -7.494  -9.697
  466   3HG2  THR  64          3HG2      THR  64  -8.879  -8.430 -10.016
  467    H    LEU  65             H      LEU  65 -10.467  -3.547 -10.140
  468    HA   LEU  65            HA      LEU  65 -11.631  -2.955  -7.540
  469   1HB   LEU  65           2HB      LEU  65 -11.692  -0.478  -8.449
  470   2HB   LEU  65           1HB      LEU  65 -10.457  -1.106  -7.419
  471    HG   LEU  65            HG      LEU  65  -8.923  -1.406  -9.249
  472   1HD1  LEU  65          1HD1      LEU  65 -11.164  -1.604 -10.895
  473   2HD1  LEU  65          3HD1      LEU  65 -10.354  -0.147 -11.418
  474   3HD1  LEU  65          2HD1      LEU  65  -9.495  -1.674 -11.379
  475   1HD2  LEU  65          2HD2      LEU  65 -10.264   1.186  -8.792
  476   2HD2  LEU  65          1HD2      LEU  65  -8.557   0.750  -8.662
  477   3HD2  LEU  65          3HD2      LEU  65  -9.255   1.112 -10.241
  478    H    GLY  66             H      GLY  66 -13.563  -3.671  -7.658
  479   1HA   GLY  66           2HA      GLY  66 -15.836  -3.723  -8.250
  480   2HA   GLY  66           1HA      GLY  66 -15.484  -2.578  -9.545
  481    H    GLY  67             H      GLY  67 -13.414  -5.375  -9.251
  482   1HA   GLY  67           2HA      GLY  67 -13.410  -7.425 -10.419
  483   2HA   GLY  67           1HA      GLY  67 -14.918  -6.957 -11.211
  484    H    GLN  68             H      GLN  68 -12.565  -4.385 -11.226
  485    HA   GLN  68            HA      GLN  68 -11.930  -5.091 -14.081
  486   1HB   GLN  68           2HB      GLN  68 -13.200  -3.059 -13.941
  487   2HB   GLN  68           1HB      GLN  68 -12.069  -2.459 -12.780
  488   1HG   GLN  68           2HG      GLN  68 -11.725  -1.535 -15.128
  489   2HG   GLN  68           1HG      GLN  68 -10.292  -2.250 -14.393
  490   1HE2  GLN  68          2HE2      GLN  68  -9.920  -4.313 -17.248
  491   2HE2  GLN  68          1HE2      GLN  68  -9.191  -3.239 -16.149
  492    H    LYS  69             H      LYS  69 -10.012  -6.092 -14.092
  493    HA   LYS  69            HA      LYS  69  -7.901  -5.718 -12.250
  494   1HB   LYS  69           2HB      LYS  69  -8.482  -7.449 -14.266
  495   2HB   LYS  69           1HB      LYS  69  -7.184  -6.509 -14.999
  496   1HG   LYS  69           2HG      LYS  69  -5.631  -7.170 -13.412
  497   2HG   LYS  69           1HG      LYS  69  -6.870  -7.524 -12.203
  498   1HD   LYS  69           2HD      LYS  69  -7.620  -9.446 -13.450
  499   2HD   LYS  69           1HD      LYS  69  -6.510  -9.070 -14.765
  500   1HE   LYS  69           2HE      LYS  69  -4.876  -9.150 -12.478
  501   2HE   LYS  69           1HE      LYS  69  -5.977 -10.514 -12.291
  502   1HZ   LYS  69           3HZ      LYS  69  -4.635 -10.011 -14.866
  503   2HZ   LYS  69           2HZ      LYS  69  -3.828 -10.839 -13.621
  504   3HZ   LYS  69           1HZ      LYS  69  -5.275 -11.462 -14.262
  505    H    CYS  70             H      CYS  70  -6.688  -3.912 -11.961
  506    HA   CYS  70            HA      CYS  70  -5.992  -2.307 -14.406
  507   1HB   CYS  70           2HB      CYS  70  -5.436  -0.517 -12.720
  508   2HB   CYS  70           1HB      CYS  70  -7.128  -0.918 -12.806
  509    HG   CYS  70            HG      CYS  70  -5.430  -2.226 -10.558
  510    H    SER  71             H      SER  71  -3.671  -1.813 -14.383
  511    HA   SER  71            HA      SER  71  -2.032  -3.680 -12.794
  512   1HB   SER  71           2HB      SER  71  -0.756  -4.258 -14.602
  513   2HB   SER  71           1HB      SER  71  -2.313  -3.981 -15.349
  514    HG   SER  71            HG      SER  71  -0.002  -2.393 -15.355
  515    H    VAL  72             H      VAL  72  -0.755  -2.824 -11.478
  516    HA   VAL  72            HA      VAL  72  -0.400  -0.163 -10.916
  517    HB   VAL  72            HB      VAL  72   1.811  -2.028 -10.336
  518   1HG1  VAL  72          2HG1      VAL  72   1.164   0.591  -9.595
  519   2HG1  VAL  72          1HG1      VAL  72   0.778  -0.390  -8.186
  520   3HG1  VAL  72          3HG1      VAL  72   2.400  -0.431  -8.871
  521   1HG2  VAL  72          2HG2      VAL  72  -0.991  -2.179  -9.429
  522   2HG2  VAL  72          1HG2      VAL  72   0.202  -3.461  -9.591
  523   3HG2  VAL  72          3HG2      VAL  72   0.252  -2.383  -8.215
  524    H    ILE  73             H      ILE  73   0.423   1.355 -12.000
  525    HA   ILE  73            HA      ILE  73   2.871   1.055 -13.423
  526    HB   ILE  73            HB      ILE  73   0.420   2.618 -13.906
  527   1HG1  ILE  73          2HG1      ILE  73   1.590   1.980 -16.362
  528   2HG1  ILE  73          1HG1      ILE  73   2.033   0.628 -15.330
  529   1HG2  ILE  73          1HG2      ILE  73   3.139   3.648 -14.321
  530   2HG2  ILE  73          3HG2      ILE  73   2.059   3.811 -15.707
  531   3HG2  ILE  73          2HG2      ILE  73   1.625   4.534 -14.160
  532   1HD1  ILE  73          2HD1      ILE  73  -0.755   1.179 -14.876
  533   2HD1  ILE  73          1HD1      ILE  73  -0.514   1.116 -16.623
  534   3HD1  ILE  73          3HD1      ILE  73  -0.053  -0.262 -15.614
  535    NH1  ARG  74           NH2      ARG  74   8.537   5.389 -11.002
  536    NH2  ARG  74           NH1      ARG  74   8.005   7.094  -9.620
  537    H    ARG  74             H      ARG  74   3.387   1.187 -11.032
  538    HA   ARG  74            HA      ARG  74   5.022   2.418  -9.667
  539   1HB   ARG  74           2HB      ARG  74   3.050   4.659 -10.083
  540   2HB   ARG  74           1HB      ARG  74   4.332   4.711  -8.883
  541   1HG   ARG  74           2HG      ARG  74   5.943   4.206 -10.817
  542   2HG   ARG  74           1HG      ARG  74   4.604   4.589 -11.899
  543   1HD   ARG  74           2HD      ARG  74   4.544   6.830 -11.255
  544   2HD   ARG  74           1HD      ARG  74   5.313   6.505  -9.701
  545    HE   ARG  74            HE      ARG  74   6.694   6.943 -12.248
  546   1HH1  ARG  74          1HH2      ARG  74   8.327   4.819 -11.798
  547   2HH1  ARG  74          2HH2      ARG  74   9.365   5.215 -10.467
  548   1HH2  ARG  74          2HH1      ARG  74   7.383   7.829  -9.349
  549   2HH2  ARG  74          1HH1      ARG  74   8.843   6.932  -9.101
  550    H    ASP  75             H      ASP  75   4.900   2.133  -7.442
  551    HA   ASP  75            HA      ASP  75   2.248   2.139  -6.255
  552   1HB   ASP  75           2HB      ASP  75   2.404  -0.147  -6.897
  553   2HB   ASP  75           1HB      ASP  75   3.983  -0.257  -6.222
  554    H    SER  76             H      SER  76   2.685   3.868  -5.073
  555    HA   SER  76            HA      SER  76   4.549   3.429  -2.795
  556   1HB   SER  76           2HB      SER  76   4.051   5.953  -4.436
  557   2HB   SER  76           1HB      SER  76   4.452   6.091  -2.730
  558    HG   SER  76            HG      SER  76   5.941   4.652  -4.667
  559    H    LEU  77             H      LEU  77   1.964   2.424  -3.034
  560    HA   LEU  77            HA      LEU  77  -0.231   4.076  -2.122
  561   1HB   LEU  77           2HB      LEU  77  -0.228   1.807  -3.309
  562   2HB   LEU  77           1HB      LEU  77   0.072   1.086  -1.731
  563    HG   LEU  77            HG      LEU  77  -1.978   2.211  -0.872
  564   1HD1  LEU  77          3HD1      LEU  77  -2.105   3.085  -3.763
  565   2HD1  LEU  77          2HD1      LEU  77  -3.551   2.998  -2.754
  566   3HD1  LEU  77          1HD1      LEU  77  -2.233   4.078  -2.312
  567   1HD2  LEU  77          2HD2      LEU  77  -1.943  -0.134  -1.829
  568   2HD2  LEU  77          1HD2      LEU  77  -3.515   0.661  -1.920
  569   3HD2  LEU  77          3HD2      LEU  77  -2.499   0.549  -3.362
  570    H    LEU  78             H      LEU  78   1.257   1.403  -0.075
  571    HA   LEU  78            HA      LEU  78   0.494   3.164   2.225
  572   1HB   LEU  78           2HB      LEU  78   0.648   0.906   3.555
  573   2HB   LEU  78           1HB      LEU  78  -0.785   1.237   2.604
  574    HG   LEU  78            HG      LEU  78   1.533  -0.247   1.367
  575   1HD1  LEU  78          1HD1      LEU  78   0.961  -1.452   3.482
  576   2HD1  LEU  78          3HD1      LEU  78  -0.725  -1.525   2.968
  577   3HD1  LEU  78          2HD1      LEU  78   0.513  -2.397   2.057
  578   1HD2  LEU  78          3HD2      LEU  78  -1.065   0.619   0.551
  579   2HD2  LEU  78          2HD2      LEU  78   0.089  -0.342  -0.357
  580   3HD2  LEU  78          1HD2      LEU  78  -1.114  -1.143   0.643
  581    H    GLN  79             H      GLN  79   2.858   3.885   1.147
  582    HA   GLN  79            HA      GLN  79   4.901   2.604   2.764
  583   1HB   GLN  79           2HB      GLN  79   6.457   3.618   1.066
  584   2HB   GLN  79           1HB      GLN  79   5.446   2.305   0.540
  585   1HG   GLN  79           2HG      GLN  79   4.193   3.632  -0.777
  586   2HG   GLN  79           1HG      GLN  79   4.405   5.034   0.247
  587   1HE2  GLN  79          2HE2      GLN  79   7.161   6.255  -1.586
  588   2HE2  GLN  79          1HE2      GLN  79   6.027   6.529  -0.354
  589    H    ASP  80             H      ASP  80   5.885   5.545   1.478
  590    HA   ASP  80            HA      ASP  80   6.137   6.665   4.199
  591   1HB   ASP  80           2HB      ASP  80   8.167   6.198   2.799
  592   2HB   ASP  80           1HB      ASP  80   7.663   7.510   1.734
  593    H    GLY  81             H      GLY  81   3.668   7.412   3.750
  594   1HA   GLY  81           2HA      GLY  81   2.369   9.412   3.817
  595   2HA   GLY  81           1HA      GLY  81   3.824  10.317   3.480
  596    H    GLU  82             H      GLU  82   4.041   8.372   0.936
  597    HA   GLU  82            HA      GLU  82   2.943  10.208  -0.958
  598   1HB   GLU  82           2HB      GLU  82   4.242   7.522  -1.085
  599   2HB   GLU  82           1HB      GLU  82   3.349   8.081  -2.466
  600   1HG   GLU  82           2HG      GLU  82   5.770   9.374  -1.243
  601   2HG   GLU  82           1HG      GLU  82   5.626   8.612  -2.845
  602    H    PHE  83             H      PHE  83   2.323   6.830  -0.441
  603    HA   PHE  83            HA      PHE  83   0.461   5.518  -0.801
  604   1HB   PHE  83           2HB      PHE  83  -1.708   7.268  -0.816
  605   2HB   PHE  83           1HB      PHE  83  -1.378   5.974   0.239
  606    HD1  PHE  83           HD1      PHE  83   0.574   6.453   1.995
  607    HD2  PHE  83           HD2      PHE  83  -1.890   9.405   0.079
  608    HE1  PHE  83           HE1      PHE  83   0.974   8.022   3.871
  609    HE2  PHE  83           HE2      PHE  83  -1.468  10.982   1.941
  610    HZ   PHE  83            HZ      PHE  83  -0.035  10.292   3.843
  611    H    SER  84             H      SER  84   1.270   7.856  -3.054
  612    HA   SER  84            HA      SER  84  -1.003   7.400  -4.802
  613   1HB   SER  84           2HB      SER  84   0.518   8.679  -6.449
  614   2HB   SER  84           1HB      SER  84  -0.144   9.543  -5.060
  615    HG   SER  84            HG      SER  84   1.879   9.966  -4.656
  616    H    MET  85             H      MET  85  -1.203   5.809  -6.103
  617    HA   MET  85            HA      MET  85   1.182   4.286  -7.116
  618   1HB   MET  85           2HB      MET  85   0.300   3.118  -5.133
  619   2HB   MET  85           1HB      MET  85  -1.296   3.286  -5.778
  620   1HG   MET  85           2HG      MET  85  -0.106   1.933  -7.814
  621   2HG   MET  85           1HG      MET  85   0.707   1.267  -6.412
  622   1HE   MET  85           1HE      MET  85   0.285  -0.656  -6.338
  623   2HE   MET  85           3HE      MET  85  -1.060  -1.279  -5.357
  624   3HE   MET  85           2HE      MET  85  -1.130  -1.389  -7.117
  625    H    ASP  86             H      ASP  86   0.903   4.076  -9.372
  626    HA   ASP  86            HA      ASP  86  -1.846   4.706 -10.301
  627   1HB   ASP  86           2HB      ASP  86   0.652   4.197 -11.828
  628   2HB   ASP  86           1HB      ASP  86  -0.861   4.660 -12.515
  629    H    LEU  87             H      LEU  87  -2.940   3.288 -11.543
  630    HA   LEU  87            HA      LEU  87  -1.907   0.797 -12.315
  631   1HB   LEU  87           2HB      LEU  87  -3.869  -0.449 -11.172
  632   2HB   LEU  87           1HB      LEU  87  -2.387  -0.155 -10.364
  633    HG   LEU  87            HG      LEU  87  -4.248   0.146  -8.853
  634   1HD1  LEU  87          1HD1      LEU  87  -2.141   1.636  -8.842
  635   2HD1  LEU  87          3HD1      LEU  87  -3.279   2.911  -9.273
  636   3HD1  LEU  87          2HD1      LEU  87  -3.502   1.992  -7.790
  637   1HD2  LEU  87          2HD2      LEU  87  -5.506   1.305 -11.023
  638   2HD2  LEU  87          1HD2      LEU  87  -6.118   1.228  -9.377
  639   3HD2  LEU  87          3HD2      LEU  87  -5.228   2.645  -9.915
  640    NH1  ARG  88           NH2      ARG  88  -1.932   0.756 -20.956
  641    NH2  ARG  88           NH1      ARG  88  -0.124   2.114 -20.893
  642    H    ARG  88             H      ARG  88  -2.859   0.252 -14.293
  643    HA   ARG  88            HA      ARG  88  -5.377   1.819 -14.840
  644   1HB   ARG  88           2HB      ARG  88  -4.600   2.671 -16.830
  645   2HB   ARG  88           1HB      ARG  88  -3.117   2.638 -15.914
  646   1HG   ARG  88           2HG      ARG  88  -2.420   0.601 -17.121
  647   2HG   ARG  88           1HG      ARG  88  -3.990   0.552 -17.971
  648   1HD   ARG  88           2HD      ARG  88  -3.399   2.193 -19.415
  649   2HD   ARG  88           1HD      ARG  88  -2.671   3.206 -18.121
  650    HE   ARG  88            HE      ARG  88  -0.622   1.734 -18.395
  651   1HH1  ARG  88          1HH2      ARG  88  -2.711   0.330 -20.493
  652   2HH1  ARG  88          2HH2      ARG  88  -1.761   0.569 -21.924
  653   1HH2  ARG  88          2HH1      ARG  88   0.480   2.726 -20.385
  654   2HH2  ARG  88          1HH1      ARG  88   0.050   1.931 -21.862
  655    H    THR  89             H      THR  89  -6.804   1.082 -16.323
  656    HA   THR  89            HA      THR  89  -7.100  -1.811 -16.314
  657    HB   THR  89            HB      THR  89  -9.324  -1.419 -16.900
  658    HG1  THR  89           HG1      THR  89  -9.875  -0.406 -18.654
  659   1HG2  THR  89          2HG2      THR  89  -8.562   0.302 -15.155
  660   2HG2  THR  89          1HG2      THR  89  -8.857   1.422 -16.473
  661   3HG2  THR  89          3HG2      THR  89 -10.171   0.434 -15.867
  662    H    LYS  90             H      LYS  90  -5.302  -2.441 -17.489
  663    HA   LYS  90            HA      LYS  90  -4.775  -1.345 -20.071
  664   1HB   LYS  90           2HB      LYS  90  -3.355  -3.813 -19.134
  665   2HB   LYS  90           1HB      LYS  90  -2.747  -2.403 -19.955
  666   1HG   LYS  90           2HG      LYS  90  -3.520  -1.334 -17.573
  667   2HG   LYS  90           1HG      LYS  90  -2.854  -2.890 -17.100
  668   1HD   LYS  90           2HD      LYS  90  -1.456  -0.947 -18.972
  669   2HD   LYS  90           1HD      LYS  90  -1.144  -1.010 -17.241
  670   1HE   LYS  90           2HE      LYS  90  -0.888  -3.649 -17.891
  671   2HE   LYS  90           1HE      LYS  90  -0.321  -2.893 -19.378
  672   1HZ   LYS  90           3HZ      LYS  90   0.828  -1.493 -17.246
  673   2HZ   LYS  90           2HZ      LYS  90   1.015  -3.149 -16.909
  674   3HZ   LYS  90           1HZ      LYS  90   1.604  -2.508 -18.365
  675    H    SER  91             H      SER  91  -5.630  -2.067 -21.835
  676    HA   SER  91            HA      SER  91  -7.551  -4.252 -21.793
  677   1HB   SER  91           2HB      SER  91  -8.541  -2.462 -22.828
  678   2HB   SER  91           1HB      SER  91  -7.060  -1.825 -23.430
  679    HG   SER  91            HG      SER  91  -7.439  -2.788 -25.257
  680    H    THR  92             H      THR  92  -7.803  -5.396 -23.991
  681    HA   THR  92            HA      THR  92  -5.376  -7.073 -24.281
  682    HB   THR  92            HB      THR  92  -6.812  -8.538 -25.569
  683    HG1  THR  92           HG1      THR  92  -8.964  -7.755 -26.085
  684   1HG2  THR  92          3HG2      THR  92  -7.661  -7.428 -23.002
  685   2HG2  THR  92          2HG2      THR  92  -9.036  -8.025 -23.938
  686   3HG2  THR  92          1HG2      THR  92  -7.695  -9.106 -23.563
  687    H    GLY  93             H      GLY  93  -7.083  -4.654 -26.158
  688   1HA   GLY  93           2HA      GLY  93  -5.155  -3.597 -27.746
  689   2HA   GLY  93           1HA      GLY  93  -5.498  -5.105 -28.604
  690    H    GLY  94             H      GLY  94  -8.113  -5.475 -28.400
  691   1HA   GLY  94           2HA      GLY  94  -9.280  -3.277 -29.984
  692   2HA   GLY  94           1HA      GLY  94 -10.017  -4.856 -29.692
  693    H    ALA  95             H      ALA  95  -9.151  -4.289 -26.678
  694    HA   ALA  95            HA      ALA  95 -11.746  -3.136 -25.902
  695   1HB   ALA  95           3HB      ALA  95  -9.978  -5.001 -24.749
  696   2HB   ALA  95           2HB      ALA  95  -9.894  -3.586 -23.693
  697   3HB   ALA  95           1HB      ALA  95 -11.451  -4.357 -24.028
  698    HA   PRO  96            HA      PRO  96 -10.120   0.781 -24.717
  699   1HB   PRO  96           2HB      PRO  96 -11.939   1.462 -22.831
  700   2HB   PRO  96           1HB      PRO  96 -12.391   1.271 -24.537
  701   1HG   PRO  96           2HG      PRO  96 -13.043  -0.504 -22.244
  702   2HG   PRO  96           1HG      PRO  96 -13.825  -0.396 -23.821
  703   1HD   PRO  96           2HD      PRO  96 -11.845  -2.345 -22.960
  704   2HD   PRO  96           1HD      PRO  96 -12.701  -2.238 -24.517
  705    H    THR  97             H      THR  97  -9.169   1.987 -22.911
  706    HA   THR  97            HA      THR  97  -8.509   0.315 -20.530
  707    HB   THR  97            HB      THR  97  -6.398   1.711 -20.423
  708    HG1  THR  97           HG1      THR  97  -7.151   2.184 -23.129
  709   1HG2  THR  97          3HG2      THR  97  -6.951  -0.639 -21.768
  710   2HG2  THR  97          2HG2      THR  97  -6.109   0.342 -22.976
  711   3HG2  THR  97          1HG2      THR  97  -5.340   0.023 -21.410
  712    H    PHE  98             H      PHE  98  -7.921   1.747 -18.622
  713    HA   PHE  98            HA      PHE  98  -9.019   4.478 -18.625
  714   1HB   PHE  98           2HB      PHE  98 -10.394   2.167 -17.245
  715   2HB   PHE  98           1HB      PHE  98 -10.635   3.865 -16.751
  716    HD1  PHE  98           HD1      PHE  98 -10.982   5.492 -18.938
  717    HD2  PHE  98           HD2      PHE  98 -11.918   1.363 -18.827
  718    HE1  PHE  98           HE1      PHE  98 -12.460   5.972 -20.875
  719    HE2  PHE  98           HE2      PHE  98 -13.443   1.679 -20.764
  720    HZ   PHE  98            HZ      PHE  98 -13.717   3.923 -21.795
  721    H    ASN  99             H      ASN  99  -7.097   5.356 -17.795
  722    HA   ASN  99            HA      ASN  99  -5.480   3.977 -15.962
  723   1HB   ASN  99           2HB      ASN  99  -5.096   6.849 -16.820
  724   2HB   ASN  99           1HB      ASN  99  -3.918   5.803 -16.028
  725   1HD2  ASN  99          2HD2      ASN  99  -3.143   5.758 -19.628
  726   2HD2  ASN  99          1HD2      ASN  99  -3.230   6.955 -18.442
  727    H    VAL 100             H      VAL 100  -5.137   4.287 -14.026
  728    HA   VAL 100            HA      VAL 100  -6.939   6.030 -12.517
  729    HB   VAL 100            HB      VAL 100  -5.963   3.330 -11.506
  730   1HG1  VAL 100          2HG1      VAL 100  -7.339   5.226 -10.218
  731   2HG1  VAL 100          1HG1      VAL 100  -8.656   4.312 -10.865
  732   3HG1  VAL 100          3HG1      VAL 100  -7.471   3.532  -9.856
  733   1HG2  VAL 100          2HG2      VAL 100  -7.077   2.905 -13.712
  734   2HG2  VAL 100          1HG2      VAL 100  -8.011   2.246 -12.366
  735   3HG2  VAL 100          3HG2      VAL 100  -8.510   3.754 -13.134
  736    H    THR 101             H      THR 101  -6.151   6.533 -10.487
  737    HA   THR 101            HA      THR 101  -3.326   6.038  -9.906
  738    HB   THR 101            HB      THR 101  -4.912   8.654  -9.630
  739    HG1  THR 101           HG1      THR 101  -3.703   8.338 -11.534
  740   1HG2  THR 101          2HG2      THR 101  -2.305   7.890  -8.275
  741   2HG2  THR 101          1HG2      THR 101  -3.013   9.489  -8.272
  742   3HG2  THR 101          3HG2      THR 101  -3.844   8.180  -7.473
  743    H    VAL 102             H      VAL 102  -3.182   6.047  -7.417
  744    HA   VAL 102            HA      VAL 102  -5.742   5.736  -6.053
  745    HB   VAL 102            HB      VAL 102  -3.879   3.521  -6.792
  746   1HG1  VAL 102          1HG1      VAL 102  -5.033   3.863  -4.099
  747   2HG1  VAL 102          3HG1      VAL 102  -5.655   2.412  -4.891
  748   3HG1  VAL 102          2HG1      VAL 102  -3.915   2.626  -4.679
  749   1HG2  VAL 102          1HG2      VAL 102  -6.786   4.135  -6.794
  750   2HG2  VAL 102          3HG2      VAL 102  -5.736   3.635  -8.116
  751   3HG2  VAL 102          2HG2      VAL 102  -6.230   2.461  -6.900
  752    H    THR 103             H      THR 103  -5.575   6.941  -4.409
  753    HA   THR 103            HA      THR 103  -2.943   7.271  -3.002
  754    HB   THR 103            HB      THR 103  -4.153   9.318  -2.056
  755    HG1  THR 103           HG1      THR 103  -6.226   8.710  -2.613
  756   1HG2  THR 103          3HG2      THR 103  -2.751   8.904  -4.448
  757   2HG2  THR 103          2HG2      THR 103  -4.153   9.895  -4.919
  758   3HG2  THR 103          1HG2      THR 103  -3.037  10.453  -3.655
  759    H    LYS 104             H      LYS 104  -2.932   5.682  -1.389
  760    HA   LYS 104            HA      LYS 104  -5.393   5.002   0.104
  761   1HB   LYS 104           2HB      LYS 104  -3.816   3.218  -0.646
  762   2HB   LYS 104           1HB      LYS 104  -2.574   3.908   0.398
  763   1HG   LYS 104           2HG      LYS 104  -3.390   2.442   1.939
  764   2HG   LYS 104           1HG      LYS 104  -4.641   3.660   2.165
  765   1HD   LYS 104           2HD      LYS 104  -6.228   2.454   1.014
  766   2HD   LYS 104           1HD      LYS 104  -5.036   1.692  -0.041
  767   1HE   LYS 104           2HE      LYS 104  -5.165   1.055   2.906
  768   2HE   LYS 104           1HE      LYS 104  -6.166   0.202   1.733
  769   1HZ   LYS 104           2HZ      LYS 104  -4.080  -0.279   0.490
  770   2HZ   LYS 104           1HZ      LYS 104  -3.208   0.340   1.812
  771   3HZ   LYS 104           3HZ      LYS 104  -4.181  -1.034   2.009
  772    H    THR 105             H      THR 105  -5.946   6.308   1.781
  773    HA   THR 105            HA      THR 105  -3.930   7.875   3.251
  774    HB   THR 105            HB      THR 105  -5.771   8.762   4.545
  775    HG1  THR 105           HG1      THR 105  -7.557   7.693   4.859
  776   1HG2  THR 105          3HG2      THR 105  -5.977   8.558   1.635
  777   2HG2  THR 105          2HG2      THR 105  -7.535   8.856   2.406
  778   3HG2  THR 105          1HG2      THR 105  -6.187   9.969   2.681
  779    H    ASP 106             H      ASP 106  -5.371   7.337   5.939
  780    HA   ASP 106            HA      ASP 106  -3.747   4.977   6.657
  781   1HB   ASP 106           2HB      ASP 106  -3.731   7.130   7.986
  782   2HB   ASP 106           1HB      ASP 106  -5.360   6.721   8.508
  783    H    LYS 107             H      LYS 107  -7.165   6.047   6.714
  784    HA   LYS 107            HA      LYS 107  -7.949   3.181   7.173
  785   1HB   LYS 107           2HB      LYS 107  -9.604   5.525   8.122
  786   2HB   LYS 107           1HB      LYS 107  -9.764   3.832   8.567
  787   1HG   LYS 107           2HG      LYS 107  -7.440   4.006   9.579
  788   2HG   LYS 107           1HG      LYS 107  -7.589   5.750   9.370
  789   1HD   LYS 107           2HD      LYS 107  -9.684   5.727  10.692
  790   2HD   LYS 107           1HD      LYS 107  -9.504   3.990  10.931
  791   1HE   LYS 107           2HE      LYS 107  -7.590   6.141  11.881
  792   2HE   LYS 107           1HE      LYS 107  -8.652   5.166  12.894
  793   1HZ   LYS 107           3HZ      LYS 107  -7.362   3.240  11.632
  794   2HZ   LYS 107           2HZ      LYS 107  -6.159   4.435  11.567
  795   3HZ   LYS 107           1HZ      LYS 107  -6.778   3.933  13.064
  796    H    THR 108             H      THR 108  -7.814   5.219   4.728
  797    HA   THR 108            HA      THR 108 -10.428   4.351   3.625
  798    HB   THR 108            HB      THR 108 -10.967   6.473   2.748
  799    HG1  THR 108           HG1      THR 108  -9.049   7.156   1.925
  800   1HG2  THR 108          1HG2      THR 108 -11.055   6.175   5.327
  801   2HG2  THR 108          3HG2      THR 108  -9.669   7.281   5.340
  802   3HG2  THR 108          2HG2      THR 108 -11.204   7.821   4.671
  803    H    LEU 109             H      LEU 109 -10.338   4.241   1.312
  804    HA   LEU 109            HA      LEU 109  -7.637   3.856   0.126
  805   1HB   LEU 109           2HB      LEU 109  -9.352   1.892   0.812
  806   2HB   LEU 109           1HB      LEU 109 -10.013   2.248  -0.764
  807    HG   LEU 109            HG      LEU 109  -7.342   1.097  -0.047
  808   1HD1  LEU 109          3HD1      LEU 109  -9.628   0.533  -1.918
  809   2HD1  LEU 109          2HD1      LEU 109  -8.074  -0.278  -2.076
  810   3HD1  LEU 109          1HD1      LEU 109  -9.013  -0.456  -0.607
  811   1HD2  LEU 109          1HD2      LEU 109  -8.072   2.518  -2.582
  812   2HD2  LEU 109          3HD2      LEU 109  -6.796   2.973  -1.460
  813   3HD2  LEU 109          2HD2      LEU 109  -6.676   1.469  -2.383
  814    H    VAL 110             H      VAL 110  -7.779   6.045  -1.017
  815    HA   VAL 110            HA      VAL 110 -10.279   6.538  -2.505
  816    HB   VAL 110            HB      VAL 110  -7.829   8.158  -1.778
  817   1HG1  VAL 110          3HG1      VAL 110  -9.449   8.533  -4.277
  818   2HG1  VAL 110          2HG1      VAL 110  -8.909   9.963  -3.403
  819   3HG1  VAL 110          1HG1      VAL 110  -7.739   8.810  -4.026
  820   1HG2  VAL 110          1HG2      VAL 110 -10.649   8.084  -1.164
  821   2HG2  VAL 110          3HG2      VAL 110  -9.392   9.092  -0.440
  822   3HG2  VAL 110          2HG2      VAL 110 -10.268   9.668  -1.868
  823    H    LEU 111             H      LEU 111 -10.473   6.359  -4.666
  824    HA   LEU 111            HA      LEU 111  -8.115   5.582  -6.261
  825   1HB   LEU 111           2HB      LEU 111 -10.903   4.560  -6.874
  826   2HB   LEU 111           1HB      LEU 111  -9.364   3.961  -7.485
  827    HG   LEU 111            HG      LEU 111  -9.870   3.863  -4.562
  828   1HD1  LEU 111          1HD1      LEU 111 -11.280   2.295  -6.644
  829   2HD1  LEU 111          3HD1      LEU 111 -10.723   1.421  -5.215
  830   3HD1  LEU 111          2HD1      LEU 111 -11.828   2.786  -5.043
  831   1HD2  LEU 111          2HD2      LEU 111  -8.316   2.281  -6.592
  832   2HD2  LEU 111          1HD2      LEU 111  -7.720   3.111  -5.153
  833   3HD2  LEU 111          3HD2      LEU 111  -8.642   1.619  -4.990
  834    H    LEU 112             H      LEU 112  -8.100   6.474  -8.245
  835    HA   LEU 112            HA      LEU 112 -10.239   8.348  -9.024
  836   1HB   LEU 112           2HB      LEU 112  -8.201   9.477  -8.010
  837   2HB   LEU 112           1HB      LEU 112  -7.262   8.708  -9.245
  838    HG   LEU 112            HG      LEU 112  -7.563  10.461 -10.600
  839   1HD1  LEU 112          2HD1      LEU 112 -10.435   9.645 -10.446
  840   2HD1  LEU 112          1HD1      LEU 112 -10.032  11.199 -11.166
  841   3HD1  LEU 112          3HD1      LEU 112  -9.358   9.719 -11.837
  842   1HD2  LEU 112          2HD2      LEU 112  -9.373  11.477  -8.438
  843   2HD2  LEU 112          1HD2      LEU 112  -7.650  11.759  -8.602
  844   3HD2  LEU 112          3HD2      LEU 112  -8.771  12.445  -9.773
  845    H    MET 113             H      MET 113 -10.968   6.852 -10.554
  846    HA   MET 113            HA      MET 113  -8.858   5.636 -12.317
  847   1HB   MET 113           2HB      MET 113 -10.219   3.803 -11.762
  848   2HB   MET 113           1HB      MET 113 -11.652   4.778 -11.603
  849   1HG   MET 113           2HG      MET 113 -11.847   4.920 -14.099
  850   2HG   MET 113           1HG      MET 113 -10.355   4.020 -14.279
  851   1HE   MET 113           2HE      MET 113 -12.392   3.607 -15.837
  852   2HE   MET 113           1HE      MET 113 -12.642   1.864 -15.909
  853   3HE   MET 113           3HE      MET 113 -13.919   2.922 -15.288
  854    H    GLY 114             H      GLY 114  -9.175   5.489 -14.544
  855   1HA   GLY 114           2HA      GLY 114 -10.910   6.351 -16.185
  856   2HA   GLY 114           1HA      GLY 114 -10.456   7.895 -15.575
  857    H    LYS 115             H      LYS 115 -10.551   6.912 -18.163
  858    HA   LYS 115            HA      LYS 115  -8.291   8.032 -19.229
  859   1HB   LYS 115           2HB      LYS 115  -9.198   5.418 -20.344
  860   2HB   LYS 115           1HB      LYS 115  -8.299   6.511 -21.325
  861   1HG   LYS 115           2HG      LYS 115  -6.552   5.780 -19.241
  862   2HG   LYS 115           1HG      LYS 115  -7.355   4.333 -19.662
  863   1HD   LYS 115           2HD      LYS 115  -6.881   4.854 -22.081
  864   2HD   LYS 115           1HD      LYS 115  -5.828   6.147 -21.505
  865   1HE   LYS 115           2HE      LYS 115  -4.366   4.656 -20.488
  866   2HE   LYS 115           1HE      LYS 115  -5.538   3.346 -20.421
  867   1HZ   LYS 115           2HZ      LYS 115  -5.275   3.846 -23.092
  868   2HZ   LYS 115           1HZ      LYS 115  -3.699   4.157 -22.538
  869   3HZ   LYS 115           3HZ      LYS 115  -4.412   2.645 -22.249
  870    H    GLU 116             H      GLU 116  -9.130   9.511 -20.377
  871    HA   GLU 116            HA      GLU 116 -11.206   8.648 -22.280
  872   1HB   GLU 116           2HB      GLU 116 -11.564  10.497 -20.494
  873   2HB   GLU 116           1HB      GLU 116 -10.684  11.365 -21.608
  874   1HG   GLU 116           2HG      GLU 116 -12.782  11.817 -22.475
  875   2HG   GLU 116           1HG      GLU 116 -12.317  10.384 -23.394
  876    H    GLY 117             H      GLY 117  -9.227   7.871 -23.651
  877   1HA   GLY 117           2HA      GLY 117  -7.225   8.313 -24.933
  878   2HA   GLY 117           1HA      GLY 117  -7.787   9.986 -25.011
  879    H    VAL 118             H      VAL 118  -7.547   9.341 -21.635
  880    HA   VAL 118            HA      VAL 118  -5.906  11.158 -20.734
  881    HB   VAL 118            HB      VAL 118  -7.337   9.695 -19.343
  882   1HG1  VAL 118          1HG1      VAL 118  -6.593   7.681 -20.571
  883   2HG1  VAL 118          3HG1      VAL 118  -5.068   7.723 -19.693
  884   3HG1  VAL 118          2HG1      VAL 118  -6.586   7.500 -18.810
  885   1HG2  VAL 118          2HG2      VAL 118  -4.398   9.994 -18.523
  886   2HG2  VAL 118          1HG2      VAL 118  -5.826  10.643 -17.752
  887   3HG2  VAL 118          3HG2      VAL 118  -5.411   8.909 -17.522
  888    H    HIS 119             H      HIS 119  -3.926  11.316 -19.951
  889    HA   HIS 119            HA      HIS 119  -1.772   9.985 -21.499
  890   1HB   HIS 119           2HB      HIS 119  -1.899  12.478 -21.508
  891   2HB   HIS 119           1HB      HIS 119  -1.696  12.477 -19.753
  892    HD1  HIS 119           HD1      HIS 119   0.224  12.603 -22.836
  893    HD2  HIS 119           HD2      HIS 119   0.888  11.137 -18.991
  894    HE1  HIS 119           HE1      HIS 119   2.734  12.338 -22.591
  895    H    GLY 120             H      GLY 120  -2.656  10.883 -18.099
  896   1HA   GLY 120           2HA      GLY 120  -2.303   9.326 -16.235
  897   2HA   GLY 120           1HA      GLY 120  -0.963   8.602 -17.146
  898    H    GLY 121             H      GLY 121  -1.684  10.696 -14.663
  899   1HA   GLY 121           2HA      GLY 121   0.521  11.435 -13.472
  900   2HA   GLY 121           1HA      GLY 121   0.802  12.334 -14.968
  901    H    LEU 122             H      LEU 122  -1.956  12.966 -15.440
  902    HA   LEU 122            HA      LEU 122  -2.306  15.313 -13.694
  903   1HB   LEU 122           2HB      LEU 122  -4.442  14.336 -15.588
  904   2HB   LEU 122           1HB      LEU 122  -4.020  15.988 -15.158
  905    HG   LEU 122            HG      LEU 122  -1.842  14.568 -16.528
  906   1HD1  LEU 122          3HD1      LEU 122  -4.200  13.768 -17.484
  907   2HD1  LEU 122          2HD1      LEU 122  -4.075  15.316 -18.335
  908   3HD1  LEU 122          1HD1      LEU 122  -2.823  14.095 -18.544
  909   1HD2  LEU 122          2HD2      LEU 122  -3.319  17.172 -16.887
  910   2HD2  LEU 122          1HD2      LEU 122  -1.722  16.940 -16.164
  911   3HD2  LEU 122          3HD2      LEU 122  -1.961  16.683 -17.897
  912    H    ILE 123             H      ILE 123  -3.748  12.158 -14.345
  913    HA   ILE 123            HA      ILE 123  -5.915  12.367 -12.433
  914    HB   ILE 123            HB      ILE 123  -4.337  10.033 -13.519
  915   1HG1  ILE 123          2HG1      ILE 123  -7.100  11.083 -14.303
  916   2HG1  ILE 123          1HG1      ILE 123  -5.616  11.380 -15.222
  917   1HG2  ILE 123          1HG2      ILE 123  -5.827   9.791 -11.278
  918   2HG2  ILE 123          3HG2      ILE 123  -7.114   9.649 -12.466
  919   3HG2  ILE 123          2HG2      ILE 123  -5.769   8.518 -12.485
  920   1HD1  ILE 123          1HD1      ILE 123  -6.763   8.642 -14.589
  921   2HD1  ILE 123          3HD1      ILE 123  -6.887   9.469 -16.144
  922   3HD1  ILE 123          2HD1      ILE 123  -5.302   8.962 -15.536
  923    H    ASN 124             H      ASN 124  -2.498  11.411 -12.337
  924    HA   ASN 124            HA      ASN 124  -2.418  10.461  -9.660
  925   1HB   ASN 124           2HB      ASN 124  -0.588  10.140 -11.351
  926   2HB   ASN 124           1HB      ASN 124  -0.183  11.845 -11.133
  927   1HD2  ASN 124          2HD2      ASN 124   1.564  11.286  -8.122
  928   2HD2  ASN 124          1HD2      ASN 124   1.133  12.380  -9.345
  929    H    LYS 125             H      LYS 125  -2.426  13.606 -11.131
  930    HA   LYS 125            HA      LYS 125  -1.619  15.085  -8.652
  931   1HB   LYS 125           2HB      LYS 125  -2.700  15.912 -11.401
  932   2HB   LYS 125           1HB      LYS 125  -2.405  17.081 -10.104
  933   1HG   LYS 125           2HG      LYS 125  -0.224  15.151 -10.846
  934   2HG   LYS 125           1HG      LYS 125  -0.515  16.555 -11.884
  935   1HD   LYS 125           2HD      LYS 125  -0.541  17.780  -9.469
  936   2HD   LYS 125           1HD      LYS 125   0.541  16.438  -9.093
  937   1HE   LYS 125           2HE      LYS 125   1.903  18.275  -9.884
  938   2HE   LYS 125           1HE      LYS 125   1.879  17.044 -11.149
  939   1HZ   LYS 125           3HZ      LYS 125  -0.159  19.155 -11.185
  940   2HZ   LYS 125           2HZ      LYS 125   1.414  19.531 -11.709
  941   3HZ   LYS 125           1HZ      LYS 125   0.530  18.297 -12.476
  942    H    LYS 126             H      LYS 126  -4.650  14.194 -10.319
  943    HA   LYS 126            HA      LYS 126  -6.343  15.815  -8.572
  944   1HB   LYS 126           2HB      LYS 126  -6.771  13.975 -10.887
  945   2HB   LYS 126           1HB      LYS 126  -8.117  14.247  -9.785
  946   1HG   LYS 126           2HG      LYS 126  -8.500  16.034 -11.155
  947   2HG   LYS 126           1HG      LYS 126  -7.310  16.796 -10.109
  948   1HD   LYS 126           2HD      LYS 126  -6.641  17.207 -12.392
  949   2HD   LYS 126           1HD      LYS 126  -5.530  16.026 -11.714
  950   1HE   LYS 126           2HE      LYS 126  -6.221  14.370 -13.130
  951   2HE   LYS 126           1HE      LYS 126  -7.914  14.838 -12.979
  952   1HZ   LYS 126           3HZ      LYS 126  -6.028  16.549 -14.461
  953   2HZ   LYS 126           2HZ      LYS 126  -6.727  15.196 -15.215
  954   3HZ   LYS 126           1HZ      LYS 126  -7.714  16.442 -14.612
  955    H    CYS 127             H      CYS 127  -4.901  12.690  -8.412
  956    HA   CYS 127            HA      CYS 127  -6.900  11.563  -6.545
  957   1HB   CYS 127           2HB      CYS 127  -5.403  10.257  -8.313
  958   2HB   CYS 127           1HB      CYS 127  -4.234  10.308  -7.013
  959    HG   CYS 127            HG      CYS 127  -5.736   8.162  -6.698
  960    OH   TYR 128            OH      TYR 128   1.870  15.968  -1.636
  961    H    TYR 128             H      TYR 128  -3.760  13.036  -6.706
  962    HA   TYR 128            HA      TYR 128  -2.954  12.600  -3.979
  963   1HB   TYR 128           2HB      TYR 128  -1.451  13.168  -5.917
  964   2HB   TYR 128           1HB      TYR 128  -2.204  14.748  -6.012
  965    HD1  TYR 128           HD1      TYR 128  -1.409  13.023  -2.800
  966    HD2  TYR 128           HD2      TYR 128  -0.275  16.011  -5.682
  967    HE1  TYR 128           HE1      TYR 128   0.269  13.903  -1.200
  968    HE2  TYR 128           HE2      TYR 128   1.398  16.911  -4.063
  969    HH   TYR 128            HH      TYR 128   1.400  16.320  -0.877
  970    H    GLU 129             H      GLU 129  -4.984  14.911  -5.759
  971    HA   GLU 129            HA      GLU 129  -5.298  16.765  -3.471
  972   1HB   GLU 129           2HB      GLU 129  -6.450  16.586  -6.251
  973   2HB   GLU 129           1HB      GLU 129  -7.124  17.704  -5.064
  974   1HG   GLU 129           2HG      GLU 129  -4.155  17.665  -5.481
  975   2HG   GLU 129           1HG      GLU 129  -5.168  18.486  -6.669
  976    H    MET 130             H      MET 130  -7.082  14.159  -5.051
  977    HA   MET 130            HA      MET 130  -9.607  14.356  -3.711
  978   1HB   MET 130           2HB      MET 130  -8.614  12.763  -5.682
  979   2HB   MET 130           1HB      MET 130  -8.426  11.652  -4.340
  980   1HG   MET 130           2HG      MET 130 -10.926  12.130  -3.829
  981   2HG   MET 130           1HG      MET 130 -10.989  12.858  -5.452
  982   1HE   MET 130           2HE      MET 130 -12.614  10.689  -4.197
  983   2HE   MET 130           1HE      MET 130 -13.008  10.689  -5.914
  984   3HE   MET 130           3HE      MET 130 -12.591   9.173  -5.099
  985    H    ALA 131             H      ALA 131  -6.609  12.631  -2.929
  986    HA   ALA 131            HA      ALA 131  -7.475  11.717  -0.290
  987   1HB   ALA 131           1HB      ALA 131  -4.802  11.645  -1.747
  988   2HB   ALA 131           3HB      ALA 131  -5.048  11.010  -0.109
  989   3HB   ALA 131           2HB      ALA 131  -5.920  10.300  -1.468
  990    H    SER 132             H      SER 132  -6.039  14.607  -1.620
  991    HA   SER 132            HA      SER 132  -4.562  15.460   0.671
  992   1HB   SER 132           2HB      SER 132  -4.520  17.623  -0.299
  993   2HB   SER 132           1HB      SER 132  -4.588  16.548  -1.681
  994    HG   SER 132            HG      SER 132  -6.104  18.441  -1.550
  995    H    HIS 133             H      HIS 133  -8.021  15.399  -0.174
  996    HA   HIS 133            HA      HIS 133  -8.753  16.956   2.225
  997   1HB   HIS 133           2HB      HIS 133 -10.229  16.823   0.123
  998   2HB   HIS 133           1HB      HIS 133 -10.743  15.221   0.730
  999    HD1  HIS 133           HD1      HIS 133 -10.568  18.875   1.846
 1000    HD2  HIS 133           HD2      HIS 133 -12.518  15.331   2.858
 1001    HE1  HIS 133           HE1      HIS 133 -12.246  19.470   3.652
 1002    H    LEU 134             H      LEU 134  -8.657  13.517   1.162
 1003    HA   LEU 134            HA      LEU 134  -9.715  12.547   3.713
 1004   1HB   LEU 134           2HB      LEU 134  -8.170  11.205   1.504
 1005   2HB   LEU 134           1HB      LEU 134  -8.707  10.351   2.956
 1006    HG   LEU 134            HG      LEU 134 -10.976  11.686   2.237
 1007   1HD1  LEU 134          3HD1      LEU 134  -9.348  11.244  -0.191
 1008   2HD1  LEU 134          2HD1      LEU 134 -11.071  10.904  -0.286
 1009   3HD1  LEU 134          1HD1      LEU 134 -10.514  12.510   0.169
 1010   1HD2  LEU 134          2HD2      LEU 134  -9.970   8.933   1.626
 1011   2HD2  LEU 134          1HD2      LEU 134 -11.158   9.426   2.829
 1012   3HD2  LEU 134          3HD2      LEU 134 -11.578   9.424   1.121
 1013    NH1  ARG 135           NH2      ARG 135  -0.884  14.314   6.002
 1014    NH2  ARG 135           NH1      ARG 135   0.121  12.293   5.936
 1015    H    ARG 135             H      ARG 135  -6.813  13.984   3.004
 1016    HA   ARG 135            HA      ARG 135  -5.291  12.634   5.143
 1017   1HB   ARG 135           2HB      ARG 135  -4.640  14.520   2.901
 1018   2HB   ARG 135           1HB      ARG 135  -3.623  14.568   4.338
 1019   1HG   ARG 135           2HG      ARG 135  -4.284  11.953   3.004
 1020   2HG   ARG 135           1HG      ARG 135  -2.959  12.959   2.416
 1021   1HD   ARG 135           2HD      ARG 135  -3.124  12.391   5.349
 1022   2HD   ARG 135           1HD      ARG 135  -2.526  11.124   4.277
 1023    HE   ARG 135            HE      ARG 135  -0.963  13.103   3.453
 1024   1HH1  ARG 135          1HH2      ARG 135  -1.523  14.978   5.612
 1025   2HH1  ARG 135          2HH2      ARG 135  -0.377  14.540   6.835
 1026   1HH2  ARG 135          2HH1      ARG 135   0.255  11.405   5.495
 1027   2HH2  ARG 135          1HH1      ARG 135   0.617  12.514   6.776
 1028    NH1  ARG 136           NH1      ARG 136  -6.232  22.314   6.987
 1029    NH2  ARG 136           NH2      ARG 136  -8.367  21.596   7.184
 1030    H    ARG 136             H      ARG 136  -6.852  15.644   4.170
 1031    HA   ARG 136            HA      ARG 136  -6.352  16.973   6.718
 1032   1HB   ARG 136           2HB      ARG 136  -8.015  17.649   4.292
 1033   2HB   ARG 136           1HB      ARG 136  -7.999  18.655   5.738
 1034   1HG   ARG 136           2HG      ARG 136  -5.311  17.935   4.739
 1035   2HG   ARG 136           1HG      ARG 136  -6.252  18.936   3.630
 1036   1HD   ARG 136           2HD      ARG 136  -5.573  19.559   6.517
 1037   2HD   ARG 136           1HD      ARG 136  -5.007  20.412   5.082
 1038    HE   ARG 136            HE      ARG 136  -7.690  20.734   4.834
 1039   1HH1  ARG 136          2HH1      ARG 136  -5.346  22.279   6.525
 1040   2HH1  ARG 136          1HH1      ARG 136  -6.370  22.937   7.758
 1041   1HH2  ARG 136          1HH2      ARG 136  -9.118  21.014   6.869
 1042   2HH2  ARG 136          2HH2      ARG 136  -8.501  22.204   7.965
 1043    H    SER 137             H      SER 137  -8.326  14.491   5.691
 1044    HA   SER 137            HA      SER 137 -10.759  15.167   7.127
 1045   1HB   SER 137           2HB      SER 137 -11.551  13.054   6.294
 1046   2HB   SER 137           1HB      SER 137 -10.575  13.708   5.003
 1047    HG   SER 137            HG      SER 137  -9.884  11.741   6.923
 1048    H    GLN 138             H      GLN 138  -7.650  13.674   7.791
 1049    HA   GLN 138            HA      GLN 138  -6.733  12.966   9.840
 1050   1HB   GLN 138           2HB      GLN 138  -9.003  14.497  10.659
 1051   2HB   GLN 138           1HB      GLN 138  -9.030  13.010  11.604
 1052   1HG   GLN 138           2HG      GLN 138  -6.581  13.407  12.133
 1053   2HG   GLN 138           1HG      GLN 138  -6.740  14.989  11.375
 1054   1HE2  GLN 138          2HE2      GLN 138  -7.397  15.909  14.807
 1055   2HE2  GLN 138          1HE2      GLN 138  -6.136  15.718  13.688
 1056    OH   TYR 139            OH      TYR 139 -14.984   9.139   9.512
 1057    H    TYR 139             H      TYR 139  -8.144  11.252   7.887
 1058    HA   TYR 139            HA      TYR 139  -9.165   9.054   9.614
 1059   1HB   TYR 139           2HB      TYR 139  -9.532   9.825   6.760
 1060   2HB   TYR 139           1HB      TYR 139  -9.448   8.096   7.099
 1061    HD1  TYR 139           HD2      TYR 139 -10.738   7.490   9.454
 1062    HD2  TYR 139           HD1      TYR 139 -11.703  10.684   6.748
 1063    HE1  TYR 139           HE2      TYR 139 -13.058   7.524  10.325
 1064    HE2  TYR 139           HE1      TYR 139 -14.026  10.719   7.621
 1065    HH   TYR 139            HH      TYR 139 -15.556   8.769   8.836
   
   
  No H/Q in entry =        1065